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   15
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   15
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   15
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   15
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   15
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   15
   -420.44854022
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   15
   -420.44478982
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   15
   -420.44310648
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   15
   -420.44727709
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   15
   -420.45936583
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C   -0.71506129    0.86819039   -0.01595527    0.07465070    0.15136412   -0.00135724
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C    1.76005968    1.30429986   -0.21399070    0.04240357    0.02844464   -0.02274042
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   15
   -420.47338756
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C   -0.78391440   -0.74039381   -0.10912654    0.03299632    0.03823898    0.00103369
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   15
   -420.48032513
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O   -2.03615813   -1.29997132   -0.10622126   -0.07975504   -0.06401175    0.00268981
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C    1.77390826    1.30718224   -0.20855340    0.05059123   -0.00461392   -0.00875109
C    1.65979616   -1.20012524    0.22584751    0.02460397    0.00885769    0.01418664
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   15
   -420.47935373
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O   -2.02253786   -1.28185404   -0.11214080   -0.06560672   -0.04856829    0.00304552
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C    1.66899324   -1.19934075    0.23553138    0.02655799    0.01752232    0.01420512
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   15
   -420.47457258
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O   -2.00595897   -1.26154840   -0.11820340   -0.04655303   -0.02906678    0.00466914
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C   -0.75824621   -0.81323344   -0.16976768    0.09561793   -0.04077511   -0.02619367
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   15
   -420.46839298
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O   -1.98729075   -1.23993704   -0.12448275   -0.02134436   -0.00611741    0.00754878
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C    1.77290816    1.31476823   -0.19729325    0.02786680   -0.02009099    0.00734345
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   15
   -420.46208837
H   -2.52403721    0.20246478    0.32831915   -0.00916630   -0.01868386    0.02304450
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O   -1.96768432   -1.21805762   -0.13110694    0.01192048    0.01937393    0.01105892
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C    1.76828354    1.31979811   -0.19406272    0.01075697   -0.00710069    0.00969593
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   15
   -420.45587803
H   -2.54502972    0.27114284    0.35158294   -0.00221370   -0.01344985    0.01947815
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O   -1.94865373   -1.19706169   -0.13823159    0.05433141    0.04594127    0.01418723
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C   -0.77740459   -0.86603645   -0.21620583    0.01129232   -0.08089897   -0.05098581
C    0.46225358    1.59141810    0.03840693    0.17636340   -0.02950229   -0.02890331
C    0.30378390   -1.71675592    0.05286388   -0.10147631   -0.02920815   -0.00578367
C    1.76300330    1.32524176   -0.19141129   -0.00530112    0.00901374    0.01058844
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C    2.28961557    0.07541890   -0.07466056    0.00145587    0.03863032   -0.00696501
H    3.33050145   -0.07206345   -0.25006156   -0.01894780   -0.00560282   -0.00102410
   15
   -420.44929283
H   -2.56489523    0.34857517    0.36111695    0.01233128    0.00683676    0.01106395
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O   -1.93211168   -1.17814432   -0.14599535    0.10251766    0.07080875    0.01607032
C   -0.82149671    0.74225490    0.09020610   -0.08967905   -0.00644495    0.03526085
C   -0.78840566   -0.87471070   -0.22613158   -0.04538714   -0.08840512   -0.05575668
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   15
   -420.44350775
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   15
   -420.44256504
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   15
   -420.44699089
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   15
   -420.45100583
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   15
   -420.45220716
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   15
   -420.45155242
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   15
   -420.44988550
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   15
   -420.44591846
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   15
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   15
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   15
   -420.45086478
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H    2.32945188   -2.08151031    0.56416711   -0.02596143   -0.00528529    0.00011976
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   15
   -420.46009500
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C   -0.71379386   -0.77521861   -0.09427120    0.09728164    0.06810467    0.00706172
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   15
   -420.47194796
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O   -2.04628630    1.35120208    0.26176404   -0.00869050    0.06817078    0.01541451
O   -1.97381445   -1.19997456   -0.31168149   -0.08517796   -0.00514998   -0.01758221
C   -0.72887789    0.65422339    0.06553635    0.09912319   -0.00368402   -0.01481856
C   -0.72800567   -0.78203133   -0.07300474    0.08769599    0.05073130    0.01518547
C    0.17522673    1.57634876   -0.04519458   -0.10373361   -0.01375276    0.01304757
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C    1.76929464   -1.26638643    0.21128973    0.02344883    0.01606404    0.00468405
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H    2.40468863   -2.12979798    0.57841181   -0.00041377   -0.02952857    0.01380265
C    2.30165093    0.05564385   -0.10703356   -0.02691360    0.07010231   -0.02078883
H    3.41416018   -0.04728260   -0.12062319    0.01538096   -0.01970540    0.00339636
   15
   -420.48349874
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O   -1.95975356   -1.20726496   -0.32475132   -0.06290887    0.00114725   -0.01874075
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C   -0.74748355   -0.79188488   -0.05264818    0.07056006    0.02787954    0.02159783
C    0.19135935    1.58014284   -0.05492976   -0.05167777   -0.00861141    0.00965770
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C    1.63915365    1.21685526   -0.16265728    0.02358748   -0.05534811   -0.00055359
C    1.78833258   -1.27360151    0.20337913    0.03952398    0.01171700    0.00443594
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H    2.44725055   -2.12590349    0.57293572    0.00672009   -0.02915596    0.01578817
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   15
   -420.48951879
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O   -1.94287194   -1.21462180   -0.33698360   -0.03168397    0.01129057   -0.01650019
C   -0.78728751    0.67337691    0.06125636    0.00704993   -0.01781617   -0.01716259
C   -0.77118041   -0.80340594   -0.03358331    0.04372347    0.00127216    0.02510278
C    0.21061835    1.58442056   -0.06524173    0.00040015    0.00370063    0.00483578
C    0.42622953   -1.64558850    0.12344896   -0.04346829   -0.02308548   -0.02377030
C    1.61714619    1.21257018   -0.15861148    0.00849278   -0.04602022    0.00133336
C    1.80498726   -1.28148220    0.19518980    0.05425887   -0.00118043    0.00626279
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C    2.29664788    0.03154866   -0.10281301   -0.00179128    0.03929075   -0.01925980
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   15
   -420.48569126
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O   -1.97242459    1.34916368    0.28210828   -0.00371718    0.02224758    0.00639280
O   -1.92458628   -1.22250596   -0.34848357    0.00834191    0.02540250   -0.00990745
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C   -0.79746649   -0.81499440   -0.01601619    0.00599897   -0.02721937    0.02452589
C    0.22988798    1.58846722   -0.07584281    0.04555324    0.01770468   -0.00066493
C    0.41598730   -1.61947776    0.12876349   -0.05324325   -0.01389885   -0.02428993
C    1.59464645    1.21104405   -0.15464737   -0.01084740   -0.03181261    0.00343075
C    1.81836548   -1.28926335    0.18661454    0.06791192   -0.01954726    0.00945653
H   -0.45837440    2.53775865   -0.11924468   -0.06285952    0.00808911    0.00129541
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H    2.51744064   -2.06310244    0.52980295    0.00494529   -0.00400708    0.00896418
C    2.29478845    0.01539010   -0.09891665    0.01048489    0.01498863   -0.01625117
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   15
   -420.47450606
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O   -1.90670062   -1.23155262   -0.35955023    0.05377341    0.04198020    0.00089395
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C   -0.82407031   -0.82493948    0.00009025   -0.04042217   -0.05508437    0.01955621
C    0.24646139    1.59144537   -0.08640366    0.07885697    0.03157705   -0.00618769
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C    1.57281948    1.21143563   -0.15089137   -0.03346639   -0.01628720    0.00564148
C    1.82764771   -1.29586536    0.17747047    0.07904295   -0.03706995    0.01192836
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H    2.54625032   -2.02192779    0.49691677   -0.00205027    0.01424666    0.00268368
C    2.29236263   -0.00165930   -0.09403904    0.00987104   -0.01251129   -0.01288688
H    3.35338957    0.08912192   -0.02598924   -0.01575471   -0.00839815    0.00480649
   15
   -420.46151964
H   -2.53089768    0.67894422   -0.05047606    0.04606605    0.01121545   -0.00315854
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O   -1.89124235   -1.24249770   -0.37066379    0.09554205    0.05675907    0.01320331
C   -0.86865075    0.70766252    0.06226594   -0.15994780    0.02536494   -0.00899634
C   -0.84822502   -0.83157417    0.01502674   -0.08727471   -0.07864409    0.01222779
C    0.25834993    1.59249907   -0.09659294    0.09551917    0.04837150   -0.01120127
C    0.40508507   -1.56598947    0.14397975   -0.04644778    0.02871232   -0.02973099
C    1.55302359    1.21281759   -0.14747590   -0.05739431   -0.00169926    0.00770104
C    1.83219145   -1.30027714    0.16762590    0.08178887   -0.04443860    0.01031367
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H    0.29152594   -2.59046255    0.49627108    0.01665078    0.00436343    0.00835280
H    2.17204050    2.10100486   -0.22462747   -0.01276147    0.00137165    0.00254736
H    2.57630044   -1.99061514    0.46194423   -0.00513365    0.02600663   -0.00109455
C    2.28939759   -0.01793836   -0.08838099   -0.00187368   -0.04259443   -0.00970775
H    3.36213359    0.14636815   -0.01125727   -0.00145926    0.00037534    0.00526392
   15
   -420.44793951
H   -2.54764907    0.65915536   -0.07660013    0.02132238   -0.01167068   -0.01731675
O   -1.90357780    1.33732156    0.29945362    0.14366764   -0.01798199    0.00685144
O   -1.88005370   -1.25598921   -0.38236114    0.11998295    0.06387070    0.02137981
C   -0.88081269    0.71769935    0.06403702   -0.19349257    0.04817821   -0.00216830
C   -0.86717004   -0.83349804    0.02921015   -0.12048287   -0.09312371    0.00767622
C    0.26454357    1.59060959   -0.10611018    0.09650299    0.06749680   -0.01508487
C    0.40402502   -1.54112843    0.15418812   -0.03218397    0.05056435   -0.03035064
C    1.53668980    1.21431024   -0.14452402   -0.07949494    0.01130238    0.00931292
C    1.83185874   -1.30207875    0.15718511    0.07110374   -0.03694283    0.00347796
H   -0.24515090    2.51080383   -0.13980828   -0.02010688   -0.04241623    0.00487813
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H    2.13979286    2.11687042   -0.23382419   -0.01462577    0.00506299    0.00162762
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C    2.28655140   -0.03164337   -0.08213565   -0.01496282   -0.07220482   -0.00658820
H    3.37195104    0.20324450   -0.00032585    0.01268270    0.01071737    0.00584865
   15
   -420.44062885
H   -2.57999037    0.64714355   -0.09057446   -0.00017390   -0.02517422   -0.02671122
O   -1.88984541    1.33469826    0.30493195    0.18362572   -0.02184126    0.01089317
O   -1.87420314   -1.27233236   -0.39499033    0.11680509    0.05888867    0.01959336
C   -0.88141574    0.72487312    0.06594826   -0.19853969    0.06114680    0.00284732
C   -0.87895826   -0.82985614    0.04288587   -0.12836019   -0.09453626    0.01158984
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C    0.40489657   -1.51928954    0.16621565   -0.01495996    0.06538770   -0.02774419
C    1.52513646    1.21512710   -0.14213235   -0.09612455    0.02270423    0.01030694
C    1.82727305   -1.30169148    0.14654365    0.05120266   -0.02053837   -0.00526805
H   -0.12501980    2.54194861   -0.15270602   -0.00387098   -0.04772000    0.00462815
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H    2.11796741    2.12907791   -0.24418169   -0.01467313    0.00894596    0.00049103
H    2.64062761   -1.98201120    0.39313177    0.01620016    0.01721009    0.00270030
C    2.28457959   -0.04101071   -0.07549129   -0.02211365   -0.09603828   -0.00357607
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   15
   -420.44590554
H   -2.61263924    0.65272174   -0.08569474   -0.01442199   -0.02963988   -0.02981713
O   -1.88431493    1.33304657    0.30992126    0.18958842   -0.02095973    0.01341907
O   -1.87355358   -1.29130274   -0.40846574    0.08783054    0.04218922    0.00671412
C   -0.87018619    0.72841746    0.06771315   -0.16914189    0.06077037    0.00284552
C   -0.88311184   -0.82056376    0.05581082   -0.11113368   -0.08276317    0.02515043
C    0.25971121    1.57490587   -0.12235583    0.08344849    0.03160981   -0.01458231
C    0.40667792   -1.50136278    0.17990744    0.00128163    0.07177272   -0.02236155
C    1.51935062    1.21458246   -0.14036079   -0.10356701    0.03172979    0.01066979
C    1.81958948   -1.30005570    0.13620961    0.03128694   -0.00516003   -0.01193076
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H    2.66028098   -1.99907471    0.35689352    0.02903579    0.00745421    0.00502941
C    2.28390133   -0.04462349   -0.06862823   -0.02046275   -0.10921706   -0.00103430
H    3.36067320    0.28772978    0.00886304    0.01714090    0.02508316    0.00556170
   15
   -420.45663445
H   -2.63538342    0.67924307   -0.05967344   -0.02032239   -0.02699742   -0.02723878
O   -1.88727071    1.33232572    0.31430508    0.16473443   -0.01525040    0.01480080
O   -1.87683910   -1.31216108   -0.42222153    0.04549921    0.01851628   -0.01254625
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C   -0.88061379   -0.80631219    0.06718991   -0.08002049   -0.06176392    0.04358245
C    0.24956693    1.56324430   -0.12911798    0.05285737   -0.01950258   -0.00961570
C    0.40840146   -1.48773602    0.19494201    0.01362048    0.07002314   -0.01501710
C    1.51976937    1.21213969   -0.13923207   -0.09938281    0.03670931    0.01055378
C    1.80998435   -1.29807147    0.12657929    0.01706194    0.00313624   -0.01511821
H    0.11956703    2.67999344   -0.18670380    0.01394004    0.02492497   -0.00050767
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H    2.65942333   -2.02169015    0.31714284    0.03536243    0.00064260    0.00557454
C    2.28441124   -0.04170003   -0.06169873   -0.00904642   -0.10866059    0.00074136
H    3.33648670    0.30521408    0.00733920    0.00530241    0.02549206    0.00454582
   15
   -420.46334394
H   -2.64430234    0.72459430   -0.01444916   -0.01240207   -0.01384700   -0.01775704
O   -1.89760920    1.33231477    0.31803574    0.11506116   -0.01439875    0.01128397
O   -1.88219062   -1.33385515   -0.43540880    0.00327326   -0.00646275   -0.03173917
C   -0.82101073    0.72516677    0.07111431   -0.03412227    0.03924178   -0.01052574
C   -0.87328128   -0.78834749    0.07594296   -0.04756788   -0.03619181    0.06022048
C    0.23632819    1.55268857   -0.13530411    0.00238608   -0.05746615   -0.00349568
C    0.40932756   -1.47830819    0.21087945    0.02078262    0.06112865   -0.00659875
C    1.52614601    1.20750117   -0.13874038   -0.08480529    0.03686423    0.01019056
C    1.79930965   -1.29623241    0.11784886    0.01030621    0.00263563   -0.01544748
H    0.23028175    2.73795794   -0.20425943    0.02949437    0.05095989   -0.00299557
H    0.02188727   -2.51122939    0.31921509   -0.01866144    0.00056593   -0.00038260
H    2.11422513    2.12027707   -0.27414776   -0.01378473    0.01156745   -0.00221516
H    2.63356459   -2.04502541    0.27346693    0.03392185   -0.00192511    0.00462108
C    2.28542714   -0.03227775   -0.05480959    0.01022673   -0.09372798    0.00159830
H    3.30895125    0.30463689    0.00255862   -0.01410285    0.02104362    0.00326249
   15
   -420.46171497
H   -2.64557999    0.77897142    0.04310081    0.01622950    0.01430032   -0.00109341
O   -1.91308676    1.33301746    0.32128545    0.04437678   -0.02862335    0.00010116
O   -1.88772210   -1.35526581   -0.44717250   -0.03086217   -0.02892292   -0.04668923
C   -0.79108076    0.71961695    0.07353094    0.04203076    0.02901292   -0.01840065
C   -0.86304216   -0.76820283    0.08108503   -0.02078208   -0.00874204    0.07083113
C    0.22297117    1.54552834   -0.14127834   -0.05335593   -0.07946421    0.00251400
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C    1.53762120    1.20065886   -0.13886506   -0.06413560    0.03179523    0.00984695
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   15
   -420.45499717
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   15
   -420.45482809
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   15
   -420.45475155
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   15
   -420.44336897
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   15
   -420.44065145
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   15
   -420.45800734
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C    0.25846962    1.55951196   -0.17923327   -0.04071311    0.04495034   -0.01850061
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   15
   -420.47139301
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   15
   -420.47258714
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O   -1.83310470   -1.43388944   -0.45171343   -0.04649688   -0.06366439   -0.02935559
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   15
   -420.46961982
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C   -0.81244135   -0.73648772   -0.04183460    0.03850103    0.04494985   -0.01054288
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   15
   -420.47081427
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O   -1.79170285   -1.42240590   -0.43308939    0.02729068   -0.01629601    0.00716789
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C    1.69976248    1.23296697   -0.18187282   -0.02589136    0.00422122   -0.00760304
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   15
   -420.46752756
H   -2.71036580    0.61805192    0.48920981   -0.01060887   -0.01935411    0.00708132
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O   -1.77193468   -1.41495783   -0.42382003    0.08745235    0.02198250    0.03135663
C   -0.84898339    0.74538385    0.15302046   -0.05063976    0.00364634    0.02951852
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C    0.34394434    1.54650996   -0.18842109    0.11404006   -0.02838602   -0.02244538
C    0.31213837   -1.54145594    0.32150625   -0.02534903   -0.01729631    0.02403230
C    1.71627320    1.25459302   -0.18873718   -0.02326517    0.02731437   -0.01307696
C    1.61428645   -1.20948137    0.07265451   -0.01498252   -0.00796627   -0.00952918
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H    2.42972935    2.05320608   -0.32234194    0.00328894   -0.01144271    0.00430015
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C    2.35902468   -0.00226060    0.03071604    0.05326662   -0.02184271    0.02448663
H    3.41022903   -0.10277245   -0.12504936   -0.01364255   -0.00492181   -0.00108638
   15
   -420.45306969
H   -2.70366096    0.55939442    0.51714274   -0.02237377   -0.04172329    0.01199223
O   -2.06334460    1.37642596    0.35033569    0.00808275    0.05633158   -0.00309533
O   -1.75615371   -1.40851558   -0.41597020    0.15194808    0.06202845    0.05447398
C   -0.86856329    0.76227794    0.15694069   -0.07337546    0.02532439    0.03245831
C   -0.83196428   -0.79941580   -0.10078760   -0.08847516   -0.09266014   -0.08549688
C    0.34433584    1.54984818   -0.18650990    0.09385634    0.00267060   -0.02569078
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   15
   -420.42729740
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O   -1.74719119   -1.40483571   -0.41055850    0.19611115    0.08823352    0.06869143
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   15
   -420.40730069
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O   -1.74695685   -1.40505304   -0.40820569    0.19628695    0.08697536    0.06789413
C   -0.89341319    0.79050940    0.15881325   -0.10399580    0.05275109    0.03508372
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   15
   -420.42244901
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O   -1.75546101   -1.40911812   -0.40888146    0.15302395    0.06010404    0.05354291
C   -0.89683925    0.80019993    0.15660252   -0.11004739    0.05625806    0.03552420
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C    0.32411708    1.54309223   -0.16925088    0.00412943    0.07274598   -0.03069223
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   15
   -420.43800670
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C   -0.89366870    0.80650831    0.15225258   -0.10446685    0.05576666    0.03412195
C   -0.79369594   -0.81069361   -0.11179994    0.00737276   -0.07143104   -0.05979584
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C    1.80518803    1.32566950   -0.20814188    0.04030043    0.06804737   -0.02090403
C    1.56567872   -1.17556441    0.07479676   -0.06822605    0.06158114   -0.00250650
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C    2.37677369   -0.06087943    0.03084550    0.02666086   -0.12601401    0.03763948
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   15
   -420.43740134
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O   -1.79032022   -1.42365604   -0.41654266    0.03165214   -0.01222462    0.01272644
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C   -0.77684070   -0.79891062   -0.10282737    0.06428999   -0.03983000   -0.03842599
C    0.30753787    1.51894180   -0.14897645    0.00886361   -0.07739987    0.01161224
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C    1.81875700    1.32915518   -0.20839731    0.05150298    0.07380727   -0.02043684
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   15
   -420.43604605
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O   -2.08743668    1.35333746    0.35401305   -0.03243236   -0.00123541    0.00839212
O   -1.81129826   -1.43092007   -0.42171263   -0.01215472   -0.03836865   -0.00403387
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C    0.29126359   -1.61200014    0.28794752   -0.04163470   -0.03038153    0.00659779
C    1.82921700    1.32819311   -0.20742171    0.06152200    0.07628373   -0.01896165
C    1.57073439   -1.18312342    0.07653735   -0.05611068    0.04310059   -0.01477830
H    0.02115503    2.75822918   -0.45157471   -0.01494918    0.06954402   -0.02547034
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C    2.37510720   -0.03687120    0.01494565    0.07695910   -0.11102644    0.03008235
H    3.38963421   -0.17921854   -0.09529677   -0.04401675    0.00405298    0.00171545
   15
   -420.43771869
H   -2.67872519    0.55627825    0.57015061   -0.01168104   -0.02084812    0.01248614
O   -2.08742249    1.35004174    0.35346051   -0.01170083    0.03397519    0.00018419
O   -1.83177991   -1.43647547   -0.42671467   -0.04136654   -0.05599211   -0.01681281
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C    0.28987941    1.51103555   -0.13092792   -0.04219775   -0.10962608    0.02724163
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C    1.83596471    1.32265192   -0.20530658    0.06986367    0.07180291   -0.01602298
C    1.57860400   -1.19116053    0.07854831   -0.04053341    0.02620863   -0.02024716
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C    2.36809011   -0.01452294    0.00415437    0.06212317   -0.08416512    0.02841414
H    3.39197712   -0.19497375   -0.08072660   -0.03369948   -0.00064347    0.00074554
   15
   -420.44442464
H   -2.72696926    0.53961962    0.57060424   -0.03201153   -0.03627603    0.01804586
O   -2.08683059    1.34528444    0.35287793   -0.00265130    0.04898464   -0.00257175
O   -1.85042605   -1.43951468   -0.43096688   -0.05948897   -0.06709663   -0.02613053
C   -0.83297799    0.79835271    0.11770806    0.01144147    0.05361378    0.00573996
C   -0.75648778   -0.75505992   -0.06590902    0.11758268    0.02717939    0.00489269
C    0.28406587    1.51666735   -0.12417071   -0.06357875   -0.10994039    0.03015254
C    0.30814166   -1.62573627    0.27463210   -0.01931171   -0.04948619    0.00989590
C    1.83849571    1.31282587   -0.20223252    0.07652282    0.05586628   -0.01106629
C    1.58893525   -1.20079508    0.08177257   -0.02701566    0.01187600   -0.02362242
H    0.15991269    2.78910883   -0.43443233    0.00595695    0.07395808   -0.02719519
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C    2.35743767    0.01283163   -0.00834459    0.02354593   -0.04089764    0.02471180
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   15
   -420.45716800
H   -2.75302033    0.54812594    0.55838513   -0.03777602   -0.03530845    0.01814338
O   -2.08607551    1.33836695    0.35239513   -0.00525417    0.04704720   -0.00076033
O   -1.86640235   -1.43952658   -0.43404358   -0.06969757   -0.07358768   -0.03274467
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C   -0.76338796   -0.74212252   -0.05318744    0.10879615    0.04434242    0.01524241
C    0.28205324    1.52886316   -0.11921139   -0.07615152   -0.09230689    0.02773681
C    0.31871468   -1.62832365    0.26710951   -0.00253958   -0.04609859    0.00754734
C    1.83640381    1.29969232   -0.19850022    0.08217591    0.02592180   -0.00395034
C    1.60094825   -1.21119582    0.08642195   -0.02245633    0.00664657   -0.02631244
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C    2.34535457    0.04260012   -0.02231466   -0.01478803    0.01428920    0.01652190
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   15
   -420.46754877
H   -2.75279308    0.58114891    0.53337458   -0.02769492   -0.01870254    0.01359903
O   -2.08503335    1.32937279    0.35193275   -0.02115770    0.02930783    0.00481980
O   -1.87923850   -1.43621242   -0.43564229   -0.07390534   -0.07660704   -0.03728022
C   -0.79828398    0.77511675    0.09623312    0.04595990    0.03048768   -0.00552141
C   -0.77683333   -0.73185921   -0.04138399    0.09299406    0.05987142    0.02483629
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C    0.32944509   -1.62813459    0.25913545    0.01350444   -0.04024660    0.00418792
C    1.82934235    1.28505095   -0.19453589    0.08769458   -0.01566638    0.00449422
C    1.61435214   -1.22203695    0.09266893   -0.02420188    0.00876491   -0.03001804
H    0.28111854    2.62125814   -0.34250377    0.02731741    0.00397860   -0.01143888
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H    2.30020098   -2.04362366    0.30559745   -0.00619663   -0.00194865    0.00502635
C    2.33411669    0.07147724   -0.03726704   -0.04365914    0.07474156    0.00501014
H    3.45929106   -0.21138721   -0.03857604    0.03344953   -0.02535619    0.00262346
   15
   -420.45519164
H   -2.73385214    0.62649552    0.49881535    0.00235379    0.01636623    0.00529169
O   -2.08296057    1.31912056    0.35123924   -0.05516656   -0.00681491    0.01343962
O   -1.88874092   -1.42943397   -0.43555618   -0.07282721   -0.07646892   -0.04001960
C   -0.78467791    0.76031700    0.08584520    0.04931957    0.00756466   -0.00830004
C   -0.79587811   -0.72520363   -0.03107861    0.07217408    0.07268343    0.03359756
C    0.29172739    1.56538152   -0.11337336   -0.06527086    0.10472385   -0.00933438
C    0.33938088   -1.62550320    0.25090484    0.02521113   -0.03594182    0.00144883
C    1.81697914    1.27137134   -0.19084162    0.09252956   -0.05972726    0.01249475
C    1.62921217   -1.23340623    0.10073129   -0.02473209    0.01070803   -0.03365174
H    0.31629673    2.51897930   -0.28077268    0.03167051   -0.11571234    0.00990794
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H    2.35055190    2.19059140   -0.43998205   -0.00649666    0.00707406   -0.00712234
H    2.30015035   -2.08371934    0.38576672   -0.00019328   -0.01787984    0.01220189
C    2.32546283    0.09585657   -0.05251992   -0.06094326    0.13041346   -0.00701302
H    3.44953674   -0.18716977   -0.02660255    0.03210412   -0.02657078    0.00517951
   15
   -420.44262170
H   -2.71711020    0.65976993    0.46033448    0.03814997    0.05369750   -0.00087543
O   -2.07835935    1.30919681    0.34994454   -0.09316630   -0.04554945    0.01945207
O   -1.89495990   -1.41919988   -0.43366161   -0.06609510   -0.07256639   -0.04077429
C   -0.77404013    0.74505909    0.07595710    0.04964847   -0.01521437   -0.01061822
C   -0.81926815   -0.72291900   -0.02279728    0.04733234    0.08047546    0.04074994
C    0.30278541    1.57824930   -0.11039419   -0.04820580    0.18241201   -0.01665525
C    0.34782324   -1.62068265    0.24257917    0.03072589   -0.03467657    0.00017200
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C    1.64554258   -1.24539704    0.11081713   -0.02040536    0.00759359   -0.03500211
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   15
   -420.47021353
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O   -1.89820613   -1.40569181   -0.42992683   -0.05233368   -0.06370088   -0.03885821
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   15
   -420.48452432
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   15
   -420.47732700
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O   -1.89871735   -1.37076822   -0.41746851    0.00399151   -0.02607010   -0.02285782
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C    2.31918847    0.10279805   -0.10509227    0.03563352    0.11931123   -0.02222239
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   15
   -420.46709385
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O   -1.89854246   -1.35106061   -0.40947500    0.04743075    0.00264500   -0.00789161
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C   -0.92143167   -0.75858270   -0.01520723   -0.11094455    0.01471605    0.02684951
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C    1.68484478    1.27067385   -0.18694537   -0.04442077   -0.00131652    0.01410379
C    1.71700417   -1.28968985    0.16926116    0.02707140   -0.06582525    0.00043185
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   15
   -420.45961520
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C   -0.76380902    0.69687231    0.03898975    0.02700073   -0.04644658   -0.01986273
C   -0.93718616   -0.77374271   -0.01865785   -0.16020986   -0.02081938    0.01233165
C    0.36964794    1.58561398   -0.08710170    0.12540495   -0.06507617   -0.02052564
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C    1.65606535    1.27860786   -0.18911744   -0.09102434    0.03182802    0.01331949
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   15
   -420.46016114
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O   -1.90670779   -1.31332346   -0.39315759    0.12620986    0.05308665    0.02026345
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C   -0.94333319   -0.78768250   -0.02287262   -0.19294765   -0.04867006    0.00150551
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C    1.63270907    1.28466399   -0.19209483   -0.12131473    0.05567240    0.01244528
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H    2.37461665   -2.02865617    0.63899248   -0.01457001    0.01666401    0.00410896
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   15
   -420.46911605
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C   -0.93798096   -0.79876317   -0.02722933   -0.19241902   -0.06016225    0.00052812
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C    0.36797586   -1.53395047    0.18467643   -0.00120317    0.03886030   -0.01565645
C    1.61655563    1.28740998   -0.19581743   -0.12528435    0.06814203    0.01010878
C    1.75855216   -1.28966721    0.21671882    0.02176092   -0.05708522    0.00888037
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H    2.42591386   -2.03372899    0.64982027    0.00187388    0.00400589    0.01095988
C    2.30906382    0.00345526   -0.13577147   -0.02568421   -0.03571331   -0.02111382
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   15
   -420.47386958
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O   -1.93602644   -1.28422922   -0.37987752    0.09951838    0.04479810    0.01093229
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C   -0.92117722   -0.80628569   -0.03166914   -0.15565858   -0.05603844    0.00942644
C    0.34448278    1.62269337   -0.06139657    0.10673688    0.05667188   -0.01401773
C    0.36877137   -1.52174996    0.17813370   -0.00849093    0.05109707   -0.01823649
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C    1.76915062   -1.28168840    0.23130878    0.01485697   -0.03605694    0.00542959
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   15
   -420.46340274
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O   -1.95799969   -1.27294899   -0.37417254    0.05082750    0.02482561   -0.00342770
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C   -0.89507009   -0.81045252   -0.03669716   -0.09690643   -0.04519039    0.02197908
C    0.32090170    1.63353733   -0.05056885    0.02180706    0.18415809    0.01388243
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C    2.30980682   -0.04298542   -0.14310983   -0.00851164   -0.08727797   -0.01045096
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   15
   -420.47135921
H   -2.55456200    0.53016932   -0.02309492    0.00870768   -0.00095314   -0.01083837
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O   -1.98227845   -1.26279950   -0.36832174    0.00145242    0.00574301   -0.01544794
C   -0.78447388    0.70649173    0.02941315   -0.04966053    0.01943176   -0.01022136
C   -0.86311827   -0.81187457   -0.04303986   -0.03452082   -0.03635464    0.03184096
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C    1.60683568    1.27196102   -0.20936134   -0.03406148    0.03921154   -0.00778225
C    1.78753876   -1.26026556    0.25949555    0.02204567   -0.00366223    0.00728770
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H    2.53383022   -2.03853496    0.62439831    0.02770482   -0.01256366    0.01390439
C    2.31125775   -0.05902374   -0.14565705    0.02362132   -0.09526900   -0.00565110
H    3.32535895    0.28059329   -0.15162142   -0.02185585    0.02377257   -0.00056791
   15
   -420.47854352
H   -2.56717905    0.49193827   -0.07506120   -0.01273583   -0.01697671   -0.02237796
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O   -2.00666115   -1.25292948   -0.36178982   -0.03826210   -0.00842813   -0.02235483
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C   -0.82903667   -0.81107150   -0.05128165    0.01985655   -0.03254211    0.03653070
C    0.27108869    1.62509663   -0.03123356   -0.00246712    0.04713943   -0.00492919
C    0.37646457   -1.50380330    0.16519492   -0.03595815    0.04034420   -0.01736641
C    1.61047443    1.26083065   -0.21347331   -0.00868798    0.02008415   -0.01391690
C    1.79489878   -1.24876309    0.27298167    0.03536860    0.00407403    0.01233417
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H    2.28905829    2.12301169   -0.17950445   -0.00161046    0.00736207    0.00816512
H    2.53409988   -2.02366120    0.59434041    0.02162991   -0.00523237    0.00783389
C    2.31122247   -0.06935338   -0.14784848    0.06450595   -0.09375012   -0.00348462
H    3.27598927    0.22735458   -0.17620287   -0.07183088    0.00655302    0.00096995
   15
   -420.46132475
H   -2.57137154    0.46517169   -0.11130501   -0.02179291   -0.02033887   -0.02748974
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O   -2.02935005   -1.24269786   -0.35426157   -0.06686919   -0.01709744   -0.02454117
C   -0.77859749    0.70918156    0.03117264   -0.04100861    0.04890646   -0.00539396
C   -0.79609392   -0.80828397   -0.06170936    0.06197831   -0.03193713    0.03655152
C    0.24678141    1.61297508   -0.02179955   -0.02036528   -0.02198772   -0.01493076
C    0.38262720   -1.50335614    0.16306041   -0.04145684    0.03296901   -0.01664206
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   15
   -420.44454871
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   15
   -420.43376307
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   15
   -420.43220805
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   15
   -420.44151392
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   15
   -420.45547742
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   15
   -420.45693415
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   15
   -420.45350828
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O   -2.06817598   -1.14898841   -0.27669094   -0.10967473    0.00326630    0.00069402
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   15
   -420.46990406
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O   -2.05320549   -1.13414558   -0.26406835   -0.09429929    0.01335697    0.00598320
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C   -0.73714541   -0.75137429   -0.19216276    0.05963028    0.06291842   -0.02892160
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C    1.58680213    1.19747262   -0.19696233   -0.02325513   -0.05892061    0.00384964
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   15
   -420.46814626
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C    0.25634192    1.56246846    0.07709324   -0.03117150   -0.01523902    0.00644723
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C    2.31865190    0.06914187   -0.15763246    0.11308468    0.05812944   -0.05521440
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   15
   -420.46191773
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C   -0.77319851   -0.75581757   -0.21878127    0.00457359    0.05532311   -0.04641024
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   15
   -420.45745877
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O   -1.98763602   -1.09595492   -0.22882602    0.01187071    0.06450181    0.02167270
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C    1.57497692    1.22483732   -0.18344274   -0.12350456   -0.02128183    0.03835279
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C    2.31011292    0.08897810   -0.14076642    0.01637298    0.07977274   -0.02097354
H    3.34674175   -0.09598196   -0.49040074    0.01091107   -0.02043347   -0.00806733
   15
   -420.45230380
H   -2.59362347    0.35839982    0.18502899   -0.00258696   -0.00205414    0.00625571
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O   -1.96425333   -1.08790926   -0.21874013    0.07218591    0.08613216    0.02470463
C   -0.74105949    0.62751142    0.06767591    0.00351387   -0.08049556    0.00366466
C   -0.80941281   -0.77281511   -0.23425874   -0.09351128    0.00850789   -0.05933295
C    0.34088710    1.51606316    0.09986058    0.11474179   -0.09186896   -0.00702299
C    0.41849679   -1.63778326    0.15669971    0.04950208   -0.01664644    0.01990772
C    1.58348091    1.23784965   -0.18271559   -0.13415964    0.00115363    0.04173845
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   15
   -420.44906174
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   15
   -420.45462372
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O   -1.93003204   -1.08434115   -0.20194440    0.17366758    0.11526259    0.02474189
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   15
   -420.45961906
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C    2.29022150    0.07888392   -0.09900278   -0.03847798    0.01298494    0.02705623
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   15
   -420.45193518
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C    1.68370982    1.27793751   -0.20023439    0.00222536    0.02784498    0.00897545
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   15
   -420.46108741
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C    1.71487406    1.28285300   -0.20715524    0.03913927    0.00653756    0.00712206
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   15
   -420.45769786
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O   -1.94293316   -1.13488159   -0.18119455    0.02022008    0.05269315    0.01536799
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C   -0.74829843   -0.79860193   -0.19432040    0.04182539   -0.04380426   -0.04341543
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C    1.74370567    1.28735073   -0.21450257    0.06900879   -0.01056159    0.00459378
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   15
   -420.44684606
H   -2.60831824    0.24677245    0.24810258   -0.02959888   -0.02259317    0.01814142
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O   -1.95461712   -1.15597667   -0.17811751   -0.02321327    0.03109110    0.01070831
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C    1.76840943    1.29243780   -0.22211493    0.08983761   -0.01789576   -0.00045376
C    1.66446318   -1.19205754    0.20311720    0.03671009    0.00284027   -0.00348356
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C    2.28754092    0.05099053   -0.07415491    0.02698197   -0.02521499    0.01736384
H    3.23509152    0.24025522   -0.40361938   -0.06939977    0.03133133    0.00630072
   15
   -420.44122046
H   -2.56081271    0.25923705    0.21523017   -0.01150767   -0.00664384    0.01364453
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C   -0.76668174    0.77552429    0.07884333    0.01347453    0.08044197    0.02011701
C   -0.70766594   -0.78515453   -0.15637175    0.13767444   -0.03481379   -0.02000798
C    0.34908180    1.49366009    0.16034418   -0.01010525   -0.13659482    0.02041396
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C    1.65549193   -1.19782548    0.18967240    0.02949533    0.00134381   -0.00858347
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C    2.28206965    0.04665755   -0.06980856   -0.03103631   -0.03430501    0.03539141
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   15
   -420.43893084
H   -2.50543068    0.27591905    0.17257930    0.01295002    0.01794219    0.00849706
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O   -1.97358328   -1.20159058   -0.17321263   -0.07302230   -0.00306103    0.00181307
C   -0.76943949    0.78181316    0.07501610    0.00742166    0.07817648    0.01789508
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C    0.34391068    1.50370421    0.16407096   -0.01475815   -0.13379325    0.02092467
C    0.31313881   -1.66283671    0.08528455   -0.08759513    0.00113116   -0.02066523
C    1.80093724    1.30538422   -0.23669813    0.10710534    0.00321325   -0.02068785
C    1.64481085   -1.20370764    0.17677405    0.00788035    0.00614226   -0.01887884
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C    2.27835579    0.04434479   -0.06753925   -0.06775551   -0.03313424    0.04168969
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   15
   -420.44443872
H   -2.45901071    0.28007170    0.12364481    0.03132856    0.03531497    0.00595080
O   -2.06403419    1.15639623    0.09173261   -0.04661865   -0.04355064   -0.01042728
O   -1.97859074   -1.22455689   -0.17098213   -0.08314705   -0.01631756   -0.00210688
C   -0.77262169    0.78340473    0.07011379   -0.00340853    0.06974968    0.01424240
C   -0.69869840   -0.76360641   -0.11348127    0.15332983   -0.01103643   -0.00069302
C    0.33960053    1.52178612    0.16653094   -0.01334291   -0.11967137    0.02172769
C    0.32611874   -1.65765642    0.07948530   -0.05358125    0.01115773   -0.02275806
C    1.80768621    1.31199945   -0.24245736    0.10920810    0.02478249   -0.03324828
C    1.63368890   -1.20995649    0.16501675   -0.02095181    0.01012591   -0.02910754
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H    2.23244974    2.18901705   -0.67505897   -0.02036465   -0.00620832   -0.00400682
H    2.35037638   -1.87968957    0.66971312    0.00562761    0.00637498    0.01560934
C    2.27861931    0.04399464   -0.06774631   -0.08064869   -0.02366024    0.03891560
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   15
   -420.46290326
H   -2.43409342    0.26056189    0.07030519    0.03314017    0.02518906    0.00516450
O   -2.06345534    1.16338525    0.08873095   -0.04015883   -0.02793869   -0.00936935
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C   -0.77560036    0.78080300    0.06435728   -0.01376341    0.05625583    0.00921379
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C    0.33609688    1.54701209    0.16767050   -0.01218461   -0.08586426    0.02396912
C    0.34228285   -1.65309230    0.07504204   -0.00843343    0.00953086   -0.02081459
C    1.80786162    1.31715835   -0.24623332    0.10484173    0.03789073   -0.04045886
C    1.62383414   -1.21678780    0.15499694   -0.04991926    0.00835461   -0.03491052
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H    2.27040926    2.18016655   -0.62611671   -0.02378076   -0.01706055    0.00088906
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C    2.28368251    0.04505031   -0.07028377   -0.07771613   -0.00911730    0.03132215
H    3.51866010   -0.00463376   -0.24292422    0.06475562    0.00555217   -0.01029592
   15
   -420.48198542
H   -2.43239469    0.22390337    0.01341036    0.02417805   -0.00115167    0.00196562
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O   -1.97727527   -1.26774524   -0.16607775   -0.08035572   -0.03883314   -0.00855411
C   -0.77777037    0.77482173    0.05804739   -0.01953868    0.03816627    0.00343164
C   -0.72548795   -0.73971843   -0.07034126    0.10396170    0.02754331    0.01446246
C    0.33339484    1.57720298    0.16733112   -0.02418715   -0.00578903    0.03251895
C    0.35894275   -1.64906008    0.07184400    0.03946683   -0.00105372   -0.01615196
C    1.80176139    1.32012795   -0.24760635    0.08792924    0.03167902   -0.03936547
C    1.61697215   -1.22409306    0.14705943   -0.07356475    0.00038791   -0.03494564
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C    2.29338209    0.04664599   -0.07470229   -0.06167461    0.00756208    0.02101088
H    3.50388494   -0.09694900   -0.17966279    0.05980241   -0.00842090   -0.00314008
   15
   -420.47594186
H   -2.44804358    0.18768653   -0.04474640    0.01374057   -0.02219056   -0.00372839
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O   -1.97107346   -1.28694933   -0.16311447   -0.06894724   -0.04708516   -0.01030638
C   -0.77878635    0.76655412    0.05152951   -0.01990294    0.01590681   -0.00226101
C   -0.74918065   -0.72966452   -0.04985749    0.06640665    0.04467751    0.02109572
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C    0.37325485   -1.64493210    0.06961685    0.07959734   -0.01801688   -0.01031967
C    1.79040509    1.32124234   -0.24661521    0.05902820    0.01376803   -0.03490298
C    1.61450277   -1.23140111    0.14120748   -0.08593933   -0.01171985   -0.02941356
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H    2.30237258   -1.98709261    0.59416055    0.00368785   -0.00780333    0.01766296
C    2.30672806    0.04779683   -0.08038555   -0.02873578    0.02157402    0.00958555
H    3.44706755   -0.18330969   -0.11418469    0.03747334   -0.02043394    0.00466083
   15
   -420.46818273
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O   -2.05320751    1.18654251    0.08141842   -0.00595443    0.04067639    0.00695511
O   -1.96176506   -1.30403389   -0.15969022   -0.05174007   -0.05077961   -0.01060960
C   -0.77861804    0.75732611    0.04514394   -0.01642355   -0.00661125   -0.00708601
C   -0.77687919   -0.72228572   -0.03064290    0.02673240    0.05650172    0.02638691
C    0.33436266    1.63009108    0.15925842   -0.05651035    0.17587229    0.06599168
C    0.38283636   -1.63969976    0.06801798    0.10339557   -0.03770461   -0.00536519
C    1.77550211    1.32149819   -0.24350280    0.02534203    0.00035076   -0.03224733
C    1.61714930   -1.23799467    0.13711165   -0.08224920   -0.02493660   -0.01941198
H    0.06256195    2.50031129    0.37567466    0.03580562   -0.15644878   -0.02857397
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H    2.27672250   -2.01277407    0.54144540   -0.00741176   -0.00129198    0.01109031
C    2.32169969    0.04769268   -0.08665824    0.02592576    0.02576158    0.00023928
H    3.36470332   -0.25539788   -0.05193451   -0.00825189   -0.02497496    0.01015668
   15
   -420.47269679
H   -2.50270626    0.17028814   -0.14848415   -0.00302671   -0.04089451   -0.01552257
O   -2.04865277    1.19160290    0.07872885    0.00182852    0.04529058    0.01237293
O   -1.95012777   -1.31883765   -0.15578914   -0.02953667   -0.04831316   -0.00973263
C   -0.77746165    0.74847563    0.03918118   -0.01187138   -0.02492644   -0.01079130
C   -0.80619808   -0.71829045   -0.01301381   -0.01229467    0.06163684    0.02963136
C    0.33964325    1.64296813    0.14981256   -0.01665332    0.07344703    0.03682410
C    0.38625566   -1.63221163    0.06676086    0.10932684   -0.05234515   -0.00377204
C    1.75905460    1.32167835   -0.23842718   -0.00604715   -0.00263168   -0.03212508
C    1.62469374   -1.24309619    0.13418115   -0.06369247   -0.03481966   -0.00773399
H    0.07289994    2.60782116    0.42870835    0.00479602   -0.03875296   -0.00006643
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H    2.51033718    2.18887668   -0.40976964    0.03082608    0.02539629   -0.00840458
H    2.25643469   -2.03765995    0.48074062   -0.01876063    0.00722222    0.00457948
C    2.33505224    0.04609763   -0.09297778    0.08845000    0.01781164   -0.00304529
H    3.28905784   -0.31017169    0.00340117   -0.06459787   -0.01941783    0.00939029
   15
   -420.46094972
H   -2.52965181    0.20298007   -0.18569252   -0.00893759   -0.04470086   -0.01953035
O   -2.04417893    1.19463024    0.07548254    0.00894063    0.04359767    0.01647019
O   -1.93716533   -1.33147327   -0.15144974   -0.00331120   -0.03950966   -0.00796485
C   -0.77557928    0.74110704    0.03386651   -0.00881159   -0.03803407   -0.01354621
C   -0.83478290   -0.71798683    0.00283462   -0.04943560    0.05954736    0.03060328
C    0.34602013    1.65116829    0.13810528    0.00980102    0.00355936    0.01088599
C    0.38312917   -1.62162890    0.06575437    0.10195111   -0.05320480   -0.00645706
C    1.74293251    1.32198190   -0.23140026   -0.02951503    0.00170769   -0.03366763
C    1.63606030   -1.24614008    0.13172965   -0.03917012   -0.03521071    0.00185780
H    0.07863179    2.74622755    0.48225813   -0.01131246    0.04302960    0.02416184
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H    2.54215407    2.16253663   -0.34184404    0.03661129    0.02222659   -0.00476771
H    2.24926993   -2.06742648    0.41652812   -0.02371555    0.01044601    0.00141524
C    2.34325830    0.04340017   -0.09912578    0.11213231    0.01488978   -0.00432252
H    3.25769381   -0.35065197    0.05212366   -0.08501936   -0.01906636    0.00662311
   15
   -420.45305492
H   -2.55036752    0.26747487   -0.20901873   -0.01109227   -0.04164818   -0.02046313
O   -2.04010109    1.19571149    0.07149862    0.01322800    0.03285433    0.01777561
O   -1.92406353   -1.34233567   -0.14675137    0.02578167   -0.02561967   -0.00552659
C   -0.77315328    0.73600793    0.02936562   -0.00776364   -0.04503208   -0.01521547
C   -0.86039360   -0.72124705    0.01684213   -0.08340233    0.05001215    0.02960714
C    0.35186667    1.65890416    0.12566935    0.02345153   -0.01709021   -0.00145455
C    0.37388515   -1.60790255    0.06514866    0.08469578   -0.03968929   -0.01116987
C    1.72853842    1.32215535   -0.22233517   -0.04161023    0.01159977   -0.03561271
C    1.64981438   -1.24711858    0.12918310   -0.01788151   -0.02330061    0.00820558
H    0.09168670    2.85678823    0.51930590   -0.01351141    0.07261851    0.03386739
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H    2.54813568    2.12063386   -0.27052902    0.03349875    0.01157369   -0.00035828
H    2.25856877   -2.10406359    0.35107714   -0.01879166    0.00324984    0.00174497
C    2.34497370    0.03970476   -0.10497218    0.08151021    0.02910988   -0.01257874
H    3.28419126   -0.37630823    0.09557040   -0.05285662   -0.03488244    0.01128812
   15
   -420.45210067
H   -2.56366010    0.36090995   -0.21800111   -0.00334711   -0.02070644   -0.01467487
O   -2.03658449    1.19536883    0.06673325    0.00669965    0.00402229    0.01223492
O   -1.91213433   -1.35204397   -0.14180425    0.05549185   -0.00958735   -0.00255234
C   -0.77025537    0.73360028    0.02577895   -0.00706587   -0.04571381   -0.01570214
C   -0.88098692   -0.72749866    0.02906590   -0.11188845    0.03390969    0.02726438
C    0.35631666    1.66758784    0.11329201    0.03232929   -0.01937254   -0.00761042
C    0.35956573   -1.59181007    0.06521225    0.05817619   -0.01928028   -0.01476941
C    1.71659323    1.32159428   -0.21112106   -0.04027692    0.02796769   -0.03659165
C    1.66467533   -1.24672323    0.12614604   -0.00147657   -0.00452306    0.01332873
H    0.11422981    2.91627149    0.53235300   -0.01132539    0.08062910    0.03670116
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H    2.53061618    2.07081976   -0.19890453    0.02006327   -0.00608571    0.00317935
H    2.28102564   -2.14263214    0.28435575   -0.00772010   -0.01062240    0.00237218
C    2.34181674    0.03426063   -0.11004456    0.03772158    0.04173280   -0.02352788
H    3.34809141   -0.37698170    0.13067511   -0.00801512   -0.04923030    0.01957093
   15
   -420.45089647
H   -2.57577416    0.46751225   -0.21713177    0.02407648    0.02733373    0.00237288
O   -2.03328121    1.19494757    0.06145911   -0.02279954   -0.05032848   -0.00499233
O   -1.90270925   -1.36130916   -0.13674160    0.08137518    0.00436435    0.00048475
C   -0.76694340    0.73393042    0.02313634   -0.00383650   -0.04101037   -0.01506795
C   -0.89485947   -0.73578256    0.03964294   -0.13105819    0.01420345    0.02449534
C    0.35883004    1.67741606    0.10136186    0.03736157   -0.01554621   -0.01095490
C    0.34176433   -1.57454945    0.06615619    0.02445616    0.00095906   -0.01585886
C    1.70702196    1.31931661   -0.19770611   -0.02714920    0.04886403   -0.03521055
C    1.67963609   -1.24604382    0.12230123    0.01271129    0.01237456    0.01864936
H    0.14484153    2.91819602    0.51914665   -0.00756704    0.07951351    0.03635805
H   -0.03034868   -2.63987345    0.12501535   -0.01925715   -0.01896836    0.00000488
H    2.49916243    2.02563637   -0.12941498   -0.00145311   -0.02746118    0.00421300
H    2.30906038   -2.17364733    0.21605635    0.00323877   -0.02310342    0.00096004
C    2.33631323    0.02636831   -0.11371639    0.00571130    0.03995955   -0.03040028
H    3.41858905   -0.34298461    0.15187890    0.02419548   -0.05115746    0.02495975
   15
   -420.45416921
H   -2.60552059    0.55472619   -0.21805787    0.05248945    0.06741088    0.01907457
O   -2.02891170    1.19678476    0.05641854   -0.05654275   -0.09494441   -0.02233701
O   -1.89693855   -1.37074862   -0.13169736    0.09717786    0.01207149    0.00255520
C   -0.76341829    0.73672076    0.02140009    0.00297005   -0.03233903   -0.01346752
C   -0.90087732   -0.74493190    0.04873500   -0.13591165   -0.00424423    0.02243105
C    0.35911172    1.68814304    0.09007587    0.03675454   -0.00255225   -0.01034811
C    0.32250020   -1.55732936    0.06804743   -0.01263622    0.01779317   -0.01458072
C    1.69909050    1.31411349   -0.18217250   -0.01394183    0.06355440   -0.03190693
C    1.69383112   -1.24607561    0.11733010    0.02612204    0.02200971    0.02365930
H    0.18078656    2.86350537    0.47998174   -0.00177242    0.06671767    0.03197376
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H    2.46851818    1.99981082   -0.06282272   -0.01870496   -0.04155596    0.00322480
H    2.33498885   -2.18843242    0.14718145    0.01048922   -0.02901001   -0.00233032
C    2.33040474    0.01612278   -0.11557373   -0.01437505    0.02551016   -0.03252695
H    3.47248700   -0.27273768    0.15533854    0.04259732   -0.04309380    0.02652637
   15
   -420.47256752
H   -2.66939717    0.59759651   -0.23092615    0.02628317    0.04567435    0.00942935
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O   -1.89552044   -1.38070226   -0.12676134    0.09803548    0.01101176    0.00257865
C   -0.76007880    0.74145680    0.02047583    0.01096290   -0.02168542   -0.01137141
C   -0.89876932   -0.75385145    0.05646211   -0.12211152   -0.01746141    0.02201374
C    0.35721307    1.69888015    0.07936625    0.02767401    0.04066317    0.00053495
C    0.30400077   -1.54116077    0.07081240   -0.04994148    0.02976236   -0.01166849
C    1.69207882    1.30516806   -0.16469878   -0.01480888    0.05894354   -0.03057619
C    1.70645079   -1.24739323    0.11093527    0.03864459    0.02263295    0.02726305
H    0.21774896    2.76258269    0.41838074    0.00843551    0.02212556    0.01738823
H    0.05025027   -2.64891438    0.04469822   -0.00706164   -0.02677571   -0.00399574
H    2.45014366    2.00268888    0.00131128   -0.01708528   -0.03613195    0.00441074
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C    2.32532262    0.00437455   -0.11548089   -0.02563259    0.00297342   -0.03121543
H    3.49636538   -0.17182962    0.13987474    0.04978155   -0.02871875    0.02505448
   15
   -420.47495737
H   -2.75063263    0.60843451   -0.25000852   -0.02632965    0.00714089   -0.01034168
O   -2.01396871    1.21194173    0.04872039    0.01198516   -0.03894015    0.00563500
O   -1.89849249   -1.39112385   -0.12193346    0.08363376    0.00169844    0.00031174
C   -0.75739597    0.74750622    0.02024023    0.01774833   -0.01126206   -0.00941853
C   -0.88937325   -0.76174358    0.06284880   -0.08920195   -0.02507564    0.02336199
C    0.35369085    1.70681956    0.06852750    0.00929524    0.14700225    0.02906761
C    0.28851335   -1.52676270    0.07427974   -0.08557835    0.03583660   -0.00809001
C    1.68601265    1.29274593   -0.14535524   -0.02514859    0.03737629   -0.03303874
C    1.71673861   -1.25003417    0.10290349    0.05010430    0.01420788    0.02852195
H    0.24824976    2.64977616    0.34539774    0.02452799   -0.08606583   -0.01461496
H    0.10074113   -2.62514139    0.00806624    0.00243859   -0.01705431   -0.00551060
H    2.44318266    2.03062458    0.06199585   -0.00111835   -0.01511991    0.00980999
H    2.36340673   -2.15856156    0.01727869    0.00988044   -0.01574679   -0.00919150
C    2.32174432   -0.00753405   -0.11351257   -0.02745509   -0.02338385   -0.02738416
H    3.48508665   -0.05046335    0.10653062    0.04525125   -0.01059272    0.02089951
   15
   -420.45812384
H   -2.81434841    0.61276957   -0.26228393   -0.05768305   -0.01086108   -0.02056619
O   -2.00618888    1.22306669    0.04494327    0.04027268   -0.02007927    0.01578293
O   -1.90521875   -1.40160472   -0.11711451    0.05848704   -0.01233262   -0.00334676
C   -0.75577806    0.75423725    0.02057504    0.02285688   -0.00076015   -0.00760678
C   -0.87465038   -0.76813426    0.06781877   -0.04288578   -0.02963758    0.02546961
C    0.34958741    1.70591057    0.05597900   -0.00437104    0.23100493    0.04532601
C    0.27818232   -1.51450257    0.07823827   -0.11720279    0.03619825   -0.00487412
C    1.68144111    1.27807590   -0.12401207   -0.03094780    0.01291832   -0.03583520
C    1.72400463   -1.25349742    0.09316121    0.05981556   -0.00139891    0.02694969
H    0.26141196    2.59855527    0.28236438    0.03436701   -0.17392492   -0.03445402
H    0.14950317   -2.58956075   -0.02467773    0.01162804    0.00038025   -0.00573784
H    2.43713085    2.06941890    0.11556234    0.01371144    0.00688462    0.01617313
H    2.36632455   -2.12336286   -0.03897656    0.00235392    0.00177036   -0.01000628
C    2.31976390   -0.01803562   -0.10989751   -0.01699442   -0.04824613   -0.02174542
H    3.44207760    0.07849062    0.05827849    0.02658348    0.00808372    0.01446641
   15
   -420.46798243
H   -2.83785536    0.62408175   -0.26024981   -0.06655245   -0.01430323   -0.02242168
O   -2.00016078    1.23515134    0.04047912    0.04829608   -0.01450058    0.01802549
O   -1.91458335   -1.41152417   -0.11214329    0.02911007   -0.02693270   -0.00713321
C   -0.75553632    0.76100303    0.02136895    0.02662922    0.01160410   -0.00566403
C   -0.85735138   -0.77273664    0.07125149    0.00690852   -0.03318922    0.02700166
C    0.34563180    1.69211969    0.04095859    0.00231001    0.13006800    0.01615200
C    0.27489804   -1.50442070    0.08249587   -0.14046858    0.03456097   -0.00242007
C    1.67869445    1.26259383   -0.10051676   -0.02752922   -0.00593036   -0.03582016
C    1.72767734   -1.25687016    0.08180016    0.06457537   -0.01787106    0.02328578
H    0.25119440    2.65991669    0.24097929    0.02404341   -0.08140458   -0.00954064
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   15
   -420.46956105
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   15
   -420.46020905
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C   -0.82644117   -0.77586390    0.07322483    0.07740318   -0.03205698    0.02601625
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   15
   -420.45208976
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O   -1.94569203   -1.43185728   -0.09480336   -0.04276625   -0.05594096   -0.01320115
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C    1.67692006    1.22088282   -0.01798186    0.02466899   -0.02354039   -0.01897851
C    1.71783165   -1.25986817    0.03974079    0.01152830   -0.00671439    0.02314558
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   15
   -420.45455073
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O   -1.95345576   -1.43403206   -0.08790929   -0.05586879   -0.06031176   -0.01336501
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C   -0.81283704   -0.77166263    0.06900758    0.08132539   -0.01180225    0.01977908
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C    1.67500607    1.20974330    0.01241968    0.04594577   -0.01452152   -0.00867269
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   15
   -420.47356205
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O   -1.98370787    1.31635077    0.01188518   -0.00209680   -0.02249181    0.00237464
O   -1.95870754   -1.43347715   -0.08041188   -0.06284403   -0.06283187   -0.01272466
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C   -0.81350049   -0.76813823    0.06500092    0.06475782    0.00078610    0.01472067
C    0.31670960    1.59675462   -0.03176299    0.01196224   -0.05636981   -0.01966718
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C    2.30499364   -0.00007967   -0.06888579   -0.03437348   -0.04746500    0.00279817
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   15
   -420.49200722
H   -2.60063531    0.51760559   -0.09514589   -0.01022732   -0.02658810   -0.00535221
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C   -0.78658250    0.77021366    0.03056776    0.00570446    0.03288773    0.00154050
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C    0.30842072    1.58664933   -0.04312535    0.00691248   -0.02906970   -0.02040090
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C    1.70319949   -1.25809974   -0.01487029   -0.07534849   -0.00679195    0.02314795
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   15
   -420.49341473
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O   -1.96066996   -1.42380201   -0.06375217   -0.05981200   -0.06187902   -0.00956056
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C   -0.82526005   -0.76177770    0.05469615    0.02262298    0.01636161    0.00204425
C    0.29976584    1.57803783   -0.05323403   -0.00877082    0.05024357   -0.02565866
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C    1.70523001   -1.25713660   -0.03599728   -0.08561450   -0.02126609    0.01728862
H    0.05519747    2.58746268   -0.13333675    0.00180005   -0.03577632    0.00115457
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H    2.34944909   -2.12030657   -0.24939182    0.00029721   -0.00600102   -0.00439251
C    2.30630363    0.03407474   -0.05352242   -0.04549653    0.01694778    0.01662903
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   15
   -420.47081766
H   -2.57248710    0.42406372   -0.03644773   -0.01393807   -0.05875135   -0.00049849
O   -1.97293942    1.37769533   -0.00575921    0.05570803    0.08173297    0.00473676
O   -1.95751295   -1.41473251   -0.05473220   -0.05116203   -0.05644790   -0.00729903
C   -0.80357630    0.75729879    0.03367172   -0.00465003    0.02476340    0.00383087
C   -0.83384105   -0.75987929    0.04915994    0.00369076    0.01839416   -0.00461226
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C    0.45980172   -1.53229195    0.10275695    0.13691457    0.02105484    0.01145044
C    1.63849690    1.17919841    0.13441637    0.00164744   -0.08954908    0.02364421
C    1.71233337   -1.25488463   -0.05815416   -0.07542452   -0.03601435    0.00837424
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C    2.31097142    0.05065747   -0.04713843   -0.03793602    0.04720601    0.02024297
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   15
   -420.46867559
H   -2.54252035    0.43681817   -0.00536137   -0.00349121   -0.05859057    0.00307530
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O   -1.95204981   -1.40311959   -0.04538216   -0.03844006   -0.04633689   -0.00474131
C   -0.81181022    0.74845867    0.03490776   -0.00940516    0.02102707    0.00389064
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C    0.28569791    1.54537382   -0.06762268   -0.02930357    0.12872922   -0.04585050
C    0.47311227   -1.54903423    0.10156645    0.13321579   -0.00619287    0.00951694
C    1.62563370    1.18097621    0.16262202   -0.02698152   -0.09373590    0.03400207
C    1.72391225   -1.25050195   -0.08081024   -0.04848069   -0.04128781   -0.00192482
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H    0.09153192   -2.53889706   -0.03002689   -0.00912051    0.02190478   -0.00497349
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C    2.31789221    0.06443698   -0.04195982   -0.02229056    0.06732326    0.02018166
H    3.34079687    0.06856951   -0.47362422    0.00579553   -0.00901956   -0.02291522
   15
   -420.47844647
H   -2.51043662    0.49103427    0.02358010    0.01392859   -0.04550216    0.00540752
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C   -0.85072999   -0.75933246    0.03927575   -0.02668663    0.01478289   -0.01541427
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C    1.61439171    1.18832819    0.18877679   -0.05321401   -0.07910555    0.04331284
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H    2.30097506    2.11435432    0.06946791    0.02222406    0.02353923   -0.00958616
H    2.30840774   -2.11990325   -0.24776713   -0.02872581    0.01215548    0.00549447
C    2.32614390    0.07420836   -0.03798736   -0.00327504    0.07494872    0.01730354
H    3.32549025   -0.04478169   -0.46814105   -0.00726063   -0.02564606   -0.01977229
   15
   -420.46742585
H   -2.48915028    0.57641965    0.04885450    0.04396416   -0.00615341    0.00387919
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O   -1.93668892   -1.37429082   -0.02615809   -0.00134810   -0.01447840    0.00041685
C   -0.82635319    0.72725592    0.03665118   -0.01483513    0.01030656    0.00529824
C   -0.85718998   -0.76047248    0.03557768   -0.04020371    0.01047153   -0.01889858
C    0.27669456    1.48836117   -0.07317814    0.02021988   -0.06024960    0.00518502
C    0.47706939   -1.58014102    0.09735241    0.08490324   -0.03771633    0.01379949
C    1.60631780    1.20040175    0.21232178   -0.06945341   -0.05172149    0.05063119
C    1.75390431   -1.23528144   -0.12523002    0.01183517   -0.00111438   -0.01864886
H   -0.08168596    2.57547842   -0.45673125   -0.02892062    0.04189323   -0.02832892
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H    2.33090592   -2.13600534   -0.25337879   -0.02057473   -0.00225342    0.00411624
C    2.33460846    0.07949998   -0.03505700    0.01291418    0.07202218    0.01351457
H    3.31526465   -0.13992642   -0.44838839   -0.01797699   -0.03797427   -0.01706013
   15
   -420.44618302
H   -2.50010329    0.66498984    0.07172924    0.08041832    0.04878234   -0.00340584
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O   -1.92847124   -1.35850562   -0.01651567    0.02212227    0.00337813    0.00237001
C   -0.83235990    0.71553367    0.03707319   -0.01050682    0.00479182    0.00670193
C   -0.86121536   -0.76224023    0.03301701   -0.05420384    0.00516236   -0.02126765
C    0.27095443    1.46290984   -0.07567386    0.01740968   -0.08702595    0.01496674
C    0.47053964   -1.59264536    0.09408709    0.05944048   -0.03323967    0.01675060
C    1.60236134    1.21555546    0.23282023   -0.06939608   -0.01477847    0.05484910
C    1.76872312   -1.22678576   -0.14598563    0.03434280    0.02779326   -0.02429601
H   -0.10097796    2.62478374   -0.52299396   -0.03159571    0.06113707   -0.03708930
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   15
   -420.43757225
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O   -1.92125768   -1.34286741   -0.00697764    0.04555845    0.01961430    0.00350161
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   15
   -420.44469661
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C   -0.85868345   -0.76645656    0.03182110   -0.07395747   -0.00115291   -0.02303627
C    0.25708705    1.42830296   -0.08352860   -0.00780144   -0.10175214    0.01880971
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   15
   -420.45565675
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C   -0.85098611   -0.76854164    0.03329415   -0.06922159    0.00141609   -0.02267827
C    0.25044504    1.42004168   -0.08912156   -0.02241124   -0.09044087    0.01299031
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C    1.61150922    1.25689215    0.27423598   -0.03110646    0.06715141    0.06083150
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   15
   -420.46357682
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C    0.24517500    1.41706024   -0.09542170   -0.04047540   -0.04021769   -0.00889419
C    0.42267869   -1.62722612    0.07062450   -0.03213555   -0.02024414    0.01646096
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   15
   -420.45238530
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O   -1.91862075   -1.29362950    0.02960855    0.05402740    0.03973151    0.00176471
C   -0.86267735    0.65705374    0.03293057   -0.00141384   -0.02433299    0.00754480
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C    0.24238208    1.41618099   -0.10105060   -0.06271652    0.06804883   -0.05390298
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C    1.62873711    1.26757512    0.28364052   -0.03648605    0.03733502    0.06879736
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C    2.36205770    0.04838555   -0.02690924    0.00042841   -0.03209948   -0.01563373
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   15
   -420.44593783
H   -2.93922402    0.97917062    0.14436575   -0.05720603   -0.00589218    0.01396500
O   -2.01540423    1.43072584   -0.06863455    0.03228631    0.03808840   -0.01140038
O   -1.92499219   -1.28578885    0.03846299    0.03462324    0.03533818    0.00059535
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C   -0.80780598   -0.77703375    0.04563028    0.00589116    0.02207173   -0.01750726
C    0.24327829    1.41149724   -0.10356543   -0.06514615    0.11098021   -0.06951601
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C    1.64059307    1.26901156    0.28220300   -0.02852682    0.02799574    0.06657452
C    1.79078752   -1.22844220   -0.23380484    0.06417719   -0.00067021   -0.03523903
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C    2.36418440    0.04262592   -0.02444429   -0.00428420   -0.05193475   -0.02339964
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   15
   -420.46045446
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C    0.24798341    1.40095479   -0.10218936   -0.04365785    0.00601356   -0.03052624
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C    1.65414256    1.26872143    0.27675544   -0.01409689    0.02527550    0.06111924
C    1.78057062   -1.23433152   -0.24133862    0.04556774   -0.01078787   -0.03399801
H    0.11987995    2.35769285   -0.43988678    0.02061734   -0.05475906    0.00780656
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C    2.36654700    0.03998312   -0.02057067   -0.00440106   -0.06689787   -0.02985418
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   15
   -420.44702705
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O   -2.03435369    1.42085795   -0.07733356   -0.13026779   -0.02641042    0.02311560
O   -1.94151005   -1.27471879    0.05615067   -0.00472984    0.02739473   -0.00208934
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C   -0.77787591   -0.78833637    0.05931473    0.06426874    0.02088014   -0.01115209
C    0.25535028    1.38986993   -0.09887708   -0.02440929   -0.07726314   -0.00378786
C    0.40241838   -1.63635819    0.03035038   -0.07484744   -0.04450671    0.01664651
C    1.66851520    1.26687953    0.26761830    0.00615312    0.02738958    0.05423755
C    1.76764953   -1.23960181   -0.24682531    0.01696968   -0.01437373   -0.03097024
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H    2.61193583   -1.90934300   -0.38734544    0.01430505    0.02193782    0.00002972
C    2.36914939    0.04134708   -0.01490693    0.00069487   -0.07398180   -0.03325020
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   15
   -420.43310180
H   -2.87625876    1.16744841    0.08647134    0.08473547    0.05750175   -0.01992405
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C   -0.76787480   -0.79594134    0.06726814    0.08348874    0.01355048   -0.00748962
C    0.26421503    1.38317195   -0.09524135   -0.00947950   -0.10496047    0.00430535
C    0.40793571   -1.63195675    0.01760405   -0.06639112   -0.02334104    0.00946707
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H    0.10478599    2.59201645   -0.44528337    0.00363950    0.06481055   -0.02492043
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C    2.37168861    0.04713251   -0.00725455    0.01002304   -0.07055939   -0.03219223
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   15
   -420.42975227
H   -2.95223636    1.15592711    0.09003294   -0.00971344    0.02965590   -0.00163207
O   -2.03536799    1.41371766   -0.08902150   -0.03093294    0.00146124    0.00343526
O   -1.95740323   -1.26871082    0.07422025   -0.02967068    0.02507459   -0.00489538
C   -0.88645231    0.63513433    0.01660920   -0.03954129   -0.04379101    0.00902829
C   -0.76287638   -0.80435236    0.07567350    0.09345075    0.00350336   -0.00361679
C    0.27365676    1.38270451   -0.09183853    0.00458622   -0.10808110    0.00642824
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C    1.74058424   -1.24736705   -0.25242215   -0.04036190   -0.02183648   -0.02315686
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H    0.35276754   -2.68612859    0.28115496    0.01539322   -0.00395159    0.01525045
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C    2.37361105    0.05712622    0.00231880    0.02144398   -0.05542438   -0.02600479
H    3.37901610    0.39916978    0.31248667   -0.01063766    0.04330204    0.01701369
   15
   -420.42576617
H   -3.02401038    1.12230077    0.09533063   -0.06611465    0.01215149    0.00889645
O   -2.03163622    1.41061237   -0.09551439    0.02716033    0.01504152   -0.00702631
O   -1.96358698   -1.26742967    0.08355640   -0.03528551    0.02602049   -0.00606446
C   -0.88580282    0.63881093    0.01159941   -0.04711424   -0.03708873    0.00768602
C   -0.76348292   -0.81296944    0.08429655    0.09404205   -0.00771660    0.00048042
C    0.28281894    1.38873182   -0.08881967    0.01895823   -0.10213253    0.00736252
C    0.42980373   -1.62040077   -0.00904564   -0.02244048    0.01946133   -0.00780460
C    1.70321708    1.24924544    0.22206937    0.07707535    0.04729154    0.03701886
C    1.72986098   -1.24939551   -0.25299916   -0.05970959   -0.02889443   -0.01955829
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H    2.58732430   -1.95545605   -0.44669306    0.03049717    0.00273356   -0.00709665
C    2.37424570    0.07041633    0.01344227    0.03084849   -0.02929139   -0.01545374
H    3.33589770    0.41911762    0.35963531   -0.03005880    0.04225882    0.01177398
   15
   -420.43591085
H   -3.05052442    1.07940300    0.09465954   -0.08274079    0.00359647    0.01198983
O   -2.02898953    1.40685406   -0.10171480    0.04578120    0.02055317   -0.01037871
O   -1.96818771   -1.26733258    0.09316702   -0.03609339    0.02786653   -0.00704607
C   -0.88231594    0.64472547    0.00612502   -0.05229357   -0.02931366    0.00629909
C   -0.76973118   -0.82111935    0.09288885    0.08550797   -0.01901769    0.00491893
C    0.29083892    1.40089629   -0.08624001    0.03226696   -0.08749954    0.00690909
C    0.44351729   -1.61576806   -0.02192402    0.00882196    0.02772908   -0.01396079
C    1.70727119    1.23809835    0.20202665    0.08248964    0.02049504    0.02482592
C    1.72270185   -1.24966676   -0.25238924   -0.06969003   -0.03785666   -0.01678897
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H    0.31325361   -2.70596501    0.22896933    0.00648143   -0.01920182    0.01964637
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H    2.53615518   -1.97958658   -0.45800742    0.02037250    0.00265489   -0.00671987
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   15
   -420.46043859
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O   -1.97117009   -1.26850140    0.10309684   -0.03175501    0.03012766   -0.00789569
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C   -0.78110894   -0.82812187    0.10118185    0.06860698   -0.02976212    0.00971897
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   15
   -420.47487436
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O   -1.97273103   -1.27103662    0.11338464   -0.02230289    0.03229299   -0.00866358
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C    0.30072866    1.43828952   -0.08198378    0.03004125    0.04118860   -0.00740753
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   15
   -420.46410042
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O   -1.97329669   -1.27503497    0.12406529   -0.00846418    0.03397009   -0.00935914
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C    0.30278823    1.45574136   -0.07949991    0.00806806    0.14007807   -0.00956554
C    0.47449205   -1.61049101   -0.05485009    0.07781194   -0.00426116   -0.01775197
C    1.69172219    1.20879758    0.13866351    0.04630763   -0.09713301   -0.04288873
C    1.72570406   -1.23476995   -0.24474605   -0.05009095   -0.04681805   -0.01324033
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   15
   -420.47109156
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O   -1.97348858   -1.28057182    0.13517024    0.00803442    0.03481990   -0.00995152
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C   -0.83389164   -0.83618715    0.12133179   -0.01526704   -0.05171063    0.02381675
C    0.30415942    1.46557731   -0.07649738    0.02009477    0.09035997   -0.00218679
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C    1.67971759    1.20815564    0.12096073    0.02109788   -0.09545399   -0.05552489
C    1.73356989   -1.22400450   -0.24050626   -0.03744644   -0.02689343   -0.01022117
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H    0.19875744   -2.64113889   -0.02713846   -0.00446522    0.01752692    0.00908741
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C    2.36303246    0.12165868    0.07339603   -0.05237559    0.11523382    0.00330612
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   15
   -420.48823144
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O   -1.97404299   -1.28768101    0.14672599    0.02393438    0.03364743   -0.01034259
C   -0.82014492    0.69187908   -0.02629712   -0.00974058    0.00453532    0.00617405
C   -0.85209136   -0.83309688    0.12552832   -0.04564564   -0.05241371    0.02702427
C    0.30425286    1.47022000   -0.07329970    0.04497880   -0.01804491   -0.00480177
C    0.47429682   -1.60738784   -0.07153045    0.07716120   -0.02478633   -0.01221068
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C    1.74367964   -1.21164699   -0.23565107   -0.02078983   -0.00011358   -0.00666192
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C    2.36565846    0.11632729    0.08480207   -0.04449769    0.11140108    0.00633323
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   15
   -420.47881104
H   -2.66482583    0.58909146    0.02995486   -0.01312848   -0.02976836    0.00780317
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O   -1.97566516   -1.29630253    0.15874938    0.03499284    0.02868498   -0.01029656
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C   -0.86755561   -0.82686265    0.12809548   -0.07098255   -0.04796175    0.02922477
C    0.30176162    1.47566329   -0.06979894    0.04528969   -0.07526361   -0.01061417
C    0.46712149   -1.60382239   -0.07867314    0.06964568   -0.02111215   -0.00586847
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C    1.75502223   -1.19927175   -0.23038955    0.00061443    0.02474707   -0.00374166
H   -0.08419656    2.62210206    0.06222720   -0.02785480    0.04940240    0.01264709
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C    2.37090105    0.10432346    0.09580782   -0.02174833    0.09459588    0.01273937
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   15
   -420.45675105
H   -2.63368744    0.46925840    0.02356111   -0.02320064   -0.05583135    0.01127550
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O   -1.97884298   -1.30620649    0.17123710    0.03754956    0.01878617   -0.00949690
C   -0.78559700    0.71142459   -0.04165091    0.04707956    0.01833682    0.00428540
C   -0.87877550   -0.81775558    0.12890013   -0.08669460   -0.03796068    0.03041363
C    0.29662041    1.48549169   -0.06566462    0.02773297   -0.09826835   -0.01497712
C    0.45574913   -1.59899026   -0.08547356    0.05911967   -0.01521836    0.00291224
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C    1.76631429   -1.18835925   -0.22489630    0.02468610    0.04292586   -0.00190184
H   -0.10570662    2.70523459    0.11126959   -0.03094012    0.06748015    0.01697037
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H    2.25433206   -2.18125951   -0.46624341   -0.01811684   -0.03366269   -0.00542459
C    2.37741364    0.08664097    0.10603238    0.01007227    0.06920666    0.02121618
H    3.40401376   -0.15039270    0.45582554    0.00758516   -0.02961814    0.00481681
   15
   -420.44312788
H   -2.58674884    0.38853513    0.00929491   -0.01750509   -0.06304619    0.01041344
O   -2.00188528    1.35728173   -0.14374704    0.01306116    0.10026179   -0.01698432
O   -1.98368567   -1.31694624    0.18415179    0.02989968    0.00452500   -0.00768490
C   -0.77167731    0.71975838   -0.04975083    0.07038801    0.02694910    0.00266614
C   -0.88481514   -0.80637972    0.12787156   -0.08997056   -0.02262471    0.03036482
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C    1.63491685    1.24340583    0.08334932   -0.05047981    0.04788467   -0.03187953
C    1.77611404   -1.18000034   -0.21928159    0.04866845    0.05264374   -0.00134692
H   -0.10518373    2.74055648    0.14818972   -0.02956262    0.07157136    0.01961056
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C    2.38330438    0.06480239    0.11497723    0.04414211    0.03796361    0.02891111
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   15
   -420.44869407
H   -2.52761212    0.35270274   -0.01237905   -0.00474194   -0.06109801    0.00788402
O   -1.99544531    1.34139160   -0.14719731    0.00984555    0.09651698   -0.01374174
O   -1.98985123   -1.32788340    0.19741095    0.01338369   -0.01179466   -0.00482476
C   -0.76194533    0.72647325   -0.05800996    0.07999281    0.03334671    0.00062409
C   -0.88547525   -0.79365463    0.12501427   -0.08094741   -0.00351642    0.02877044
C    0.28276394    1.52327133   -0.05448353   -0.01699258   -0.10133311   -0.02075260
C    0.42314091   -1.58668538   -0.10016682    0.02907234   -0.01388089    0.02021298
C    1.62996985    1.25075469    0.08042770   -0.05832244    0.05688443   -0.03537597
C    1.78298198   -1.17478230   -0.21357811    0.07032357    0.05393117   -0.00222000
H   -0.08352334    2.72486578    0.17107054   -0.02548206    0.06610157    0.02076740
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H    2.29412894   -2.11960101   -0.44571226   -0.01890366   -0.01474750   -0.00213493
C    2.38657416    0.04068021    0.12220000    0.06817297    0.00439108    0.03132092
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   15
   -420.46946065
H   -2.46538739    0.36028398   -0.03967016    0.01370490   -0.04861289    0.00426669
O   -1.98944714    1.32117239   -0.15003046    0.00498264    0.07875801   -0.00871439
O   -1.99660537   -1.33828927    0.21088655   -0.00805692   -0.02709823   -0.00127144
C   -0.75696264    0.73119960   -0.06630349    0.07215376    0.03420296   -0.00210085
C   -0.88128971   -0.78072065    0.12042552   -0.06205340    0.01629217    0.02548631
C    0.27670717    1.55134954   -0.04710184   -0.03517055   -0.06958665   -0.01908325
C    0.40372130   -1.57928905   -0.10908848    0.00976589   -0.01946486    0.02524851
C    1.62857268    1.25477461    0.07969216   -0.07000402    0.04423117   -0.04773893
C    1.78562102   -1.17280048   -0.20773618    0.08698427    0.05041090   -0.00384901
H   -0.04382311    2.66268467    0.17921140   -0.01594549    0.04090981    0.01809441
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H    2.24517459    1.93821226    0.63748760   -0.00029435   -0.02822778    0.01125298
H    2.33416311   -2.06849295   -0.43237491   -0.01930111    0.00258360    0.00116765
C    2.38584881    0.01627698    0.12757375    0.06749487   -0.02636193    0.02503065
H    3.36265339   -0.25945578    0.38749906   -0.03937106   -0.03044797   -0.00878759
   15
   -420.48127803
H   -2.41354865    0.40145295   -0.06994319    0.04079762   -0.01210985   -0.00079639
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O   -2.00299429   -1.34747747    0.22441895   -0.02945301   -0.03933705    0.00256763
C   -0.75626919    0.73389237   -0.07446449    0.04977767    0.02828022   -0.00590394
C   -0.87338000   -0.76875638    0.11430243   -0.03750458    0.03302721    0.02080892
C    0.27279803    1.58335620   -0.03862190   -0.05743327    0.01785077   -0.00620673
C    0.38371941   -1.57070165   -0.11951680   -0.01109323   -0.02777020    0.02624769
C    1.63137135    1.25615676    0.08181686   -0.07459797    0.02371067   -0.05533751
C    1.78304993   -1.17388267   -0.20166730    0.09345323    0.04973884   -0.00435184
H    0.00663247    2.57386799    0.17495440    0.00576025   -0.03153645    0.00484959
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H    2.38783367   -2.01894958   -0.41981658   -0.01522965    0.01499180    0.00344772
C    2.38116633   -0.00655259    0.13146546    0.04284515   -0.05315730    0.01257333
H    3.39820503   -0.25170083    0.37617918   -0.01721939   -0.03196721   -0.00218825
   15
   -420.46237862
H   -2.39162816    0.44945745   -0.09962158    0.07487947    0.05122584   -0.00586936
O   -1.97748901    1.27235337   -0.15485964   -0.02881449   -0.03841324    0.00620224
O   -2.00806285   -1.35489289    0.23783438   -0.04669294   -0.04837856    0.00654778
C   -0.75856446    0.73489535   -0.08226205    0.02310625    0.01858193   -0.01093694
C   -0.86320306   -0.75875995    0.10692492   -0.01272082    0.04395373    0.01529385
C    0.27239354    1.61399086   -0.02983667   -0.08283643    0.15122941    0.01780675
C    0.36438188   -1.56043660   -0.13151341   -0.03065213   -0.03549235    0.02354696
C    1.63862183    1.25609548    0.08724000   -0.06768843    0.00477349   -0.05358396
C    1.77490713   -1.17800778   -0.19534719    0.08427844    0.05527152   -0.00265579
H    0.05230905    2.51087883    0.16798808    0.03509764   -0.14409154   -0.01860068
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C    2.37392305   -0.02617955    0.13459469    0.01181951   -0.07717934    0.00036538
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   15
   -420.46200953
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O   -2.01103596   -1.36012310    0.25095189   -0.05785656   -0.05476933    0.01074907
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   15
   -420.48483895
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O   -2.01140585   -1.36287724    0.26358086   -0.06322871   -0.05873637    0.01513997
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C   -0.84171659   -0.74692383    0.08976733    0.02379613    0.04731653    0.00287426
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C    0.33211838   -1.53359319   -0.15961299   -0.05551014   -0.02225415    0.02184499
C    1.66439521    1.25583385    0.10716745   -0.03234637   -0.01564389   -0.03099399
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   15
   -420.47925709
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O   -1.95436287    1.20873586   -0.16403950    0.07525616   -0.00079227    0.01201969
O   -2.00892256   -1.36297654    0.27552388   -0.06442254   -0.05998956    0.01924518
C   -0.76958767    0.73230251   -0.10035936   -0.02047203    0.00981749   -0.02606314
C   -0.83262580   -0.74529561    0.08073605    0.03720991    0.04136120   -0.00357676
C    0.29733512    1.65810867   -0.00787471   -0.02457955    0.00298786   -0.01515549
C    0.32069191   -1.51784295   -0.17564177   -0.05994423    0.00375566    0.02820019
C    1.68079484    1.25685813    0.12033091   -0.00697344   -0.01486597   -0.01530453
C    1.72616369   -1.21045886   -0.17576902    0.00342267    0.03190368   -0.00305447
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   15
   -420.45975476
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O   -2.00352444   -1.36036540    0.28659744   -0.06336728   -0.05820268    0.02236330
C   -0.77170262    0.73016451   -0.10361575   -0.03036567    0.00754567   -0.02948630
C   -0.82577474   -0.74615270    0.07192003    0.04835959    0.03218116   -0.00979480
C    0.31050845    1.66671277    0.00017075   -0.01045381   -0.01053537   -0.01601264
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C    1.69760077    1.25873599    0.13442466    0.02133188   -0.00533707   -0.00060003
C    1.70717846   -1.22637529   -0.16900320   -0.01879115    0.00504036   -0.00693735
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   15
   -420.44666821
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O   -1.99525480   -1.35512376    0.29666179   -0.06124810   -0.05366281    0.02404363
C   -0.77198840    0.72757634   -0.10509379   -0.03875694    0.00402878   -0.03191688
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C    0.32431517    1.67587777    0.00917117    0.00318490   -0.00777144   -0.01393113
C    0.30863785   -1.48881281   -0.21322303   -0.05492548    0.05735025    0.03826635
C    1.71312868    1.26092066    0.14857718    0.04697276    0.00685429    0.00982929
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C    2.34056613   -0.04193231    0.15435499    0.03297150   -0.07336701    0.00268423
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   15
   -420.44961698
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C    0.30770278   -1.47870572   -0.23535230   -0.04476052    0.07128885    0.03562544
C    1.72587423    1.26275016    0.16215407    0.06115095    0.00761421    0.01676982
C    1.67320128   -1.25735140   -0.15395125   -0.03166790   -0.05179212   -0.01528239
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C    2.33261829   -0.02901003    0.15883904    0.05650448   -0.05043921    0.00609374
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   15
   -420.46908722
H   -2.72277252    0.40630965   -0.17747045   -0.04642194   -0.01447735   -0.00586165
O   -1.96748084    1.13378246   -0.18411191    0.08555002   -0.03970539    0.01362118
O   -1.97055370   -1.33766854    0.31353132   -0.05146757   -0.03801508    0.02258401
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C   -0.82387574   -0.75782950    0.05022608    0.04676099    0.00094149   -0.02102655
C    0.35050119    1.69495624    0.02948629    0.02900041    0.02211874   -0.00596978
C    0.30944786   -1.47285145   -0.25960775   -0.02926628    0.07359782    0.02737375
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C    1.65900443   -1.26901347   -0.14516947   -0.02601594   -0.07337289   -0.01778135
H    0.09835322    2.88234843    0.11743436   -0.00912155    0.06307712    0.01006797
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C    2.32137580   -0.01304193    0.16296561    0.05635855   -0.02647445    0.00742321
H    3.33869195    0.21275761    0.17205131   -0.04247472    0.02477178    0.00056675
   15
   -420.48312155
H   -2.65257573    0.45405204   -0.16789321    0.01333669    0.03792915   -0.00568387
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O   -1.95458216   -1.32616416    0.32040335   -0.03960297   -0.02709799    0.01928455
C   -0.75798668    0.71958482   -0.09772558   -0.03773584   -0.01426449   -0.03219597
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C    0.31294269   -1.47139474   -0.28549755   -0.00973660    0.06533346    0.01496800
C    1.74054842    1.26624324    0.18574432    0.04914942   -0.03204621    0.03503601
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C    2.30686880    0.00453624    0.16664118    0.02879821   -0.00396397    0.00907413
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   15
   -420.46362581
H   -2.59347294    0.47252021   -0.15385081    0.08742853    0.11186811   -0.01080416
O   -1.99694596    1.10625886   -0.19800807   -0.07420326   -0.16255648    0.01736038
O   -1.93684314   -1.31343905    0.32640719   -0.01995504   -0.01378649    0.01414862
C   -0.74844197    0.71806877   -0.09131694   -0.02578764   -0.02189591   -0.02975109
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C    0.37044472    1.70596291    0.05117591    0.01756075    0.17957478    0.00061635
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C    1.74313404    1.27018515    0.19466985    0.03583620   -0.04979314    0.04334657
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C    2.29066532    0.02234968    0.16975911   -0.00808138    0.01931480    0.01236399
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   15
   -420.45888686
H   -2.58975974    0.41792296   -0.13235410    0.05324344    0.07730045   -0.01070274
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O   -1.91823012   -1.30009900    0.33177619    0.00785881    0.00226253    0.00714527
C   -0.73735661    0.71785621   -0.08311367   -0.00984395   -0.02556768   -0.02634189
C   -0.84344802   -0.77002265    0.03879107   -0.03750521   -0.03100348   -0.00757528
C    0.37840832    1.69848191    0.06204444    0.01493223    0.21202892   -0.00514093
C    0.32046026   -1.47937126   -0.33913755    0.02886785    0.03553288   -0.01190452
C    1.74355271    1.27708070    0.20099742    0.02231966   -0.05606359    0.04703126
C    1.62690711   -1.27777098   -0.11344709   -0.04746580   -0.03870957    0.00442803
H    0.15444642    2.61101282   -0.03065867    0.03591530   -0.14410493    0.01372050
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C    2.27491088    0.03898743    0.17212732   -0.03766934    0.04385974    0.01609005
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   15
   -420.47371187
H   -2.62261542    0.31049510   -0.10374819   -0.01596663   -0.00718528   -0.00169882
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O   -1.89999217   -1.28686582    0.33682552    0.04033695    0.01926915   -0.00097768
C   -0.72569479    0.71916493   -0.07332260    0.00966063   -0.02448111   -0.02186018
C   -0.84818208   -0.77122963    0.03642254   -0.07656927   -0.04212796    0.00224955
C    0.38527571    1.67901288    0.07311266    0.04530552    0.09822223    0.00751978
C    0.32217992   -1.48706231   -0.36528154    0.04154050    0.02568631   -0.02264554
C    1.74262215    1.28729448    0.20450833    0.00895289   -0.04805190    0.04517993
C    1.62111094   -1.27422935   -0.10255837   -0.04557307   -0.01684850    0.01437823
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H    2.49594363    2.03865375   -0.23442375    0.02187528    0.00913378   -0.03365853
H    2.19525800   -2.21972710   -0.40088572   -0.00233864   -0.03569969   -0.01646713
C    2.26136695    0.05298430    0.17352761   -0.05389322    0.06605198    0.01881063
H    3.40167421    0.16783098    0.03268730    0.03283445    0.02369643   -0.00912108
   15
   -420.46116685
H   -2.64679249    0.20518179   -0.07368329   -0.04259391   -0.04645542    0.00416636
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O   -1.88357236   -1.27449400    0.34191603    0.06942571    0.03284682   -0.00821636
C   -0.71462231    0.72194426   -0.06221588    0.03012018   -0.02118531   -0.01612851
C   -0.84832470   -0.76990520    0.03391815   -0.10769504   -0.04985439    0.01196588
C    0.38945032    1.65347987    0.08369354    0.06923685   -0.00344462    0.02740298
C    0.32142404   -1.49633457   -0.39006419    0.04686705    0.02120543   -0.03176102
C    1.74112942    1.30034501    0.20531403   -0.00023602   -0.02620508    0.03789878
C    1.61801378   -1.26962671   -0.09252517   -0.03236004   -0.00320071    0.02160564
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H   -0.09250626   -2.49283031   -0.53558206   -0.01845627    0.01114997    0.01224732
H    2.52394349    1.98818882   -0.21416750    0.01944661   -0.00596177   -0.02748692
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C    2.25100832    0.06302012    0.17379977   -0.05530662    0.08160672    0.01965240
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   15
   -420.44060970
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O   -2.03778326    1.10736259   -0.23210801   -0.00292889    0.02370825   -0.01339675
O   -1.87025108   -1.26358345    0.34736652    0.08497064    0.03875730   -0.01207964
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C   -0.84204738   -0.76560609    0.03070771   -0.12039416   -0.04959722    0.01819040
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   15
   -420.43161327
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O   -1.86070975   -1.25439513    0.35334626    0.08081321    0.03520547   -0.01103462
C   -0.69895680    0.73098957   -0.03749122    0.06041466   -0.00787132   -0.00235562
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   15
   -420.43822904
H   -2.54038272    0.10794434   -0.00705315   -0.02277538   -0.05381413    0.00913936
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O   -1.85476711   -1.24677693    0.35981050    0.05883233    0.02451597   -0.00577148
C   -0.69617837    0.73645118   -0.02470154    0.06661229    0.00190400    0.00475006
C   -0.80867118   -0.74880132    0.02106747   -0.07695168   -0.01992782    0.01244297
C    0.37688708    1.58803918    0.10321508    0.05068605   -0.09940062    0.04652919
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C    1.73635347    1.34073512    0.19680676    0.00235298    0.06739163    0.00945969
C    1.61491563   -1.25501837   -0.07117504    0.04153253   -0.01713136    0.02831893
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   15
   -420.45644496
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O   -1.85145817   -1.24026382    0.36652980    0.02741129    0.01177618    0.00131010
C   -0.69738922    0.74179828   -0.01219720    0.06502026    0.01151637    0.01147519
C   -0.78414201   -0.73805231    0.01497452   -0.03197085    0.00216656    0.00251952
C    0.36553535    1.57652351    0.10435232    0.03020419   -0.10246678    0.04393892
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C    1.73454678    1.34840585    0.19221862   -0.01441881    0.07411897    0.00955513
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H    0.08943385    2.71339279   -0.26590850   -0.00939388    0.05159605   -0.02924025
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   15
   -420.46956327
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O   -1.84939628   -1.23429357    0.37319111   -0.00327975    0.00105525    0.00803833
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C   -0.75769147   -0.72742012    0.00873370    0.01547958    0.02159173   -0.00832285
C    0.35238690    1.57103797    0.10288199    0.00337471   -0.07113994    0.03099476
C    0.28633000   -1.55713930   -0.47712741   -0.03228877   -0.00953305   -0.05140634
C    1.73362232    1.35165902    0.18705836   -0.03326612    0.06791121    0.00880485
C    1.60337509   -1.24115668   -0.06543676    0.06800470   -0.02407668    0.03149070
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   15
   -420.45416939
H   -2.33196251    0.28559399    0.01774347    0.07076877    0.08223818   -0.02531676
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O   -1.84721642   -1.22838313    0.37949251   -0.02601225   -0.00650854    0.01351049
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C   -0.73214169   -0.71806493    0.00298741    0.05595270    0.03548633   -0.01744796
C    0.33909192    1.56953222    0.09963768   -0.03393020    0.01975496   -0.00035577
C    0.27986319   -1.56956833   -0.48548254   -0.05129852   -0.01837262   -0.04883088
C    1.73464710    1.35082808    0.18138294   -0.04024232    0.05684034    0.00479548
C    1.59174410   -1.23200797   -0.06533730    0.04672140    0.00861385    0.03394374
H    0.12097268    2.48048266   -0.20557264    0.02545303   -0.09663579    0.01307880
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C    2.22083323    0.02718854    0.15593041   -0.01717875    0.00713862    0.00910433
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   15
   -420.43884198
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O   -2.06826943    1.10821794   -0.26748013   -0.08897625   -0.08062106    0.00309499
O   -1.84389522   -1.22218951    0.38518633   -0.03846052   -0.01089121    0.01753625
C   -0.72197318    0.75220422    0.01971242    0.03255207    0.02379178    0.02908750
C   -0.70990907   -0.71083142   -0.00171965    0.08342369    0.04445704   -0.02342882
C    0.32781551    1.56690790    0.09637751   -0.06231060    0.08630926   -0.02162096
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C    1.73803267    1.34656238    0.17542589   -0.03290075    0.04516627   -0.00093216
C    1.57735833   -1.22337856   -0.06726162    0.01131567    0.04174080    0.03095417
H    0.11758447    2.43257874   -0.17875009    0.04096126   -0.16593583    0.03253399
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H    2.57461907    2.16482905    0.19987591    0.04266119    0.02451729    0.00117974
H    2.28930174   -2.09814423   -0.04878046    0.01263271   -0.01787448    0.00159033
C    2.21640077    0.01267166    0.15080799   -0.03616254   -0.01535930    0.00659594
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   15
   -420.45734317
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O   -2.06207750    1.11496998   -0.27222586   -0.05851293   -0.01242027   -0.02475980
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C   -0.73500470    0.75296937    0.02729674    0.02804419    0.02354411    0.03480785
C   -0.69265712   -0.70626627   -0.00502652    0.09810772    0.04931094   -0.02609425
C    0.32008458    1.55992759    0.09415883   -0.05184852    0.00532811    0.00223189
C    0.27670524   -1.59082381   -0.49355998   -0.06132722   -0.02355592   -0.04080610
C    1.74335581    1.33955591    0.16952535   -0.01496690    0.03525049   -0.00669225
C    1.56228301   -1.21718898   -0.07103489   -0.02365169    0.05885312    0.02336750
H    0.08724341    2.49358547   -0.17215726    0.01964560   -0.08234675    0.00642397
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C    2.21411028   -0.00092579    0.14529572   -0.04624058   -0.03599964    0.00229268
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   15
   -420.46012017
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O   -2.05321478    1.12241879   -0.27589344   -0.03058056    0.02645263   -0.04301020
O   -1.83200981   -1.20825817    0.39408562   -0.03530006   -0.01232853    0.02111209
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C   -0.68129222   -0.70466349   -0.00676865    0.10335892    0.05019890   -0.02605570
C    0.31545984    1.55259777    0.09184126   -0.03290375   -0.08151958    0.02321948
C    0.28062106   -1.59934660   -0.49377005   -0.05230073   -0.01811437   -0.03496096
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C    1.54860971   -1.21447830   -0.07621189   -0.05314403    0.05996717    0.01378977
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H    0.16244620   -2.66002624   -0.67725043    0.01639715   -0.00230771    0.00134250
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H    2.43690707   -2.01539251    0.07170025    0.05215873   -0.01820728    0.01595531
C    2.21455892   -0.01236489    0.13964756   -0.04494204   -0.05290207   -0.00254137
H    3.32945043   -0.24461097    0.14093124    0.02536543   -0.02204256   -0.00913967
   15
   -420.44521694
H   -2.52361919    0.15609207    0.15500467   -0.02123605   -0.03448131    0.02361811
O   -2.04293974    1.12877396   -0.27765711   -0.00896672    0.03701305   -0.04876761
O   -1.82356992   -1.20046213    0.39713127   -0.02467001   -0.00781243    0.02005941
C   -0.76574794    0.75056481    0.03588369    0.00854998    0.01040382    0.04244249
C   -0.67614126   -0.70607934   -0.00694626    0.10106531    0.04761670   -0.02373491
C    0.31285729    1.54987766    0.08820587   -0.01962824   -0.10800370    0.02760572
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C    1.75509027    1.31949045    0.15917969    0.03945220    0.02727063   -0.01274921
C    1.53811778   -1.21533522   -0.08222228   -0.07590949    0.04914603    0.00411950
H    0.00150066    2.72697728   -0.15835027   -0.01756604    0.05753816   -0.02180616
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H    2.46043767   -1.95310238    0.11736763    0.05473381   -0.00520959    0.02104829
C    2.21766197   -0.02062660    0.13414869   -0.03111991   -0.06535234   -0.00649768
H    3.31523473   -0.20460691    0.19700467    0.01521636   -0.01313302   -0.00603168
   15
   -420.43114699
H   -2.58419118    0.14375219    0.16722416   -0.03614588   -0.03618218    0.02514013
O   -2.03225277    1.13348735   -0.27722986    0.01117058    0.03690388   -0.04847613
O   -1.81401977   -1.19232773    0.39927470   -0.01147785    0.00094551    0.01688511
C   -0.78224181    0.74817279    0.03643015   -0.01413562    0.00063434    0.04324949
C   -0.67706533   -0.71036007   -0.00569978    0.09126427    0.04201128   -0.01912648
C    0.31143945    1.55353358    0.08292896   -0.00623024   -0.10229299    0.02591374
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C    1.75825600    1.30690617    0.15508852    0.06675722    0.03019870   -0.01075921
C    1.53216324   -1.21911740   -0.08849232   -0.08771865    0.02882637   -0.00336905
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H    2.44532204   -1.88741820    0.14807917    0.04425600    0.01395299    0.02269644
C    2.22259727   -0.02496314    0.12903160   -0.00774061   -0.07231970   -0.00827395
H    3.29054714   -0.15524773    0.25752569   -0.00273651   -0.00260678   -0.00457760
   15
   -420.42500754
H   -2.61922364    0.15751264    0.16140851   -0.04274948   -0.03834125    0.02538348
O   -2.02207874    1.13653644   -0.27461281    0.03277262    0.03380577   -0.04547165
O   -1.80395668   -1.18424866    0.40066033    0.00386521    0.01303477    0.01147556
C   -0.79784593    0.74573217    0.03437153   -0.04372756   -0.00716579    0.04195103
C   -0.68346903   -0.71716602   -0.00330883    0.07350232    0.03325564   -0.01206957
C    0.31038890    1.56331896    0.07609107    0.00889220   -0.08443536    0.02276212
C    0.30723492   -1.61984726   -0.48342796    0.00171674   -0.00713723   -0.01476222
C    1.75742719    1.29251710    0.15163995    0.08568625    0.02858423   -0.00735934
C    1.53141743   -1.22459889   -0.09458731   -0.08045240   -0.00023094   -0.00513842
H   -0.04050931    2.82274894   -0.08893862   -0.02484697    0.07416744   -0.01576814
H    0.15048796   -2.66771674   -0.79332607    0.01078611   -0.01343434   -0.00987355
H    2.15414878    2.21561305    0.48972462   -0.03715296   -0.00732166    0.00334053
H    2.39937316   -1.83220970    0.16279951    0.01662747    0.04015232    0.01844959
C    2.22800831   -0.02496428    0.12440478    0.01386074   -0.07162048   -0.00817528
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   15
   -420.43009261
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O   -1.79408003   -1.17676951    0.40153466    0.02215697    0.02739510    0.00355205
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   15
   -420.44849498
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O   -1.78522236   -1.17053820    0.40225791    0.04405399    0.04294604   -0.00699106
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   15
   -420.46432103
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O   -1.77837455   -1.16625210    0.40330429    0.06871947    0.05748782   -0.01901588
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C   -0.72260407   -0.74630885    0.00574236   -0.01841209   -0.01408747    0.02169892
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C    1.72303500    1.24422845    0.14448326    0.08114221   -0.05004268   -0.02160631
C    1.55267202   -1.23431424   -0.11225685   -0.05857742   -0.02482198   -0.00398981
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   15
   -420.44779304
H   -2.51842367    0.45765406   -0.01730867    0.08314516    0.09163784   -0.02838227
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O   -1.77463969   -1.16455766    0.40520779    0.09172644    0.06766790   -0.02948834
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C   -0.73614913   -0.75576696    0.00713066   -0.05028578   -0.03161946    0.03257066
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   15
   -420.45333561
H   -2.53833920    0.48836923   -0.05621606    0.09904720    0.11276187   -0.03113572
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O   -1.77502882   -1.16590829    0.40842901    0.10467852    0.07119000   -0.03461219
C   -0.80178418    0.74242357   -0.00966200   -0.09833857   -0.00516500    0.02800777
C   -0.74670306   -0.76334463    0.00657581   -0.07212015   -0.04289618    0.03813847
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C    1.67544127    1.22330930    0.14543825    0.04404086   -0.07748484   -0.03214801
C    1.58428376   -1.23402555   -0.12310649   -0.07957689    0.04931939   -0.01181036
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H    2.30311058   -2.13901019    0.11477765    0.01976402   -0.03173823    0.02214355
C    2.24856580    0.02048898    0.11384475   -0.02440901    0.02820016   -0.03233565
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   15
   -420.48234978
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O   -1.78010259   -1.17045875    0.41319045    0.10065837    0.06669259   -0.03180828
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C   -0.75298169   -0.76837365    0.00375562   -0.07689556   -0.04525221    0.03563051
C    0.28535852    1.63238537    0.01341803    0.00918578    0.02636515   -0.00990312
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C    1.60718209   -1.23728366   -0.12750282   -0.06227756    0.06534467   -0.00583619
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H    2.29439161   -2.23489343    0.07278938    0.02134288   -0.05195970    0.01950696
C    2.25519138    0.02998019    0.11649954   -0.01275944    0.04329656   -0.02795772
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   15
   -420.47510608
H   -2.71530319    0.38664305   -0.08697458   -0.05058431   -0.03473442    0.00197546
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C   -0.75470656   -0.77070353   -0.00118020   -0.06274839   -0.04016326    0.02540226
C    0.27969803    1.62774584    0.00140464    0.00597994   -0.04428407   -0.03074475
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C    1.61772700    1.21986894    0.15387900   -0.01741721   -0.04527390   -0.02894552
C    1.63380811   -1.24443304   -0.13155573   -0.03692540    0.06897625    0.00216576
H    0.06330963    2.74777260    0.37687179   -0.00453841    0.04926335    0.02955598
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H    2.27071484   -2.29406811    0.01691443    0.01570733   -0.06006997    0.01409668
C    2.26252514    0.03688443    0.12081254    0.01129385    0.05218315   -0.01719712
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   15
   -420.45648931
H   -2.77419563    0.35028336   -0.10040164   -0.07105516   -0.04920714    0.00166534
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O   -1.80283006   -1.18800086    0.42649855    0.04832578    0.03720369   -0.00674219
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C    1.66264653   -1.25569382   -0.13574072   -0.00717137    0.06019228    0.01042692
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C    2.26914566    0.04065423    0.12614627    0.04090824    0.05674837   -0.00287407
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   15
   -420.44840677
H   -2.78293551    0.34867170   -0.11495754   -0.07345702   -0.05095961   -0.00007942
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O   -1.81816730   -1.19968038    0.43393519    0.01499377    0.01891953    0.00845140
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C   -0.74854059   -0.76866759   -0.01471795   -0.00530847   -0.02129997   -0.00487288
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C    1.56417822    1.22692192    0.16916884   -0.07697342    0.00918337   -0.01847895
C    1.69189402   -1.27050233   -0.14055075    0.02759013    0.03269487    0.01748936
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   15
   -420.45430388
H   -2.73958357    0.38328570   -0.12945352   -0.06143734   -0.04384841   -0.00201631
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O   -1.83419933   -1.21222497    0.44099687   -0.01464592    0.00234016    0.02146698
C   -0.70513878    0.73868785   -0.09697201    0.10752883    0.03134360    0.01686318
C   -0.74404449   -0.76541696   -0.02152236    0.02246372   -0.01257210   -0.01831695
C    0.26274588    1.63645341   -0.02160038   -0.01246185   -0.09418363   -0.04501746
C    0.33982675   -1.59966885   -0.40156362   -0.03054039   -0.01431921   -0.00627789
C    1.54350403    1.23045760    0.17865599   -0.09839469    0.02973114   -0.01392966
C    1.71944104   -1.28715564   -0.14639582    0.06814377   -0.01994651    0.01992156
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H    2.37862918    1.82560958    0.53035627    0.01839545   -0.03764438   -0.00161977
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C    2.27394155    0.03777476    0.13684998    0.06018549    0.06029145    0.00508474
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   15
   -420.46553047
H   -2.65360959    0.44799342   -0.14243136   -0.02138453   -0.01027334   -0.00506042
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O   -1.84959091   -1.22488776    0.44709703   -0.03795028   -0.01106425    0.03119758
C   -0.69764111    0.73331651   -0.11833814    0.11028455    0.02098165    0.01111439
C   -0.74087585   -0.76139924   -0.02723621    0.04408345   -0.00514415   -0.02835182
C    0.25831541    1.65026953   -0.02396034   -0.01174722   -0.06076396   -0.03551213
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C    1.52873729    1.23224027    0.18898900   -0.11113519    0.04127266   -0.01003138
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H    2.17215015   -2.20051584   -0.26368943   -0.06231297    0.05509892    0.00214828
C    2.27098935    0.03091811    0.14175778    0.04254059    0.05791037   -0.00485360
H    3.20075577   -0.01775412    0.69604171   -0.00999266   -0.00973027    0.01076325
   15
   -420.46161449
H   -2.55513864    0.51637637   -0.15164493    0.06206895    0.08006186   -0.00969425
O   -2.01110756    1.22909732   -0.18834861   -0.09596384   -0.07079242    0.00663223
O   -1.86328850   -1.23706192    0.45179377   -0.05388810   -0.02092410    0.03772921
C   -0.69674574    0.72672411   -0.14036946    0.09969411    0.00133545    0.00399056
C   -0.74033367   -0.75706695   -0.03125500    0.05775037    0.00161362   -0.03448217
C    0.25463352    1.66746298   -0.02427562   -0.01873566    0.03112027   -0.00589423
C    0.34563506   -1.57650657   -0.37968325   -0.05462823    0.00164800   -0.00723880
C    1.52063699    1.23158031    0.19992874   -0.11298768    0.04213638   -0.00617524
C    1.76027527   -1.31378610   -0.16132050    0.10575340   -0.07493437    0.01195343
H    0.07553627    2.61202245    0.35672235    0.02007410   -0.04291055    0.00306487
H    0.04119026   -2.59017232   -0.63183572   -0.00374524    0.00225970   -0.00280508
H    2.39255192    1.82290995    0.46122900    0.01960372   -0.03759897   -0.00599701
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C    2.26548093    0.02059023    0.14695640    0.02119835    0.04948713   -0.01451996
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   15
   -420.44645234
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   15
   -420.47127952
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O   -1.88304517   -1.25829686    0.45589258   -0.06400928   -0.03180171    0.04415611
C   -0.71199991    0.71463580   -0.18465735    0.06873299   -0.03725027   -0.01218431
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C    1.52423706    1.22335004    0.22268361   -0.08740080    0.01586673    0.00198039
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   15
   -420.48443035
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O   -1.99732992    1.27597463   -0.16596173   -0.00167363    0.06911070    0.01082051
O   -1.88863788   -1.26685492    0.45499852   -0.06010837   -0.03512602    0.04520077
C   -0.72632381    0.71142647   -0.20594199    0.05734910   -0.04700530   -0.02001176
C   -0.75968155   -0.74634591   -0.03053818    0.04069670    0.02123445   -0.03189029
C    0.25350166    1.68663085   -0.02918676   -0.00603384    0.05641524   -0.00467424
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C    1.53442268    1.21732234    0.23400480   -0.06612099   -0.00233934    0.00641633
C    1.78155065   -1.32990562   -0.19131907    0.02062931    0.00339187    0.02832035
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H    2.49089887   -2.25545352   -0.53310774    0.03089168   -0.04951545   -0.02672751
C    2.24501767   -0.02474459    0.16856358   -0.01245250    0.00252648   -0.01412249
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   15
   -420.46791706
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O   -1.89151594   -1.27382379    0.45206035   -0.05283609   -0.03715372    0.04442421
C   -0.74410588    0.71103698   -0.22601772    0.04399723   -0.05196046   -0.02754042
C   -0.77199274   -0.74484116   -0.02620942    0.02239874    0.02389184   -0.02585593
C    0.25557855    1.68066177   -0.03214141    0.01125134    0.00917170   -0.01279987
C    0.39358775   -1.53620136   -0.33068063   -0.01210333    0.03801701   -0.00799549
C    1.54858675    1.21142648    0.24493648   -0.04084140   -0.01860493    0.01112441
C    1.78393158   -1.33447743   -0.20444966    0.00159938   -0.00208725    0.02493989
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   15
   -420.45027519
H   -2.59674552    0.27389783   -0.10111497   -0.02749692   -0.06165877   -0.00716844
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O   -1.89200106   -1.27911632    0.44711573   -0.04432734   -0.03670266    0.04121091
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C   -0.78565569   -0.74476374   -0.02032254    0.00344416    0.02303109   -0.01867199
C    0.25703239    1.67395211   -0.03437393    0.01708576   -0.00046302   -0.01003651
C    0.41008162   -1.53059570   -0.31726778    0.01018218    0.04296667   -0.00826920
C    1.56521083    1.20662913    0.25519640   -0.01361183   -0.02957825    0.01562466
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   15
   -420.44471234
H   -2.59399758    0.29255040   -0.07453429   -0.02542231   -0.06100016   -0.00485767
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O   -1.89047589   -1.28275557    0.44031068   -0.03553736   -0.03307702    0.03548072
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C    0.25747065    1.66721359   -0.03601217    0.01909608    0.00219756   -0.00445392
C    0.42597059   -1.52757522   -0.30335687    0.03033758    0.04523174   -0.00810089
C    1.58266163    1.20358297    0.26451492    0.01289226   -0.03312579    0.01943944
C    1.78900804   -1.34229890   -0.23472490   -0.00931648   -0.03837136    0.00507041
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H    2.61278148   -2.06664907   -0.57999836    0.03437062   -0.01300647   -0.01794935
C    2.22829071   -0.07162589    0.19661494    0.00236978   -0.04451986    0.00839828
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   15
   -420.44926944
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O   -1.88733972   -1.28490645    0.43190341   -0.02632280   -0.02617958    0.02769976
C   -0.80801791    0.72792081   -0.27470272   -0.03675411   -0.02875665   -0.04369050
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C    0.44004924   -1.52727836   -0.28895906    0.04570033    0.04513534   -0.00730822
C    1.59934895    1.20250010    0.27266173    0.03619323   -0.02870053    0.02247551
C    1.79227341   -1.34333268   -0.25065016    0.01592980   -0.07251410   -0.01453315
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C    2.22280901   -0.08310872    0.20547184   -0.01113890   -0.06154603    0.01053512
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   15
   -420.45480115
H   -2.54089701    0.45602486   -0.01318399    0.00574771   -0.02827134   -0.00112333
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O   -1.88301424   -1.28587965    0.42224362   -0.01574897   -0.01664376    0.01875654
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C    0.25487544    1.65286933   -0.03887879    0.01589354    0.02411573    0.00886306
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C    1.61387242    1.20311927    0.27945219    0.05448492   -0.01759621    0.02490502
C    1.79448077   -1.33997764   -0.26568333    0.05680878   -0.10547789   -0.03571908
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H    2.58458132   -1.88522677   -0.54731901   -0.04350947    0.06458382    0.01844552
C    2.21804546   -0.09087122    0.21368895   -0.03330276   -0.07805858    0.01306642
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   15
   -420.45266702
H   -2.51472384    0.57442704    0.01970405    0.06162701    0.04692263   -0.01295486
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O   -1.87798321   -1.28610112    0.41173272   -0.00285532   -0.00618980    0.00981108
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C   -0.83263326   -0.75459834    0.00978531   -0.05242015   -0.01146772    0.01271368
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C    1.62513244    1.20478852    0.28473968    0.06636918   -0.00377303    0.02664480
C    1.79344980   -1.33043394   -0.27864662    0.06060331   -0.10250020   -0.04001579
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C    2.21527796   -0.09393771    0.22110662   -0.05223101   -0.08966584    0.01743019
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   15
   -420.43924294
H   -2.53272623    0.65971087    0.06249566    0.10503286    0.10229011   -0.02998579
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O   -1.87282927   -1.28603739    0.40077259    0.01169708    0.00312878    0.00194425
C   -0.85177895    0.75833082   -0.30030446   -0.10451363    0.03664510   -0.04884673
C   -0.83824074   -0.75698721    0.01658157   -0.06333243   -0.02236732    0.01959682
C    0.24953867    1.63034788   -0.04371403   -0.03816901    0.15590710    0.00881860
C    0.46360220   -1.54223367   -0.24347700    0.06640267    0.03710206   -0.00266354
C    1.63241998    1.20670366    0.28842372    0.06988981    0.00662569    0.02672016
C    1.78901720   -1.31488531   -0.28928190    0.01636763   -0.06302051   -0.02716471
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C    2.21562382   -0.09162526    0.22746406   -0.06228443   -0.09257823    0.02302197
H    3.34118755    0.08593538    0.13884382    0.02275295    0.01175391   -0.01617389
   15
   -420.44864697
H   -2.61860771    0.67969341    0.12420280    0.03854682    0.04016875   -0.00960241
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O   -1.86820138   -1.28610543    0.38971679    0.02491108    0.00976777   -0.00394705
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C   -0.84002651   -0.75804367    0.02220368   -0.07227211   -0.02928928    0.02426100
C    0.24918807    1.60776975   -0.04701942   -0.05534595    0.17767217   -0.00151645
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C    1.63553691    1.20825510    0.29050963    0.06228206    0.00991746    0.02326985
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H    2.12985243    2.13871086    0.50819511   -0.02460315    0.00501604   -0.00656234
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C    2.21968640   -0.08376591    0.23242687   -0.06223811   -0.08525801    0.02903887
H    3.34403157    0.06301538    0.09778262    0.02215880    0.00700784   -0.02042300
   15
   -420.46729234
H   -2.73231394    0.66954797    0.19248819   -0.03580577   -0.01412704    0.01900899
O   -1.99302688    1.32019132   -0.13042360    0.09711825   -0.01460344   -0.00063097
O   -1.86468209   -1.28660313    0.37882977    0.03244980    0.01278663   -0.00713697
C   -0.85248194    0.77003407   -0.30266575   -0.06090358    0.06908986   -0.05642994
C   -0.83748017   -0.75735758    0.02637646   -0.07365932   -0.03048743    0.02537585
C    0.25199650    1.57524528   -0.05036191   -0.03968536    0.05960130    0.00931692
C    0.46015191   -1.56364020   -0.21221497    0.05711748    0.02524705    0.00213480
C    1.63494526    1.20923356    0.29121011    0.04338942    0.00790792    0.01560169
C    1.77918858   -1.27475847   -0.30623736   -0.03054274    0.00699812   -0.01216999
H    0.02232409    2.55462782   -0.25350695    0.00364326   -0.05462232   -0.00569970
H    0.15839628   -2.61249268   -0.21128077   -0.00100164    0.00194223    0.00868113
H    2.18981431    2.11415916    0.55648426   -0.00857011    0.01123071    0.00042176
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C    2.22745688   -0.07079386    0.23563549   -0.05097029   -0.06929417    0.03462774
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   15
   -420.46231985
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O   -1.86260380   -1.28766545    0.36825544    0.03181582    0.01170003   -0.00738846
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C   -0.83053197   -0.75486056    0.02903388   -0.06470062   -0.02526922    0.02266594
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   15
   -420.45165369
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C   -0.81971665   -0.75086241    0.03033520   -0.04663076   -0.01468531    0.01702495
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   15
   -420.45413052
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O   -1.86235399   -1.29114047    0.34799807    0.01219173    0.00059077   -0.00216935
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C   -0.80611073   -0.74599239    0.03061518   -0.02263404   -0.00082902    0.00971142
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C    1.77381489   -1.21909261   -0.32509797    0.02804793    0.04001094   -0.02569373
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   15
   -420.46577190
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O   -1.86331786   -1.29306228    0.33808689   -0.00005961   -0.00597321    0.00098916
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C   -0.79114706   -0.74107725    0.03031055    0.00361919    0.01407270    0.00183334
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   15
   -420.46328842
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O   -1.86428826   -1.29471872    0.32813390   -0.00986812   -0.01106609    0.00334624
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C   -0.77639618   -0.73700913    0.02989326    0.02862752    0.02818330   -0.00569717
C    0.29799343    1.44550409   -0.08544620   -0.00670629   -0.12680837    0.02594126
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   15
   -420.45598046
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C    0.31104405    1.44093872   -0.09731874    0.00929492   -0.08458695    0.01681366
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   15
   -420.46370697
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O   -1.86469581   -1.29642874    0.30773883   -0.01543020   -0.01403348    0.00407865
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C    2.31301313    0.06091103    0.18820065   -0.03746316    0.07311316    0.03383419
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   15
   -420.44915829
H   -2.73838787    0.67984044    0.30809534   -0.02801471   -0.02620633    0.02606780
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O   -1.86388066   -1.29634717    0.29726318   -0.01111115   -0.01195584    0.00251456
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C    0.38962459   -1.64034555   -0.11351421   -0.03316312   -0.06437475    0.02903445
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   15
   -420.45252178
H   -2.76539471    0.60163524    0.33399785   -0.04396283   -0.04981395    0.03921694
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   15
   -420.45500664
H   -2.76166256    0.55836049    0.33230174   -0.04339448   -0.05658686    0.04089191
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O   -1.86113615   -1.29478681    0.27608455    0.00753318   -0.00060170   -0.00248054
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C   -0.74652872   -0.75268196    0.03878487    0.06596867    0.03825052   -0.01842142
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C    1.65061353    1.17850098    0.30209143   -0.02892980   -0.03549790   -0.00577965
C    1.66400251   -1.14362044   -0.30080545   -0.04485002    0.08030118   -0.00859582
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C    2.36674567    0.07577227    0.13356927    0.00371504    0.05816199    0.00177831
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   15
   -420.44868242
H   -2.72718828    0.55542937    0.30147896   -0.03380061   -0.05573627    0.03676515
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O   -1.86004732   -1.29382253    0.26560458    0.02044727    0.00849471   -0.00497665
C   -0.82031167    0.65618808   -0.11251771   -0.01536860   -0.08725770    0.01351742
C   -0.75244343   -0.76394722    0.04382682    0.05651220    0.02138447   -0.01622686
C    0.35564856    1.41580010   -0.15550415    0.06523062   -0.08302835   -0.01780192
C    0.38531967   -1.61918859   -0.10128374   -0.00801878   -0.03348691    0.02531927
C    1.66162255    1.17324064    0.30493734   -0.02104364   -0.05453820   -0.00176501
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C    2.38593117    0.07294467    0.11438496    0.03386630    0.04279051   -0.00283431
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   15
   -420.44726130
H   -2.66917069    0.59172963    0.24470764   -0.01028052   -0.03834783    0.02335004
O   -2.12729596    1.40748669   -0.15602442   -0.04804198    0.10108078   -0.02833040
O   -1.85989408   -1.29325034    0.25534948    0.03543508    0.01931353   -0.00724026
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C   -0.76175041   -0.77648202    0.04984610    0.04198674   -0.00021114   -0.01320448
C    0.35556964    1.41320038   -0.16457600    0.06462534   -0.08929978   -0.02512162
C    0.38570738   -1.60712366   -0.10043467    0.00541158   -0.02032379    0.02180909
C    1.67387646    1.17121580    0.30786374   -0.00756807   -0.06112330    0.00748830
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   15
   -420.44392944
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O   -1.86135461   -1.29355662    0.24542213    0.05196575    0.03058806   -0.00928500
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   15
   -420.43162633
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C   -0.81197202    0.67714923   -0.04640127   -0.01400792   -0.05565253    0.02836662
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C    0.34416400    1.42384524   -0.17777798    0.04660211   -0.07505977   -0.03687554
C    0.38478666   -1.58011968   -0.10247937    0.02598686    0.00645618    0.01543983
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   15
   -420.44766773
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O   -1.87206337   -1.29874223    0.22689748    0.07999601    0.04576203   -0.01154547
C   -0.80723102    0.69206507   -0.02749489    0.00031933   -0.03171673    0.02945734
C   -0.80020257   -0.80824961    0.07186563   -0.01695837   -0.06599043   -0.00356845
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C    0.38225780   -1.56679460   -0.10499418    0.02838238    0.01888093    0.01381897
C    1.70936264    1.18460913    0.31059252    0.04170923   -0.00541456    0.05106045
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   15
   -420.45879053
H   -2.69473908    0.58446969    0.04091195   -0.00579747   -0.01847204    0.00651210
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O   -1.88255022   -1.30429268    0.21839862    0.08281230    0.04517594   -0.01070596
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C    0.32210876    1.45117270   -0.18224150   -0.00660279    0.02485001   -0.03913451
C    0.37804791   -1.55459709   -0.10834876    0.02368874    0.02840081    0.01301394
C    1.71748006    1.19188023    0.30658676    0.05339869    0.02161901    0.06219462
C    1.62008652   -1.17245941   -0.23721985   -0.09932560   -0.04043111    0.00110802
H    0.03173942    2.45266354   -0.13520179   -0.00042590   -0.04027731    0.00822009
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   15
   -420.44014251
H   -2.77812329    0.51577335    0.01194032   -0.04755919   -0.05121663    0.01143263
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O   -1.89674831   -1.31186675    0.21038016    0.07352162    0.03775633   -0.00846390
C   -0.79897138    0.72590751    0.00497327    0.03631109    0.02443074    0.02901150
C   -0.82329507   -0.81218256    0.08802327   -0.03038265   -0.07706060   -0.00142813
C    0.31077243    1.46444738   -0.18092508   -0.05504088    0.12563475   -0.03641966
C    0.37244350   -1.54409201   -0.11249113    0.01151517    0.03293629    0.01234988
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H    0.02103327    2.36564102   -0.14612247    0.02684066   -0.14872492    0.00525730
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H    2.42464789   -1.87512215   -0.56164348    0.02295960    0.01390537   -0.00692048
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   15
   -420.44473670
H   -2.82872680    0.48237642   -0.02483611   -0.06408990   -0.05608094    0.00853024
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O   -1.91424122   -1.32113304    0.20274318    0.05344921    0.02481661   -0.00557244
C   -0.79757983    0.74147661    0.01856524    0.04807177    0.04906549    0.02696715
C   -0.83219540   -0.80724853    0.09625192   -0.02125451   -0.06765125   -0.00148811
C    0.30257145    1.47081094   -0.17738129   -0.06845534    0.10302994   -0.03739293
C    0.36616767   -1.53554895   -0.11737686   -0.00554414    0.03154086    0.01099488
C    1.72394761    1.20265213    0.28749563    0.05016081    0.00466846    0.04882288
C    1.65012858   -1.16925965   -0.21418517   -0.08811353    0.00967701    0.02482057
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H    0.19763934   -2.59990355   -0.30715028    0.00417700   -0.00320039   -0.00089598
H    1.97122219    2.17047690    0.66167958   -0.03447333   -0.00578215   -0.00946940
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C    2.43965618    0.03641644    0.02377618    0.04022793   -0.02676994   -0.06359265
H    3.35199192   -0.11488937    0.65701868    0.00399203   -0.00208401    0.02734810
   15
   -420.46958083
H   -2.83390495    0.48886991   -0.06767080   -0.06764514   -0.05174277    0.00401008
O   -2.03194994    1.32411804   -0.16093447    0.03880741    0.06064126   -0.01584672
O   -1.93413635   -1.33151325    0.19536033    0.02726789    0.00871441   -0.00301196
C   -0.79904571    0.75411096    0.03053081    0.04987478    0.06726255    0.02404860
C   -0.83983335   -0.79826232    0.10456801   -0.00748611   -0.05039068   -0.00106694
C    0.29833199    1.47142621   -0.17159328   -0.04830850   -0.01121195   -0.03574824
C    0.36022708   -1.52888593   -0.12292078   -0.02263585    0.02466710    0.00830032
C    1.72249151    1.20707197    0.27318606    0.03564035   -0.01988121    0.03047388
C    1.67350355   -1.16780764   -0.20459565   -0.05576144    0.02642815    0.02992927
H   -0.04787417    2.48048038   -0.18141247   -0.01317950   -0.02584439    0.00730530
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H    2.03565767    2.19279983    0.68034892   -0.01941491    0.01999133    0.00494033
H    2.47849592   -1.95239527   -0.56647587    0.04168073   -0.01394543   -0.01865238
C    2.43656138    0.03646618    0.02459175    0.04381787   -0.02119850   -0.05193943
H    3.35102445   -0.17279786    0.59392303   -0.00661928   -0.00969419    0.01735744
   15
   -420.48124424
H   -2.79118103    0.53208146   -0.11335887   -0.05640890   -0.03746204   -0.00094805
O   -2.01500314    1.30314435   -0.15942071    0.04768857    0.03277155   -0.00863559
O   -1.95526597   -1.34228657    0.18811793    0.00023539   -0.00794090   -0.00144435
C   -0.80345855    0.76271780    0.04104035    0.03803457    0.07749105    0.02139190
C   -0.84701335   -0.78625313    0.11294271    0.00539701   -0.02821822    0.00050778
C    0.29707100    1.47242738   -0.16366016   -0.03623376   -0.07689158   -0.03084718
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C    1.71889225    1.21264222    0.25702315    0.01848090   -0.03461834    0.01389171
C    1.70020973   -1.16791953   -0.19679570   -0.01495662    0.03611465    0.03086471
H   -0.08065879    2.60507923   -0.20661224   -0.03044753    0.04039223    0.00303660
H    0.18367118   -2.59003556   -0.28489465    0.00386342   -0.00239251    0.00096930
H    2.11402970    2.20138077    0.69564434   -0.00350932    0.03546412    0.01650819
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C    2.43082177    0.03779791    0.02854213    0.04614617   -0.01541016   -0.03900314
H    3.35485648   -0.22377462    0.51831768   -0.01758096   -0.01658437    0.00758014
   15
   -420.48208423
H   -2.70991302    0.60054755   -0.15841550   -0.00906451    0.00675051   -0.00457764
O   -2.00011025    1.28079304   -0.15751663    0.02601272   -0.02534017   -0.00142421
O   -1.97641866   -1.35270572    0.18094522   -0.02359787   -0.02295694   -0.00098834
C   -0.81010435    0.76667381    0.05025319    0.01302139    0.08057602    0.01930517
C   -0.85449876   -0.77254537    0.12128072    0.01418522   -0.00440573    0.00327467
C    0.29802185    1.47784843   -0.15385590   -0.02858682   -0.09638271   -0.02681423
C    0.35315530   -1.51933713   -0.13524110   -0.04201412    0.00161363   -0.00111444
C    1.71417070    1.22024585    0.23999750    0.00220699   -0.03741422    0.00173461
C    1.72779887   -1.17016193   -0.19083643    0.03021857    0.03500092    0.02660544
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H    2.42197297   -1.99666294   -0.52160788    0.01833726   -0.00991229   -0.01287553
C    2.42233343    0.04005142    0.03486740    0.04029895   -0.00756655   -0.02901002
H    3.37087642   -0.26277659    0.43697213   -0.02082831   -0.02399023    0.00221611
   15
   -420.46445235
H   -2.62582998    0.66090077   -0.20074447    0.09092177    0.09676086    0.00116316
O   -1.98617039    1.25979361   -0.15551544   -0.04644227   -0.12857979   -0.00271180
O   -1.99652178   -1.36209386    0.17382039   -0.04182551   -0.03520872   -0.00134363
C   -0.81749936    0.76578446    0.05829676   -0.01956429    0.07820005    0.01757352
C   -0.86281422   -0.75856587    0.12941619    0.01738152    0.01842243    0.00693600
C    0.30068839    1.48900247   -0.14242335   -0.01882758   -0.09570339   -0.02404582
C    0.35318364   -1.51508392   -0.14145388   -0.04166249   -0.00923863   -0.00676127
C    1.70929806    1.23006094    0.22284162   -0.01047337   -0.02986177   -0.00534198
C    1.75355626   -1.17444722   -0.18645710    0.07583945    0.01964121    0.01673755
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H    2.26940070    2.14205969    0.68663506    0.01832724    0.03011518    0.02491109
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C    2.41146390    0.04274301    0.04296106    0.02373633    0.00397890   -0.02160590
H    3.40118197   -0.28443617    0.35378876   -0.01257551   -0.03232553    0.00078487
   15
   -420.45924625
H   -2.60190254    0.65645106   -0.24420174    0.10527888    0.10858061    0.00863106
O   -1.97045492    1.24432125   -0.15337352   -0.03435784   -0.15345286   -0.00561942
O   -2.01475185   -1.36989538    0.16675712   -0.05347893   -0.04459505   -0.00186502
C   -0.82371091    0.76017943    0.06527769   -0.05216376    0.07288923    0.01585882
C   -0.87214663   -0.74568975    0.13713012    0.01379772    0.03912056    0.01099995
C    0.30449423    1.50589832   -0.12953458   -0.00933067   -0.08514430   -0.02173925
C    0.35569818   -1.51029203   -0.14725893   -0.03462114   -0.01616249   -0.01220363
C    1.70502380    1.24163597    0.20598089   -0.01615081   -0.01309390   -0.00685677
C    1.77477721   -1.17988400   -0.18308189    0.11102368   -0.00188276    0.00548320
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H    2.33092867    2.07783675    0.65628614    0.01987576    0.01209078    0.02156346
H    2.31996634   -2.02275271   -0.44333203   -0.02923171    0.02903687    0.00497201
C    2.39918313    0.04518549    0.05235695    0.00234762    0.01708309   -0.01344622
H    3.44013433   -0.28291909    0.27003748    0.00246981   -0.03896519   -0.00042971
   15
   -420.47686489
H   -2.64628283    0.58050790   -0.29224659    0.00746393    0.02029377   -0.00613680
O   -1.95362923    1.23538313   -0.15107411    0.08317550   -0.07607969    0.01232010
O   -2.03057843   -1.37568302    0.15977719   -0.05905786   -0.05147640   -0.00201779
C   -0.82681107    0.75018400    0.07129656   -0.07605402    0.06374634    0.01476971
C   -0.88228255   -0.73516660    0.14418029    0.00418353    0.05715189    0.01478208
C    0.30889221    1.52787995   -0.11532784   -0.00542204   -0.06094861   -0.02034496
C    0.36027976   -1.50454890   -0.15232962   -0.02226007   -0.01797598   -0.01691177
C    1.70167588    1.25396417    0.18950805   -0.01203548    0.01112017   -0.00316583
C    1.78941362   -1.18529862   -0.18007007    0.12123798   -0.00604213    0.00006511
H    0.00892657    2.70163463   -0.29817320   -0.01857056    0.05753236   -0.01088871
H    0.12552759   -2.56267564   -0.25466919   -0.00056727   -0.00020368    0.00428186
H    2.37869503    2.00537569    0.61068841    0.01241165   -0.01349980    0.01370611
H    2.29119084   -2.05851867   -0.40597193   -0.03569011    0.02998764    0.00639346
C    2.38674387    0.04661033    0.06255603   -0.01602793    0.02714918   -0.00341707
H    3.47733954   -0.25363895    0.18671176    0.01718542   -0.04077674   -0.00345161
   15
   -420.47574777
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   15
   -420.45473539
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   15
   -420.44234227
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C   -0.91113304   -0.72732828    0.15931520   -0.03241870    0.08343747    0.02112380
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   15
   -420.46440219
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   15
   -420.47650575
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C   -0.77731801    0.67106424    0.08626484   -0.01665871   -0.06142617    0.01889548
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   15
   -420.46618393
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   15
   -420.44176185
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   15
   -420.43853237
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O   -2.06376124   -1.33660453    0.10691003   -0.03554911   -0.01670751   -0.00497767
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C   -0.91697702   -0.80134340    0.15931234   -0.05503870   -0.00046160    0.01925617
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C    1.70716660    1.28897765    0.07211798   -0.01743012   -0.00633663   -0.01549027
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   15
   -420.45506400
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   15
   -420.46478458
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C    1.72391056    1.29069091    0.05222700    0.03775911   -0.00443127   -0.00980221
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   15
   -420.45850230
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O   -2.04402474   -1.29856647    0.08963510   -0.00207524    0.00200728   -0.00073687
C   -0.68788440    0.67545349    0.07363899    0.07784238   -0.03668977   -0.00090560
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H    2.49432625   -2.04820668   -0.16937110    0.02587981   -0.00160592    0.00859448
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   15
   -420.44820794
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O   -2.03664098   -1.28577404    0.08402411    0.00025631    0.00523221   -0.00096074
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C    2.30714056    0.03643653    0.09181761   -0.02077701   -0.01757549    0.02914412
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   15
   -420.46867711
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O   -1.98329083    1.20333551   -0.17251506   -0.01988112    0.05754016   -0.01356383
O   -2.02924605   -1.27321642    0.07846041   -0.00341136    0.00777153   -0.00215742
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C   -0.84623980   -0.87315834    0.13213651    0.01355163   -0.09733767    0.00716597
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   15
   -420.48807271
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O   -2.02168263   -1.26100900    0.07299621   -0.01067404    0.00967062   -0.00377407
C   -0.69006246    0.71657503    0.06548013    0.07160973    0.03238830   -0.00940543
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   15
   -420.48794917
H   -2.57239088    0.38009981   -0.07339215   -0.00968962   -0.00005946    0.00151381
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O   -2.01363508   -1.24923752    0.06770264   -0.01786831    0.01078789   -0.00522296
C   -0.70001385    0.72823246    0.06371455    0.05451546    0.04946091   -0.01054720
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C    1.72204945    1.30730146    0.00702250    0.01368867   -0.02644199    0.02058896
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H    2.40280015   -2.02395794   -0.23974335    0.00846575   -0.00212379   -0.00237742
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   15
   -420.47104661
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O   -2.00479174   -1.23795169    0.06264365   -0.02117634    0.01093423   -0.00605501
C   -0.71323962    0.73692234    0.06258411    0.03291739    0.06181579   -0.01113732
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C    0.35237572    1.57435704    0.17570872    0.06091045   -0.07610949    0.02182098
C    0.31425168   -1.59647924   -0.11084750   -0.07943489    0.01497188    0.00282819
C    1.71557924    1.31510640   -0.00419400   -0.00063968   -0.01343599    0.02051076
C    1.67918793   -1.20411864   -0.02392349    0.05038950   -0.01046955    0.00159181
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C    2.30513263    0.06514963    0.04584047   -0.04000781    0.02980110    0.00652589
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   15
   -420.45901635
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O   -1.99501013   -1.22716131    0.05785675   -0.01856762    0.01089516   -0.00621104
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C   -0.79375564   -0.84054166    0.10039076    0.05575754   -0.04813206    0.01265429
C    0.34191087    1.56328193    0.18782537    0.05246808   -0.08758461    0.02044354
C    0.31933860   -1.63168693   -0.10914873   -0.06287902   -0.01784930   -0.00502504
C    1.70911931    1.32369418   -0.01662594   -0.00937885    0.00546537    0.01552587
C    1.67329612   -1.18796239   -0.00587100    0.07001004    0.00278538    0.00752894
H   -0.19582348    2.76449262    0.11572156   -0.04627063    0.06358106   -0.00270465
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C    2.31073683    0.06922930    0.03224609   -0.02613482    0.03010220   -0.00167901
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   15
   -420.46841482
H   -2.56931625    0.47010661    0.03209801    0.01951617    0.03608235   -0.00194990
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O   -1.98440827   -1.21686762    0.05335002   -0.01009481    0.01141635   -0.00594571
C   -0.74425199    0.74260900    0.06235460   -0.01328236    0.07551232   -0.01143391
C   -0.78926493   -0.82208745    0.09091349    0.03864190   -0.02055027    0.01448906
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C    0.32818805   -1.66584258   -0.10715733   -0.03826101   -0.04538802   -0.01072399
C    1.70319731    1.33194304   -0.02998091   -0.01247371    0.02597723    0.00744161
C    1.66328153   -1.17205499    0.01169875    0.06826121    0.03101209    0.01860036
H   -0.16778565    2.73008765    0.17821517   -0.04116211    0.05792454    0.00150329
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C    2.31787978    0.07152044    0.01874742   -0.00396217    0.02401137   -0.00870834
H    3.35753501   -0.34605479    0.00343728    0.00099317   -0.04995378    0.00844227
   15
   -420.46954742
H   -2.62818700    0.41221279    0.07815060   -0.03129440   -0.01189866    0.01510663
O   -1.94187857    1.16681152   -0.16886895    0.06217612   -0.02363661   -0.01502006
O   -1.97336443   -1.20709316    0.04911253    0.00258582    0.01227857   -0.00555927
C   -0.75925751    0.73879346    0.06327209   -0.03523135    0.07373403   -0.01085688
C   -0.78710198   -0.80238836    0.08056762    0.01954131    0.00673585    0.01483114
C    0.31263217    1.55693897    0.20843031    0.00841922   -0.07066340    0.01814364
C    0.33934485   -1.69728748   -0.10452971   -0.01218335   -0.06618353   -0.01400897
C    1.69801796    1.33864111   -0.04378788   -0.01328848    0.04248055   -0.00028879
C    1.64921867   -1.15805277    0.02812962    0.05065062    0.06486590    0.03262455
H   -0.11058530    2.65497750    0.23965412   -0.02780460    0.03450451    0.00508534
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C    2.32522801    0.07238695    0.00576417    0.02484601    0.01255409   -0.01351469
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   15
   -420.45532158
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O   -1.93255448    1.16967013   -0.16757349    0.09674761   -0.01148308   -0.02050308
O   -1.96244240   -1.19787836    0.04512746    0.01644568    0.01372777   -0.00522380
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C    0.29650690    1.56046039    0.21703796   -0.03142079   -0.00604954    0.02156354
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C    1.63212654   -1.14792517    0.04260075    0.02590657    0.08960600    0.04420558
H   -0.03429035    2.55751061    0.29770396    0.00047935   -0.03014588    0.00371739
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H    2.33427106    2.07332846   -0.52556346    0.00206253   -0.02204609   -0.01412904
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C    2.33106792    0.07250238   -0.00641520    0.05434867   -0.00035754   -0.01570064
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   15
   -420.43156796
H   -2.66979628    0.32812226    0.13337222   -0.05146335   -0.03019239    0.02588666
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O   -1.95225982   -1.18928928    0.04137929    0.02853872    0.01590921   -0.00486789
C   -0.78171473    0.71866016    0.06695932   -0.07076172    0.03906395   -0.00635208
C   -0.78533169   -0.76569005    0.05725943   -0.01087390    0.05407396    0.01224383
C    0.28229387    1.56412105    0.22428064   -0.07111744    0.09356228    0.03558108
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C    1.69028332    1.34396109   -0.07110800   -0.02215468    0.05075685   -0.00732218
C    1.61348385   -1.14314053    0.05442583   -0.00218271    0.09941214    0.05043447
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C    2.33368022    0.07261257   -0.01765340    0.07201943   -0.00808860   -0.01626998
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   15
   -420.43321963
H   -2.63661245    0.31702456    0.13434682   -0.04278188   -0.03147845    0.02607157
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O   -1.94335862   -1.18142493    0.03785093    0.03704481    0.01880924   -0.00424330
C   -0.78704471    0.70442066    0.06945607   -0.07914517    0.00976716   -0.00231810
C   -0.78389456   -0.75155050    0.04444754   -0.02008854    0.07340440    0.01047191
C    0.27218015    1.56268689    0.22941551   -0.07545053    0.09115108    0.04035134
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C    1.68825340    1.34206400   -0.08417935   -0.02813438    0.04580995   -0.00969290
C    1.59498105   -1.14429786    0.06322885   -0.03176712    0.09515998    0.05110523
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C    2.33205033    0.07317051   -0.02790655    0.06793729   -0.00805557   -0.01694731
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   15
   -420.45293928
H   -2.57327272    0.32838758    0.11674305   -0.02299743   -0.02871042    0.02287020
O   -1.93241581    1.18065394   -0.15773497    0.09419620    0.00193163   -0.02563458
O   -1.93612083   -1.17441642    0.03451327    0.04095981    0.02231011   -0.00311663
C   -0.78762686    0.68959768    0.07208920   -0.07990622   -0.02113613    0.00245783
C   -0.78126519   -0.74183207    0.03100215   -0.02475655    0.08901270    0.00871848
C    0.26655935    1.55622516    0.23224243   -0.06453074   -0.00165021    0.02191053
C    0.37893086   -1.77515585   -0.08485278    0.05498856   -0.10682428   -0.01591149
C    1.68789926    1.33741395   -0.09665363   -0.02913549    0.03725762   -0.01419275
C    1.57839224   -1.15115054    0.06896592   -0.05980315    0.07895858    0.04688128
H    0.12714247    2.58068753    0.48628912    0.01871242   -0.01655816    0.00514888
H    0.13249398   -2.80216469   -0.38303998   -0.00643272   -0.00911061   -0.00861669
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H    2.29780396   -1.97801149   -0.23013275   -0.00093004   -0.01380811   -0.02001091
C    2.32639202    0.07420578   -0.03713383    0.04816681   -0.00593901   -0.01771138
H    3.38285301   -0.20065042    0.06271192    0.00147729   -0.02481284    0.01244994
   15
   -420.45580015
H   -2.49431302    0.35948331    0.08303013    0.01242354   -0.00970146    0.01378218
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O   -1.93072491   -1.16842157    0.03131497    0.04053766    0.02614107   -0.00144367
C   -0.78340265    0.67604634    0.07457493   -0.07526745   -0.05055897    0.00702608
C   -0.77716210   -0.73746830    0.01702975   -0.02475279    0.09878808    0.00689948
C    0.26488101    1.54963107    0.23372062   -0.06015118   -0.05721886    0.00623218
C    0.38250324   -1.77957992   -0.07749751    0.06320725   -0.10756252   -0.01382957
C    1.68926888    1.33052630   -0.10825581   -0.02259879    0.02563364   -0.02138289
C    1.56539251   -1.16273052    0.07188623   -0.08237199    0.05328991    0.03902858
H    0.14470575    2.68233473    0.55311342    0.01276525    0.04639007    0.02138398
H    0.13796494   -2.80386629   -0.33308119   -0.00382771   -0.00075617   -0.00566827
H    2.45920728    2.13782203   -0.31248624    0.03164106    0.00489517   -0.01067202
H    2.31712761   -1.93898776   -0.17468848   -0.00445346    0.00035311   -0.01538100
C    2.31782640    0.07561666   -0.04529783    0.02678011   -0.00668147   -0.01697376
H    3.43509668   -0.10536962    0.04948026    0.02858776   -0.01542790    0.01245660
   15
   -420.44552960
H   -2.42511108    0.39569559    0.03973584    0.05965933    0.03759962   -0.00016292
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   15
   -420.44231112
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   15
   -420.46106920
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O   -1.92499644   -1.15812288    0.02175389    0.03140015    0.03395379    0.00475915
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C    1.69765026    1.30375071   -0.13311240    0.03511115   -0.01400760   -0.04744430
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   15
   -420.48031145
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C    0.29224636    1.56136883    0.23842750   -0.03736904   -0.03365393    0.00401586
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C    1.69801911    1.29545159   -0.13634119    0.05769670   -0.02876047   -0.05364691
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H    2.44707824   -1.87640752    0.12962295    0.01120298    0.01917873   -0.00195484
C    2.27457000    0.08568687   -0.07026997    0.00319433    0.00907296    0.00429323
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   15
   -420.48005289
H   -2.55733878    0.27031382   -0.12813775   -0.02471986   -0.04017192   -0.00359954
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O   -1.92856362   -1.15874326    0.01443847    0.02625162    0.03500010    0.01022931
C   -0.71340650    0.66996980    0.07634992    0.03204283   -0.05037899    0.02637329
C   -0.74117073   -0.79488242   -0.05586519    0.02172232   -0.00236961   -0.01012850
C    0.30589234    1.57205669    0.23946150   -0.03128865    0.03072791    0.02396468
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C    1.69493173    1.28890165   -0.13633342    0.07365455   -0.04525756   -0.05825313
C    1.58950899   -1.23891353    0.06058499   -0.10916528   -0.02125294    0.00490588
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C    2.26329491    0.08813966   -0.07620752    0.01472581    0.02728300    0.00892634
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   15
   -420.45778184
H   -2.60912422    0.25417275   -0.16755562   -0.04144471   -0.04536648   -0.00916331
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C    0.32148047    1.58070056    0.23897297   -0.03311562    0.12344011    0.05515532
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C    1.68744864    1.28508122   -0.13281043    0.07772856   -0.05996730   -0.06115002
C    1.61461900   -1.25152711    0.05595236   -0.08364187   -0.02070939   -0.00165210
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C    2.25113588    0.08894185   -0.08267217    0.02427514    0.04538314    0.01111433
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   15
   -420.45091462
H   -2.63169969    0.27036910   -0.20046870   -0.04728797   -0.04443267   -0.01323824
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C   -0.68758073    0.69364089    0.06772230    0.06283398   -0.00620075    0.03382593
C   -0.73095780   -0.82984646   -0.08252786    0.06849007   -0.07058837   -0.01527632
C    0.33896345    1.58238954    0.23533815   -0.01278972    0.12169200    0.05138344
C    0.31684869   -1.68523661   -0.01374052   -0.08254480    0.03541194   -0.01022310
C    1.67535181    1.28484093   -0.12560760    0.06443245   -0.06545768   -0.06035522
C    1.64473274   -1.26288161    0.05141416   -0.04716464   -0.02144551   -0.00715190
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H    0.17811757   -2.77504697    0.10184457    0.00778595   -0.01312182    0.00193430
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H    2.48649757   -1.96328914    0.37115591    0.02912689   -0.00613722    0.01638555
C    2.23760863    0.08705021   -0.08980506    0.01469032    0.05368466    0.01251711
H    3.23346529    0.36669276   -0.19088542   -0.05219901    0.03289316   -0.00146656
   15
   -420.46607103
H   -2.62086343    0.31820459   -0.22399073   -0.04197045   -0.03687445   -0.01484078
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O   -1.94205512   -1.17143050   -0.00019799    0.00760900    0.03139101    0.01476084
C   -0.67994566    0.70673706    0.06045109    0.07023259    0.01429788    0.03559954
C   -0.73131296   -0.84194386   -0.09453963    0.08635335   -0.09244972   -0.01578097
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C    0.30968368   -1.66977051   -0.00334067   -0.11687332    0.04265370   -0.01342094
C    1.65945774    1.28848664   -0.11478438    0.03147618   -0.05665108   -0.05376266
C    1.67767112   -1.27293026    0.04729754   -0.00505354   -0.02390365   -0.01045955
H   -0.01706332    2.50051143    0.56758427   -0.00434080   -0.03313967   -0.00113271
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H    2.45880609   -1.99004590    0.43397524    0.01980596   -0.00734386    0.01939793
C    2.22330825    0.08198060   -0.09770304   -0.01652874    0.04880935    0.01525863
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   15
   -420.46836652
H   -2.58084447    0.39150842   -0.23713857   -0.01875552   -0.01034059   -0.01092108
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C   -0.67653009    0.71900080    0.05103900    0.07216072    0.02860125    0.03501206
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C    0.30949498   -1.65682925    0.00785941   -0.13302394    0.03925116   -0.01446437
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C    1.71091207   -1.28152668    0.04379859    0.03762867   -0.02759496   -0.01085026
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H    2.41716337   -2.01179076    0.48305511    0.00531015   -0.00401879    0.01869561
C    2.21002298    0.07399420   -0.10652507   -0.05119641    0.03680172    0.01820061
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   15
   -420.45544832
H   -2.52899257    0.46994024   -0.24314565    0.03048625    0.05217749    0.00457532
O   -2.01531445    1.22389237   -0.05646608   -0.10026769   -0.04501472   -0.02304530
O   -1.95335633   -1.18709379   -0.01318601   -0.00219423    0.02593411    0.01457914
C   -0.67746070    0.72956386    0.03951955    0.07053640    0.03715131    0.03240757
C   -0.74773219   -0.84906130   -0.11570653    0.07786557   -0.09599435   -0.01608694
C    0.38042707    1.56666281    0.21515436    0.15411728   -0.08291480   -0.03162392
C    0.31724053   -1.64622819    0.01992425   -0.12725149    0.02928811   -0.01361181
C    1.62500106    1.30458701   -0.08419006   -0.06653444   -0.00665413   -0.02646533
C    1.74190215   -1.28845805    0.04094491    0.07530379   -0.03040053   -0.00917460
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H    2.37175635   -2.03080425    0.51885431   -0.01015867    0.00188429    0.01511309
C    2.19977433    0.06378770   -0.11643731   -0.07460775    0.02347569    0.01913803
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   15
   -420.44562856
H   -2.49862396    0.51128608   -0.25266878    0.06776680    0.10034143    0.02110191
O   -2.01167949    1.22260177   -0.04298202   -0.12964503   -0.09598458   -0.03660437
O   -1.95895640   -1.19675645   -0.02067741   -0.00136419    0.02282933    0.01445283
C   -0.68265338    0.73789803    0.02604666    0.06798836    0.04206076    0.02847747
C   -0.76327151   -0.84384480   -0.12483572    0.04925693   -0.08191283   -0.01731088
C    0.37963327    1.56768782    0.21069546    0.17259499   -0.09638586   -0.03617743
C    0.33258263   -1.63740042    0.03281084   -0.10177361    0.01953406   -0.01246159
C    1.61222851    1.31408548   -0.06603672   -0.10450951    0.02129970   -0.01225836
C    1.76839179   -1.29357563    0.03865153    0.10239583   -0.02828401   -0.00859088
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H    0.11200545   -2.63923515    0.35536197    0.00327987    0.01117759    0.00363119
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H    2.33341011   -2.05104954    0.54375659   -0.02147326    0.00572463    0.01188503
C    2.19396670    0.05215622   -0.12749301   -0.08390083    0.01112158    0.01732384
H    3.33493487    0.15440593   -0.30719789    0.03277421    0.00676357   -0.01201987
   15
   -420.46339700
H   -2.51217236    0.48715571   -0.27528789    0.03400213    0.05055516    0.00730808
O   -2.00248059    1.22524081   -0.02796814   -0.08513266   -0.04926825   -0.02016332
O   -1.96450769   -1.20745533   -0.02882563    0.00287436    0.01971611    0.01461610
C   -0.69195641    0.74370009    0.01085652    0.06497045    0.04450897    0.02350471
C   -0.78174300   -0.83369503   -0.13291456    0.01143443   -0.06364051   -0.01920014
C    0.36856147    1.57447238    0.20838271    0.15934343   -0.09522098   -0.03227188
C    0.35401626   -1.62977289    0.04645550   -0.06365645    0.01330626   -0.01209291
C    1.60565312    1.32232667   -0.04712205   -0.11830369    0.04324898   -0.00188985
C    1.78875531   -1.29702310    0.03689955    0.11638208   -0.01837000   -0.01215147
H   -0.11373782    2.68915686    0.52721170   -0.03816246    0.05340166    0.01893685
H    0.08452792   -2.62190525    0.41331848   -0.00308617    0.00282148    0.00725794
H    2.30370933    2.14002530    0.12550162   -0.00444177    0.00147012    0.01144735
H    2.31010418   -2.07503906    0.55986785   -0.02588639    0.00347420    0.01237792
C    2.19316941    0.03984476   -0.13958376   -0.08029788    0.00018461    0.01297403
H    3.33132457    0.07079772   -0.31828849    0.02999774   -0.00618728   -0.01068099
   15
   -420.48325532
H   -2.54976470    0.42695286   -0.30269143   -0.01132569   -0.01126285   -0.01570688
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O   -1.97019236   -1.21904426   -0.03763828    0.00781581    0.01540114    0.01511311
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   15
   -420.48463746
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   15
   -420.46660220
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   15
   -420.46238371
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   15
   -420.47252078
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   15
   -420.46539434
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   15
   -420.44400365
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O   -2.00420870   -1.29107381   -0.10501418   -0.05417360   -0.03167833    0.00983826
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   15
   -420.43287700
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O   -2.00519558   -1.30007251   -0.11827976   -0.06310150   -0.03680054    0.00757273
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   15
   -420.44741163
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O   -2.00333977   -1.30740966   -0.13188790   -0.06664945   -0.03975998    0.00505937
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   15
   -420.46242632
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   15
   -420.46461151
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   15
   -420.45435127
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C    2.33510735   -0.00604249   -0.23923498    0.04195149    0.00032592   -0.03707416
H    3.36335336    0.14544541   -0.41099351   -0.02718469    0.01260746    0.00764675
   15
   -420.46105725
H   -2.81710343    0.55231519    0.20154979   -0.05803941   -0.03176466    0.01340686
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   15
   -420.48057633
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O   -1.95193769   -1.31893942   -0.20119719   -0.02801173   -0.01465383   -0.00290460
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   15
   -420.47307611
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C   -0.81809251   -0.77520338   -0.09145668    0.01901937   -0.02459625   -0.00145206
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   15
   -420.45608041
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C    1.71199160    1.15275862    0.06439236    0.03803071   -0.07892302    0.02424341
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   15
   -420.45870303
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O   -1.90307172   -1.31564620   -0.24184038    0.03910565    0.02030981    0.00268859
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C   -0.81605960   -0.80210910   -0.07012739    0.00639002   -0.07227248    0.00464314
C    0.34017995    1.54240762    0.05395810    0.06847503   -0.05589838   -0.01455550
C    0.30823708   -1.52158523    0.30721854   -0.12019021   -0.00291036    0.01997646
C    1.69616142    1.15925706    0.05364522    0.00478555   -0.05931026    0.02108947
C    1.77066971   -1.23675642    0.05386483    0.05849199    0.02590833    0.00959410
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   15
   -420.45818704
H   -2.79620668    0.56047818    0.33835397   -0.03837723   -0.02189780    0.01711583
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O   -1.88887518   -1.31566106   -0.25548718    0.05995102    0.03018862    0.00532633
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C    0.35811999    1.51937652    0.03722909    0.09350211   -0.07268695   -0.01921167
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H    2.29131973   -2.19969592   -0.07826707   -0.00225564   -0.01966677   -0.00771048
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   15
   -420.45628922
H   -2.81764774    0.49327142    0.35312960   -0.05468508   -0.04709550    0.02196374
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O   -1.87736617   -1.31702950   -0.26937206    0.07215041    0.03579200    0.00701212
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C    1.66634289    1.18164207    0.02855021   -0.08413099   -0.01423208    0.01301290
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C    2.40320563    0.01321806   -0.19191578    0.02019449    0.00322436   -0.00161514
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   15
   -420.45607790
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O   -1.86908394   -1.31999985   -0.28356769    0.07199808    0.03557390    0.00677338
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C    1.65764049    1.19481671    0.01469131   -0.12174971    0.00822350    0.00798843
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   15
   -420.45156225
H   -2.74701332    0.46319778    0.33611677   -0.03689875   -0.04954810    0.01792291
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O   -1.86402091   -1.32456215   -0.29806148    0.05933232    0.02950594    0.00414811
C   -0.80825543    0.76067437   -0.04999668    0.03867541    0.03521479   -0.02510354
C   -0.81227811   -0.79975504   -0.03004759   -0.00839450   -0.07914928    0.00029820
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C    1.65620255    1.20750110    0.00034707   -0.13998249    0.02920901    0.00337839
C    1.73026508   -1.19624096    0.02192819    0.05578597    0.03855618   -0.01465435
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C    2.41655928    0.01553796   -0.17408553    0.07227236    0.00500678   -0.00690884
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   15
   -420.45655012
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O   -1.86161707   -1.33044720   -0.31273552    0.03793434    0.01919424   -0.00058995
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   15
   -420.46510116
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O   -1.86092418   -1.33719560   -0.32737754    0.01374504    0.00681953   -0.00675664
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C   -0.80761545   -0.76899957   -0.01055502    0.01920833   -0.03069166    0.00383066
C    0.35553743    1.44353566   -0.03237581    0.06264832   -0.02545032   -0.02382635
C    0.37179827   -1.51322761    0.35452798    0.01103273   -0.02048652    0.03172018
C    1.67806423    1.22656705   -0.02874620   -0.10809584    0.05793017   -0.00332473
C    1.68949282   -1.19038406    0.00974931    0.01996968    0.02660605   -0.01744836
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H    2.35926389    2.01673774    0.30611125    0.00960414   -0.01081951    0.01545306
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C    2.41415494    0.01666712   -0.15509012    0.05194124    0.00707622    0.00792895
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   15
   -420.45650222
H   -2.54282183    0.57113955    0.23796812    0.08576718    0.09312030   -0.00617775
O   -2.13665542    1.35930895    0.17777845   -0.12074066   -0.05204477    0.01674286
O   -1.86086602   -1.34425209   -0.34171066   -0.00761060   -0.00594245   -0.01361046
C   -0.85665927    0.72953669    0.02078554   -0.01710787   -0.02583413   -0.00620041
C   -0.80656145   -0.75004708   -0.00108987    0.03164812   -0.00058035    0.00717065
C    0.33963698    1.42843837   -0.04401771    0.02636135   -0.08356962   -0.04187637
C    0.39015580   -1.51192202    0.35680972    0.04213611   -0.03594315    0.03138712
C    1.69948368    1.23123826   -0.04308473   -0.06758959    0.06055639   -0.00632352
C    1.66669222   -1.19003345    0.00522102   -0.01440381    0.02624965   -0.01415660
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H    2.35285393    2.01579250    0.31800774    0.00301844   -0.01571988    0.01525148
H    2.12264659   -2.16822700    0.02028725   -0.03097557   -0.00191284    0.00606811
C    2.40768887    0.01663159   -0.14601488    0.02541389    0.01075296    0.01735040
H    3.46670380   -0.10364831   -0.45673454    0.01166236   -0.01055035   -0.01446595
   15
   -420.45323293
H   -2.55573495    0.52964362    0.20783346    0.05684355    0.03334544    0.00007622
O   -2.12628512    1.36167991    0.17862128   -0.07695859    0.00777012    0.00828689
O   -1.86048608   -1.35104210   -0.35542658   -0.02284790   -0.01787936   -0.02037823
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C   -0.80738878   -0.73106008    0.00793960    0.03783425    0.02959146    0.01090248
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   15
   -420.44839002
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O   -2.11244744    1.36371178    0.17906739   -0.02316347    0.07150637    0.00418965
O   -1.85909405   -1.35702769   -0.36822134   -0.03158220   -0.02799236   -0.02619626
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C    1.75201359    1.23005736   -0.07038864    0.01169706    0.04083643   -0.01464373
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   15
   -420.44483101
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O   -1.85628897   -1.36175375   -0.37983455   -0.03501406   -0.03530823   -0.03017283
C   -0.89765520    0.71114031    0.09529034   -0.04571633   -0.05961175    0.00788732
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C    0.29002137    1.41637200   -0.06277014   -0.04933096   -0.09772222   -0.04642084
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C    1.77838091    1.22539473   -0.08284967    0.04007121    0.01937977   -0.02011107
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C    2.38337695    0.01164509   -0.12596698   -0.01138179    0.02035527    0.02119859
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   15
   -420.45099454
H   -2.72857827    0.41804263    0.11362526   -0.02944945   -0.06471176   -0.00086465
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O   -1.85190981   -1.36489123   -0.39008771   -0.03449806   -0.03906937   -0.03175773
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C   -0.82353493   -0.69077634    0.03023479    0.03364384    0.08844164    0.01972936
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C    1.80235527    1.21957804   -0.09410017    0.06233721   -0.00564111   -0.02445726
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H    2.35915499   -2.05144655    0.02376142    0.02033645   -0.00929959    0.00165841
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   15
   -420.46244713
H   -2.76311711    0.46201298    0.08157531   -0.03716299   -0.05945321   -0.00388483
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C   -0.91171716    0.71538243    0.14300171   -0.07108056   -0.04011175    0.01794701
C   -0.83320295   -0.68683925    0.03548166    0.02892682    0.08984924    0.01996110
C    0.26902855    1.43702099   -0.06140883   -0.05233305   -0.02451317   -0.02951467
C    0.40836145   -1.48098667    0.34621662    0.10529473    0.03095045    0.00841562
C    1.82257793    1.21409723   -0.10388497    0.08085726   -0.02959980   -0.02617393
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H    2.40259119   -1.99987404    0.01892414    0.02255807    0.00384933   -0.00022933
C    2.36912819    0.00268646   -0.11893579    0.00531270    0.01329539    0.01244710
H    3.41767949   -0.17602823   -0.17074036   -0.01799923   -0.00654439   -0.00051631
   15
   -420.46717786
H   -2.77158850    0.54806190    0.05225796   -0.03252980   -0.04120476   -0.00554903
O   -2.06124627    1.33671069    0.17910668    0.07432875    0.03248892    0.00282167
O   -1.83867938   -1.36589722   -0.40634937   -0.02237554   -0.03483801   -0.02689423
C   -0.91272687    0.72152050    0.16538720   -0.08418023   -0.01641783    0.02245667
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C    0.26334313    1.45087828   -0.05773882   -0.05409204    0.05827200   -0.01894761
C    0.39138012   -1.47615976    0.34179883    0.06163460    0.03448989    0.01127114
C    1.83792524    1.21038066   -0.11210255    0.09633241   -0.04826782   -0.02478778
C    1.62587750   -1.21401023   -0.01569236   -0.07465928   -0.00787779   -0.00769565
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H    2.33318935    2.17565528    0.14157015   -0.00200149    0.01810317    0.01609930
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C    2.36187723   -0.00314280   -0.11668921    0.00908631    0.00526702    0.00932086
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   15
   -420.46918435
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O   -2.05498141    1.32341194    0.17877406    0.04904865   -0.02622478   -0.00397014
O   -1.83038466   -1.36395815   -0.41257901   -0.00908911   -0.02677633   -0.02036909
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C   -0.85730696   -0.69456350    0.04254120    0.01049455    0.06233150    0.01210106
C    0.26094755    1.46150435   -0.05286458   -0.05655836    0.08424699   -0.01798746
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C    1.84746874    1.20953297   -0.11883491    0.10740811   -0.05695219   -0.02068417
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H    2.33566588    2.18704623    0.06779499   -0.00465381    0.01769691    0.01153621
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C    2.35417587   -0.00928648   -0.11500346   -0.00576749   -0.00375903    0.00562976
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   15
   -420.46653707
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O   -2.05075775    1.31136749    0.17867190   -0.01804888   -0.09674606   -0.02250196
O   -1.82169921   -1.36081730   -0.41789371    0.00993581   -0.01526387   -0.01136972
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C   -0.87061173   -0.70458084    0.04482939   -0.00641445    0.03742597    0.00397160
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C    0.34925933   -1.47243672    0.33069119   -0.03229887    0.02191664    0.01789259
C    1.85054493    1.21206489   -0.12432268    0.11288281   -0.05303434   -0.01534278
C    1.65901028   -1.22305713   -0.02126268    0.02389352   -0.01096526   -0.02373634
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C    2.34688244   -0.01519480   -0.11364453   -0.03199172   -0.01435657   -0.00052496
H    3.41551301   -0.14196864    0.03885707   -0.00569523   -0.00584601    0.01063572
   15
   -420.45658607
H   -2.78084747    0.84200732   -0.03732550    0.06850115    0.06545290    0.02180855
O   -2.04593678    1.30345221    0.17954999   -0.02992748   -0.10451587   -0.02996995
O   -1.81348244   -1.35699262   -0.42269961    0.03358771   -0.00147759   -0.00051014
C   -0.88516460    0.73931691    0.22381410   -0.06075850    0.05231370    0.02933475
C   -0.88349892   -0.71684821    0.04688585   -0.02902926    0.00982164   -0.00581727
C    0.26479295    1.47230718   -0.04026242   -0.01060371   -0.03562289    0.00105766
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C    1.84682131    1.21775908   -0.12887867    0.11283847   -0.04022741   -0.01070578
C    1.67489056   -1.22660284   -0.02212673    0.04832112    0.00095011   -0.02926159
H   -0.23427131    2.51390212   -0.20506468   -0.04157948    0.02064757   -0.00297182
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H    2.35295258    2.17590769   -0.10109443   -0.00992670    0.00586252    0.00236147
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C    2.34149772   -0.02022713   -0.11224951   -0.05354057   -0.02638168   -0.00753019
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   15
   -420.44649745
H   -2.85789320    0.86666730   -0.08886992   -0.00860588    0.02382150    0.00090638
O   -2.04007941    1.30009245    0.18167981    0.03470655   -0.06449651   -0.01211909
O   -1.80679292   -1.35310139   -0.42748397    0.05795962    0.01235184    0.01067843
C   -0.86734865    0.74046492    0.23991389   -0.03579669    0.05946705    0.03228471
C   -0.89462072   -0.72971594    0.04929353   -0.05343309   -0.01648991   -0.01543618
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C    0.31409490   -1.47392070    0.31537509   -0.08738086    0.00686197    0.01827945
C    1.83630525    1.22588024   -0.13278059    0.10634860   -0.02611262   -0.00729745
C    1.68793603   -1.23023826   -0.02122832    0.05550263    0.01903553   -0.03331433
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H    2.37133505    2.16144042   -0.18968825   -0.00880860    0.00196054   -0.00086666
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C    2.33928427   -0.02367012   -0.11040697   -0.06202733   -0.03717529   -0.01304097
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   15
   -420.43223756
H   -2.93065501    0.87275901   -0.14137146   -0.06142510    0.00143083   -0.01696045
O   -2.03566787    1.29973416    0.18437950    0.07277410   -0.03987020    0.00265619
O   -1.80271221   -1.34975778   -0.43274334    0.07671256    0.02273851    0.01929784
C   -0.84737424    0.73805458    0.25406231   -0.00955269    0.05899694    0.03501073
C   -0.90253565   -0.74161383    0.05262021   -0.07293964   -0.03733763   -0.02211030
C    0.27230903    1.48914267   -0.02789225   -0.00055240   -0.06059131    0.02433751
C    0.30370347   -1.47550184    0.30605255   -0.09796428    0.01244219    0.01337454
C    1.81939728    1.23560262   -0.13624203    0.09193111   -0.01600450   -0.00376692
C    1.69766089   -1.23500960   -0.01832285    0.05512815    0.03425819   -0.03581203
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H    0.21081708   -2.49066806    0.61406481    0.01619179    0.01806611    0.00209029
H    2.39576115    2.14521987   -0.27764470   -0.00287915    0.00349906   -0.00433700
H    2.46070092   -2.04907672    0.03007332    0.02529566   -0.00049610   -0.00298141
C    2.34074840   -0.02488608   -0.10778845   -0.05570270   -0.04377100   -0.01601365
H    3.44931779   -0.07449498    0.17497650    0.02342242   -0.00221636    0.02512723
   15
   -420.42892127
H   -2.96135723    0.87684971   -0.18228110   -0.07809614   -0.00431472   -0.02464580
O   -2.03441739    1.30123286    0.18699514    0.07361152   -0.02840619    0.00793897
O   -1.80206786   -1.34741916   -0.43885637    0.08380954    0.02614808    0.02212404
C   -0.82681158    0.73210751    0.26609713    0.01461821    0.05225296    0.03698269
C   -0.90609395   -0.75129942    0.05725471   -0.08166701   -0.04912862   -0.02296237
C    0.27617067    1.50286127   -0.02358828   -0.00004795   -0.05614472    0.03143672
C    0.29918669   -1.47787714    0.29593874   -0.09848152    0.02605174    0.00509020
C    1.79696649    1.24630922   -0.13948306    0.07020609   -0.00898869    0.00113007
C    1.70406016   -1.24180565   -0.01326024    0.05281649    0.04028004   -0.03657175
H   -0.37765915    2.57018207   -0.41181919   -0.06013342    0.04747070   -0.02501328
H    0.17593164   -2.49764156    0.63421986    0.01093611    0.00758282    0.00719394
H    2.42203722    2.12629727   -0.36239897    0.00666240    0.00798418   -0.00902689
H    2.43528886   -2.11344130    0.04186515    0.02729804   -0.01623820   -0.00175934
C    2.34550665   -0.02348395   -0.10421614   -0.03438650   -0.04462120   -0.01601802
H    3.43034874   -0.04686903    0.18765044    0.01283287    0.00013008    0.02418731
   15
   -420.44280808
H   -2.93712198    0.88360201   -0.20588564   -0.07183593   -0.00199583   -0.02450406
O   -2.03642787    1.30403901    0.18927465    0.05224177   -0.02251375    0.00639572
O   -1.80517196   -1.34623539   -0.44594498    0.07670811    0.02129115    0.01750079
C   -0.80710897    0.72302587    0.27589978    0.03403909    0.04032584    0.03804774
C   -0.90477893   -0.75806715    0.06324158   -0.07742673   -0.05038273   -0.01667097
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   15
   -420.46393735
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C   -0.78943446    0.71153020    0.28340565    0.04742275    0.02336155    0.03826072
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C    0.28385763    1.53948128   -0.02077491   -0.00393389   -0.00914186    0.02709261
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C    1.74100261    1.26884190   -0.14652001    0.01639058    0.01052178    0.01160973
C    1.70747484   -1.26225433    0.00341419    0.04576029    0.02054573   -0.03293467
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H    2.33045335   -2.20260299    0.06859705    0.01075908   -0.02379704   -0.00020381
C    2.35897769   -0.01295220   -0.09438843    0.04054066   -0.03068725   -0.00877674
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   15
   -420.46742602
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O   -1.82084794   -1.34619050   -0.46194432    0.03268267   -0.00426353   -0.00774433
C   -0.77459661    0.69864812    0.28860089    0.05452765    0.00117457    0.03780763
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C    0.28801155    1.55938733   -0.02190224   -0.02538913    0.06181408   -0.00377425
C    0.31845371   -1.49717323    0.26582297   -0.04812716    0.04392857   -0.01593521
C    1.71069723    1.27947396   -0.15093164   -0.01033339    0.02591765    0.01366018
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   15
   -420.45198797
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O   -2.04670604    1.32026611    0.19774349   -0.10954984   -0.06222239   -0.06014626
O   -1.83146773   -1.34619781   -0.46973503    0.00763911   -0.01770577   -0.02172520
C   -0.76302634    0.68571256    0.29151299    0.05572369   -0.02431814    0.03663273
C   -0.87680361   -0.76254949    0.08401072   -0.02375883   -0.01338385    0.02515931
C    0.29369927    1.57548169   -0.02270793   -0.04281277    0.13923238   -0.04761154
C    0.33244725   -1.50883445    0.25725933   -0.01934402    0.03340869   -0.01748763
C    1.68100563    1.28852216   -0.15614996   -0.03490212    0.04459403    0.01188793
C    1.69991753   -1.28701064    0.02793869    0.03240007   -0.02985421   -0.02367452
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C    2.36377785    0.00483624   -0.08219869    0.06408831   -0.00855445   -0.01067125
H    3.40596804    0.05520728    0.09911139   -0.02335498    0.00276181    0.01251575
   15
   -420.46037654
H   -2.63760430    0.77804333   -0.26806885    0.02298919    0.03188156    0.01467253
O   -2.04362011    1.33008293    0.20428758   -0.06575301   -0.01498744   -0.02596462
O   -1.84245021   -1.34541184   -0.47655030   -0.01326560   -0.02853440   -0.03305579
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C   -0.86303103   -0.76122389    0.08908657   -0.00802047    0.00123062    0.03700296
C    0.30167263    1.58374205   -0.02096173   -0.00762627    0.11288939   -0.03399505
C    0.34760333   -1.52248686    0.24974002    0.01088744    0.01712515   -0.01642164
C    1.65341454    1.29486436   -0.16207004   -0.05734870    0.06485048    0.00681497
C    1.69299518   -1.29752223    0.04250157    0.01655512   -0.05049970   -0.01852564
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C    2.36046211    0.01484437   -0.07521832    0.04547523    0.00101229   -0.01273822
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   15
   -420.46018305
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O   -1.85285143   -1.34334121   -0.48187883   -0.02873121   -0.03670811   -0.04093574
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C   -0.84875367   -0.75996054    0.09194379    0.00381330    0.01342563    0.04503768
C    0.31004881    1.58544615   -0.01732840    0.04163906    0.03214438    0.01275359
C    0.36211114   -1.53716909    0.24320652    0.03913348   -0.00019851   -0.01391565
C    1.62927844    1.29730359   -0.16840112   -0.07721359    0.08125389    0.00155114
C    1.68512276   -1.30506596    0.05819065   -0.00910643   -0.05464502   -0.01447137
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C    2.35438930    0.02479826   -0.06748847    0.02754623    0.00919591   -0.01083368
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   15
   -420.43873885
H   -2.57887899    0.58813267   -0.35779949   -0.02414134   -0.04341659   -0.04118625
O   -2.03021633    1.34906485    0.21904168   -0.01206167    0.07912487    0.03633263
O   -1.86196819   -1.33961239   -0.48536232   -0.03913422   -0.04286696   -0.04555739
C   -0.74790185    0.66110123    0.28761952    0.04737839   -0.08072048    0.02732924
C   -0.83469120   -0.75949266    0.09209741    0.01254189    0.02234139    0.04907152
C    0.31600884    1.58500680   -0.01432439    0.07208354   -0.01447440    0.03510965
C    0.37427485   -1.55186911    0.23751670    0.06283239   -0.01171557   -0.01174683
C    1.60979946    1.29488216   -0.17484607   -0.09451408    0.08705918    0.00021774
C    1.67782654   -1.30937547    0.07476139   -0.03959472   -0.04513341   -0.01168372
H    0.07736348    2.57372195   -0.65517714    0.00682509    0.03927819   -0.04619004
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H    2.28540255    1.93505872   -0.67499685   -0.00734302   -0.03331649   -0.00012907
H    2.13149294   -2.28699499    0.13956349   -0.03149600   -0.00649346    0.00153061
C    2.34661119    0.03420309   -0.05911950    0.01717162    0.01595625   -0.00573093
H    3.50452698    0.10853947   -0.06586652    0.04196795    0.00679873    0.00690441
   15
   -420.42464823
H   -2.52821265    0.52924359   -0.36575430   -0.01720063   -0.05093288   -0.04342965
O   -2.02232407    1.35406711    0.22449507   -0.01276240    0.09407293    0.04203447
O   -1.86932301   -1.33394566   -0.48678821   -0.04588360   -0.04708020   -0.04765261
C   -0.74883309    0.66139958    0.28273409    0.04146030   -0.08739159    0.02357113
C   -0.82137913   -0.76035802    0.08930061    0.01962095    0.02766961    0.04964550
C    0.31769022    1.58529691   -0.01334947    0.08600434   -0.03170005    0.03843582
C    0.38267385   -1.56591756    0.23254382    0.07933479   -0.01218407   -0.01074561
C    1.59601828    1.28726981   -0.18133520   -0.10778903    0.07826762    0.00480661
C    1.67290018   -1.31096523    0.09204282   -0.06519235   -0.03329534   -0.00973129
H    0.10433369    2.65625579   -0.67739821    0.00715007    0.05796777   -0.05407143
H   -0.02896772   -2.52598376    0.45060557   -0.01191135    0.02600244    0.00488615
H    2.24104732    1.95820621   -0.69289760   -0.00833039   -0.02630643   -0.00240425
H    2.15738723   -2.30751750    0.15284482   -0.02150686   -0.02367223    0.00253089
C    2.33775618    0.04264954   -0.05041077    0.01450319    0.02143258    0.00073655
H    3.49301284    0.11763693   -0.13449272    0.04252839    0.00714820    0.00142489
   15
   -420.43092458
H   -2.46557832    0.50653260   -0.34288962   -0.00287736   -0.04947999   -0.03765993
O   -2.01384573    1.35484522    0.22806814   -0.01577211    0.09669183    0.04014786
O   -1.87460371   -1.32615210   -0.48605834   -0.05050200   -0.04879339   -0.04800995
C   -0.75224852    0.66694594    0.27642354    0.03092513   -0.08663319    0.01972072
C   -0.80925377   -0.76287857    0.08351354    0.02666633    0.02933032    0.04777160
C    0.31424604    1.58743869   -0.01466905    0.08473402   -0.03514352    0.03521513
C    0.38633256   -1.57928079    0.22822153    0.08422682   -0.00263926   -0.00981697
C    1.58870210    1.27499036   -0.18813034   -0.11025689    0.05640274    0.01234426
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H    2.19879284   -2.31141035    0.16434773   -0.01179583   -0.03413384    0.00280435
C    2.32798766    0.04980258   -0.04174354    0.01914057    0.02630711    0.00657973
H    3.45157777    0.12160684   -0.20421101    0.03119325    0.00700561   -0.00288833
   15
   -420.45317043
H   -2.40128129    0.51880928   -0.29339910    0.01850286   -0.03651213   -0.02333852
O   -2.00464822    1.35129260    0.22985068   -0.02001843    0.08361109    0.02963365
O   -1.87759893   -1.31615602   -0.48315536   -0.05343737   -0.04749730   -0.04692652
C   -0.75750577    0.67769561    0.26892001    0.01477867   -0.07863323    0.01594870
C   -0.79874594   -0.76715353    0.07484456    0.03455388    0.02709285    0.04440733
C    0.30574957    1.59165892   -0.01810425    0.06911385   -0.02863114    0.02876154
C    0.38497676   -1.59249999    0.22448581    0.07348511    0.01010982   -0.00748731
C    1.58796607    1.25933598   -0.19565891   -0.09551865    0.02722186    0.01746682
C    1.67540338   -1.30847905    0.12829589   -0.07296634   -0.02366387   -0.00733128
H    0.14076731    2.69409863   -0.60658434    0.01295553    0.05972887   -0.04784069
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C    2.31702797    0.05536289   -0.03345978    0.03020424    0.03147421    0.00954998
H    3.38837033    0.12055035   -0.27204918    0.00857778    0.00648588   -0.00391146
   15
   -420.47660950
H   -2.35087786    0.55588176   -0.22790443    0.04920728    0.00118264    0.00394823
O   -1.99452120    1.34405417    0.23034351   -0.02978538    0.04218155    0.00491762
O   -1.87817977   -1.30401544   -0.47812974   -0.05356694   -0.04340291   -0.04406618
C   -0.76363573    0.69316689    0.26044811   -0.00535892   -0.06377741    0.01298166
C   -0.79032746   -0.77304619    0.06349567    0.04219241    0.02071279    0.03983772
C    0.29312997    1.59752531   -0.02324369    0.04208412   -0.00420507    0.01498782
C    0.37925130   -1.60631279    0.22119541    0.04813097    0.01948280   -0.00371084
C    1.59292317    1.24204462   -0.20421808   -0.06431925   -0.00395343    0.01758670
C    1.68329067   -1.30498612    0.14711893   -0.05258316   -0.02604597   -0.00621314
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H    0.04221433   -2.67368597    0.26964901   -0.01202853   -0.01627163    0.00216605
H    2.13354192    2.09283745   -0.71589608   -0.00315009    0.02109389   -0.01839028
H    2.30230787   -2.24598825    0.18168669   -0.00088840   -0.02828717    0.00153273
C    2.30424031    0.05901611   -0.02573344    0.04094283    0.03733496    0.00877443
H    3.31928226    0.11482467   -0.33731355   -0.01837409    0.00602367   -0.00113426
   15
   -420.48451939
H   -2.33614393    0.59074876   -0.16558026    0.08160716    0.05626321    0.03408913
O   -1.98302369    1.33499782    0.23064478   -0.04240211   -0.01956408   -0.02552339
O   -1.87634832   -1.28991299   -0.47111322   -0.04881541   -0.03729764   -0.03892362
C   -0.76945154    0.71245969    0.25117976   -0.02334098   -0.04168946    0.01224381
C   -0.78444121   -0.78017329    0.04974607    0.04585170    0.01075418    0.03352666
C    0.27800761    1.60345454   -0.02921755    0.00643115    0.05776073   -0.01223137
C    0.37065592   -1.62127028    0.21812735    0.01466605    0.02220761    0.00047325
C    1.60172048    1.22498587   -0.21381935   -0.02323518   -0.03382809    0.01343592
C    1.69430304   -1.29989932    0.16631531   -0.02129370   -0.03198979   -0.00462091
H    0.13868314    2.57779004   -0.40654246    0.02478749   -0.02308880   -0.00463635
H    0.08411947   -2.71381691    0.20450555   -0.00761646   -0.02371425   -0.00133176
H    2.10240975    2.12211489   -0.70089660   -0.00779780    0.02793385   -0.01620612
H    2.35669823   -2.18080011    0.18841434   -0.00182467   -0.01342220    0.00041529
C    2.28905399    0.06041070   -0.01853949    0.03653852    0.04334108    0.00854834
H    3.26271079    0.10471433   -0.40171881   -0.03359843    0.00633060    0.00072803
   15
   -420.48353682
H   -2.37785519    0.58879272   -0.12541363    0.07639078    0.05451781    0.02786070
O   -1.96972474    1.32660992    0.23196731   -0.02337261   -0.02805244   -0.02311284
O   -1.87232758   -1.27412450   -0.46234011   -0.03724308   -0.02948402   -0.03124987
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C   -0.78128450   -0.78794139    0.03398106    0.04099831   -0.00111000    0.02480034
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   15
   -420.49352954
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   15
   -420.49081531
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   15
   -420.46292345
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   15
   -420.43722598
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   15
   -420.43236316
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   15
   -420.44613918
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   15
   -420.45870392
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   15
   -420.46316168
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   15
   -420.47269008
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   15
   -420.46627098
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O   -1.88608659   -1.12793508   -0.36656121   -0.00373368    0.03679619    0.00204359
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   15
   -420.46654445
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H    2.40167297    1.87910926   -0.52758267    0.00402943   -0.02971018    0.00692101
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   15
   -420.45541320
H   -2.79815382    0.46084751    0.49135701   -0.06907563   -0.04819887    0.02688385
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O   -1.90814693   -1.11708780   -0.35297449   -0.03960170    0.03428214   -0.00572869
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   15
   -420.44258437
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   15
   -420.44208870
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   15
   -420.44138302
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   15
   -420.43957209
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   15
   -420.45869548
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   15
   -420.45972077
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   15
   -420.44314853
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   15
   -420.44865308
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O   -1.91115029   -1.13449550   -0.28786361    0.01465345    0.04340550   -0.00079910
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C    1.69178474   -1.29603481    0.41777524    0.05438004   -0.04978506    0.05821502
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   15
   -420.45369342
H   -2.47794557    0.17373154    0.48623032   -0.01979539   -0.06163219    0.02601428
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   15
   -420.45265766
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O   -1.90230271   -1.15605942   -0.27011868    0.06398793    0.04833714    0.00479462
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   15
   -420.45538825
H   -2.43322511    0.28661566    0.36935722    0.01656255    0.00784598    0.00785841
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O   -1.90168639   -1.17007838   -0.26150338    0.07532006    0.04631485    0.00748364
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C    0.29737074    1.58945220    0.04445798   -0.06612118   -0.12196481    0.03654913
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C    1.68485990    1.26593324   -0.28623508    0.05914120    0.03973002   -0.02237034
C    1.68265179   -1.27336579    0.38538707    0.03535994   -0.02211759    0.02048284
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H    2.32666130   -1.88398140    1.11371822    0.02063779   -0.00980382    0.03185352
C    2.24078973   -0.01213492   -0.07721755   -0.03682986   -0.03192077   -0.02282617
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   15
   -420.45563369
H   -2.42064061    0.35014693    0.29830918    0.05959868    0.08305467    0.00559939
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O   -1.90443891   -1.18618034   -0.25322395    0.07388652    0.03943185    0.00923882
C   -0.74322668    0.81767410   -0.01613251    0.02808235    0.09374931    0.00037521
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   15
   -420.46609479
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   15
   -420.47915642
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   15
   -420.46966682
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   15
   -420.44647947
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   15
   -420.44582452
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   15
   -420.45599197
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   15
   -420.45598695
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   15
   -420.45460429
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   15
   -420.45560405
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   15
   -420.45868876
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O   -1.99439439   -1.32714765   -0.20667243   -0.06311156   -0.06422858    0.02505656
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   15
   -420.46118134
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O   -1.99526315   -1.32745982   -0.20758755   -0.06239779   -0.05594294    0.02382759
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C    1.76348989    1.18365115   -0.19004627    0.00343395   -0.10345453    0.00416515
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   15
   -420.46017054
H   -2.34543586    0.32378899    0.07183809    0.08474009    0.09178942    0.01993245
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O   -1.99332943   -1.32523712   -0.20958192   -0.05403907   -0.04656853    0.02209081
C   -0.69341810    0.69697444   -0.06332100    0.06046625   -0.07705063   -0.02171261
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   15
   -420.45838289
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   15
   -420.45622784
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   15
   -420.45458424
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   15
   -420.44320037
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O   -1.97163032   -1.30182174   -0.22623685    0.06608509    0.02562914    0.01117131
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   15
   -420.43627645
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   15
   -420.44289253
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O   -1.97180692   -1.29304777   -0.23815413    0.11078009    0.05542295    0.01202511
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C    2.38747369   -0.00256869    0.05848362    0.02110403   -0.05347832    0.00540906
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   15
   -420.45908641
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O   -1.97900412   -1.29213400   -0.24491105    0.09976192    0.05378748    0.01114300
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C    1.83409626    1.29956283   -0.12340901    0.02317010    0.02120840    0.00714649
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   15
   -420.46614924
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O   -1.99064993   -1.29362090   -0.25216146    0.06837197    0.04168184    0.00715141
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C    1.82739651    1.31235524   -0.11602780    0.00505034    0.02710342    0.00759585
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C    2.40013491    0.00502989    0.05231151    0.05647789   -0.05160314    0.00022484
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   15
   -420.46866730
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O   -2.00536704   -1.29697871   -0.25972457    0.02867905    0.02408088    0.00005785
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C   -0.90853661   -0.79324045   -0.11255162   -0.03904513   -0.06509050   -0.00536704
C    0.41896677    1.52327308   -0.19654086    0.07790230   -0.01221817   -0.03309127
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   15
   -420.47772788
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O   -2.02139945   -1.30142577   -0.26728278   -0.00760342    0.00545602   -0.00905648
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C    1.65508009   -1.22393242    0.15347639   -0.03736854   -0.07409784    0.01939140
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   15
   -420.46325749
H   -2.68934913    0.43536238    0.55732382   -0.03847858   -0.02151837    0.02708381
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O   -2.03712199   -1.30612598   -0.27442793   -0.03479091   -0.01172298   -0.01874455
C   -0.85884361    0.70996258   -0.02837308   -0.12023443    0.05185020    0.00312760
C   -0.89517264   -0.75597473   -0.06998975    0.00564841    0.00977367    0.01144053
C    0.43638623    1.51517543   -0.19812251    0.07672633    0.08683084   -0.01849946
C    0.34008763   -1.47924525    0.15187083    0.03969291    0.03447640    0.01857835
C    1.80713148    1.33788588   -0.09627908    0.00306555    0.07052957    0.00183521
C    1.67133909   -1.22864300    0.13928841   -0.03286592   -0.06782508    0.01700965
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H    2.35478939   -2.01287974   -0.05194415   -0.00780641    0.02752247   -0.01208739
C    2.40005286    0.03771161    0.04422332   -0.00678421   -0.01318622   -0.01813163
H    3.53026360   -0.01006535    0.27839039    0.03546344   -0.00057757    0.01587187
   15
   -420.45374289
H   -2.72282678    0.38678859    0.57812779   -0.05352058   -0.03909582    0.03569434
O   -1.98027162    1.19643851    0.26741825    0.10922310   -0.02449435   -0.03226301
O   -2.05130085   -1.31030603   -0.28072655   -0.05277286   -0.02592930   -0.02745121
C   -0.87438309    0.70374718   -0.02246325   -0.14093897    0.04645705    0.00264109
C   -0.88838696   -0.73706171   -0.04948544    0.01710997    0.04738836    0.01961546
C    0.43786804    1.50478581   -0.19706845    0.10357858    0.04387114   -0.02043435
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C    1.80048855    1.33925107   -0.09011736    0.01033661    0.07867345    0.00072188
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   15
   -420.45230355
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O   -2.06310915   -1.31332310   -0.28578759   -0.06436815   -0.03656493   -0.03406101
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C   -0.88261220   -0.72099771   -0.03016315    0.02380884    0.08163359    0.02693694
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C    1.79327812    1.33597636   -0.08401017    0.00698396    0.06439302    0.00164762
C    1.70961733   -1.22719655    0.10796952   -0.02088204   -0.02129521    0.01009364
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   15
   -420.45424517
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O   -2.07200863   -1.31469455   -0.28931278   -0.07271306   -0.04360049   -0.03813196
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C   -0.87826654   -0.70984313   -0.01246419    0.02832789    0.11031663    0.03317789
C    0.42039407    1.47947403   -0.19160359    0.13685105   -0.04485204   -0.00805654
C    0.36398880   -1.56688179    0.14158152    0.02094609   -0.04647757    0.01668929
C    1.78567529    1.32889293   -0.07800621   -0.00201847    0.03358671    0.00331289
C    1.73086218   -1.22376435    0.09127178   -0.00399458    0.00166714    0.00263751
H   -0.15058447    2.52380472   -0.29930340   -0.04752487    0.02712400   -0.00246587
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H    2.45494014   -2.10367274    0.05062081    0.02013789   -0.02176147   -0.00719627
C    2.39952087    0.07706258    0.04495114    0.01143924    0.03439945   -0.01553494
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   15
   -420.45931169
H   -2.60700282    0.41888438    0.48898958   -0.01871405   -0.03814350    0.02273878
O   -1.98030371    1.26213849    0.25021561    0.06274895    0.01435548   -0.01447455
O   -2.07761465   -1.31410067   -0.29111649   -0.07942085   -0.04717542   -0.03992489
C   -0.86966686    0.67405287   -0.00507766   -0.12062142   -0.03650039   -0.00537893
C   -0.87563140   -0.70531688    0.00323363    0.03222662    0.13025404    0.03834009
C    0.39954563    1.46976970   -0.18790252    0.11818671   -0.05748758   -0.00015620
C    0.36863224   -1.59229053    0.13604950    0.01041957   -0.05442121    0.01425350
C    1.77816378    1.31977087   -0.07220015   -0.00538862    0.00361715    0.00455223
C    1.75232106   -1.22040210    0.07442117    0.01840405    0.01849860   -0.00616178
H   -0.14569748    2.57470580   -0.36253779   -0.04621715    0.04584848   -0.00959335
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H    2.46648354   -2.11708372    0.09816221    0.01917607   -0.02693141   -0.00205532
C    2.39901864    0.08714057    0.04734495    0.03759894    0.04048956   -0.00704447
H    3.41017383   -0.03609671    0.30673259   -0.03067827   -0.01032339    0.00322148
   15
   -420.46382273
H   -2.52446952    0.48721090    0.41912329    0.02926451    0.00260001    0.00441948
O   -1.98758630    1.28357786    0.24636113    0.00418407   -0.00665469    0.00478103
O   -2.07962398   -1.31137747   -0.29111384   -0.08422995   -0.04777642   -0.04034326
C   -0.85232874    0.66597604    0.00113592   -0.09474533   -0.06149395   -0.00793751
C   -0.87494207   -0.70860472    0.01661858    0.03537876    0.13753959    0.04232263
C    0.37163041    1.46349885   -0.18418648    0.08303215   -0.06105248    0.00664693
C    0.37263667   -1.61444145    0.12966003    0.00159015   -0.05563799    0.01094529
C    1.77092957    1.31037763   -0.06666669    0.00063859   -0.01624915    0.00525817
C    1.77265618   -1.21811672    0.05794194    0.04302279    0.02694627   -0.01470365
H   -0.10796899    2.59325899   -0.41893387   -0.03741137    0.05285777   -0.01558350
H    0.00929610   -2.64863240    0.23900339   -0.01484850   -0.00580985    0.00282360
H    2.42523960    2.24678371   -0.06092023    0.02201452    0.02460951    0.00181041
H    2.46456266   -2.11159104    0.14720216    0.01248358   -0.02384723    0.00278040
C    2.39629404    0.09478725    0.05017375    0.05299677    0.04316532   -0.00042213
H    3.38438050   -0.02500770    0.29606318   -0.05341482   -0.00918516   -0.00282025
   15
   -420.46381162
H   -2.46416626    0.55100714    0.34596032    0.09118200    0.07874441   -0.01072206
O   -1.99498484    1.30549133    0.24229326   -0.06873583   -0.06440468    0.02169638
O   -2.07782411   -1.30649458   -0.28928195   -0.08566832   -0.04616352   -0.04036274
C   -0.82930500    0.66153647    0.00783404   -0.05976081   -0.07031387   -0.01141993
C   -0.87637803   -0.72013457    0.02745017    0.03552885    0.12977622    0.04505776
C    0.33876223    1.46088984   -0.18086541    0.03396906   -0.05813323    0.01190799
C    0.37653596   -1.63323834    0.12260888   -0.00543087   -0.05456202    0.00758112
C    1.76362128    1.30190733   -0.06144908    0.01372391   -0.02414870    0.00553186
C    1.79039076   -1.21741171    0.04234298    0.06735167    0.02564363   -0.02146187
H   -0.04365319    2.57442306   -0.46424999   -0.02267364    0.04806538   -0.01911162
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H    2.41376713    2.24494711   -0.04046836    0.02308897    0.02593520    0.00261934
H    2.45393428   -2.08941578    0.19435161    0.00112400   -0.01269030    0.00576446
C    2.39053693    0.09982133    0.05306711    0.03607017    0.04580899   -0.00098035
H    3.39493465   -0.00716089    0.28692745   -0.04275825   -0.01013672   -0.00113023
   15
   -420.47547775
H   -2.46534853    0.56340984    0.27901204    0.08898732    0.07413019   -0.00450292
O   -1.99951832    1.33001031    0.23733029   -0.07988736   -0.04597216    0.01852512
O   -2.07215658   -1.29952515   -0.28561986   -0.08192856   -0.04235830   -0.04001141
C   -0.80273671    0.66124583    0.01523375   -0.01124156   -0.05883588   -0.01694815
C   -0.87992749   -0.73944368    0.03556363    0.02878227    0.10822349    0.04636878
C    0.30390327    1.46174103   -0.17824559   -0.02754004   -0.04389137    0.01319350
C    0.38075567   -1.64873417    0.11509503   -0.01082393   -0.05364852    0.00501585
C    1.75546432    1.29483219   -0.05656377    0.03058763   -0.01895125    0.00537513
C    1.80406901   -1.21821763    0.02802788    0.08817072    0.01671544   -0.02554633
H    0.03662905    2.52208379   -0.49614121   -0.00212607    0.02446982   -0.01683696
H    0.03948654   -2.70139440    0.27670412   -0.01695287   -0.01557586    0.00655633
H    2.38610087    2.22504066   -0.02188226    0.01688093    0.01702187    0.00308446
H    2.44262081   -2.05841087    0.23751782   -0.01206765    0.00335437    0.00602288
C    2.38270498    0.10209567    0.05603753   -0.00142613    0.04622130   -0.00500043
H    3.43488451    0.01796638    0.27835191   -0.00939411   -0.01082400    0.00467365
   15
   -420.48323074
H   -2.52696658    0.52731046    0.21547094    0.02923634   -0.00610404    0.00118108
O   -2.00064811    1.35632587    0.23151774   -0.03560117    0.04339076    0.01557515
O   -2.06279761   -1.29064487   -0.28014747   -0.07128439   -0.03550956   -0.03825925
C   -0.77554591    0.66442970    0.02366360    0.04819738   -0.03087784   -0.02351096
C   -0.88517543   -0.76524806    0.04088413    0.01375707    0.07669110    0.04542092
C    0.27073643    1.46515501   -0.17638132   -0.09367977   -0.01259060    0.00637924
C    0.38562486   -1.66098051    0.10727160   -0.01512922   -0.05368255    0.00364798
C    1.74545353    1.28883293   -0.05200164    0.04812786   -0.00005694    0.00485035
C    1.81246119   -1.22003727    0.01525071    0.09971681    0.00845381   -0.02837305
H    0.11831317    2.45369246   -0.51655139    0.02008402   -0.02401719   -0.00416930
H    0.07271679   -2.71225181    0.28911685   -0.01481322   -0.01205233    0.00706326
H    2.34668841    2.19348172   -0.00547479    0.00396764   -0.00177902    0.00284017
H    2.43973949   -2.02961068    0.27642353   -0.02077982    0.01585631    0.00514567
C    2.37492169    0.10160517    0.05929498   -0.03258451    0.04079113   -0.00628416
H    3.48185615    0.05069822    0.26654370    0.02076853   -0.00849921    0.00847275
   15
   -420.46517448
H   -2.61081859    0.49298467    0.15162999   -0.01549682   -0.05075419   -0.00195148
O   -2.00009276    1.38084917    0.22497145   -0.00509171    0.09398319    0.01948449
O   -2.05023486   -1.28017046   -0.27294990   -0.05250547   -0.02411852   -0.03368673
C   -0.75126371    0.66944652    0.03351223    0.10632844    0.00394571   -0.02944905
C   -0.89122289   -0.79566433    0.04347374   -0.00783195    0.03987093    0.04129373
C    0.24316936    1.46933668   -0.17488145   -0.14715799    0.01496919   -0.00347282
C    0.39140669   -1.66997763    0.09922228   -0.01888062   -0.05416074    0.00329860
C    1.73255325    1.28279902   -0.04773170    0.06116315    0.02570964    0.00405204
C    1.81489829   -1.22241741    0.00420125    0.09655781    0.00940071   -0.03338522
H    0.18607955    2.40281497   -0.53432631    0.03357007   -0.07341665    0.01326619
H    0.11651616   -2.71469713    0.29651180   -0.01105185   -0.00417137    0.00645268
H    2.30457976    2.16345366    0.00893231   -0.01127662   -0.02413274    0.00187533
H    2.45115851   -2.01149441    0.31145257   -0.01874772    0.01663591    0.00699549
C    2.36902202    0.09867568    0.06291216   -0.04690360    0.02988293   -0.00363382
H    3.51470980    0.08940078    0.24884094    0.03736945   -0.00367659    0.00887546
   15
   -420.44900622
H   -2.68481147    0.49331413    0.08931408   -0.03860563   -0.06327160   -0.00733785
O   -1.99924160    1.40123866    0.21754244    0.00820963    0.10948000    0.02339407
O   -2.03532181   -1.26862246   -0.26423750   -0.02520678   -0.00730554   -0.02554035
C   -0.73333563    0.67424658    0.04513107    0.14925341    0.03433095   -0.03315655
C   -0.89677098   -0.82848878    0.04358366   -0.03462770    0.00235286    0.03366637
C    0.22438678    1.47288154   -0.17326308   -0.17815488   -0.00645952    0.00337809
C    0.39832598   -1.67570820    0.09097189   -0.02169585   -0.05271938    0.00322260
C    1.71602000    1.27526926   -0.04370382    0.06119712    0.03989542    0.00264037
C    1.81156374   -1.22540366   -0.00481332    0.08013475    0.01747414   -0.04130181
H    0.23032259    2.40143846   -0.56053606    0.03680716   -0.07069257    0.01342552
H    0.16822857   -2.71420169    0.29928944   -0.00657576    0.00466051    0.00528117
H    2.27012565    2.15005468    0.02198112   -0.01888206   -0.03412562    0.00112850
H    2.47549721   -2.00475576    0.34119672   -0.00720392    0.00770085    0.01274819
C    2.36587887    0.09395111    0.06673654   -0.04519946    0.01656830    0.00160551
H    3.52145431    0.13070057    0.22489451    0.04061076    0.00199649    0.00687146
   15
   -420.44921667
H   -2.73172705    0.53849789    0.03227341   -0.04898039   -0.06310965   -0.01258785
O   -1.99873516    1.41671259    0.20905770    0.01361617    0.11017613    0.02572602
O   -2.01929447   -1.25675766   -0.25437793    0.00975923    0.01338596   -0.01440732
C   -0.72429975    0.67705243    0.05873215    0.16552912    0.04854370   -0.03225916
C   -0.90020311   -0.86146893    0.04167300   -0.06565053   -0.03247240    0.02298965
C    0.21625977    1.47696690   -0.17192320   -0.18458312   -0.05604119    0.02388788
C    0.40654536   -1.67827972    0.08253092   -0.02208929   -0.04545395    0.00229502
C    1.69587306    1.26545665   -0.03983029    0.04442662    0.02958133    0.00025532
C    1.80341501   -1.22943358   -0.01133249    0.05714620    0.02319171   -0.04871861
H    0.24817307    2.44831241   -0.59527573    0.03733707   -0.02538393   -0.00430839
H    0.22469236   -2.71682640    0.29823631   -0.00229569    0.00962022    0.00455352
H    2.24843314    2.15981146    0.03412334   -0.01326799   -0.02166986    0.00185960
H    2.50489708   -2.00352722    0.36172283    0.00660634   -0.00205773    0.01918914
C    2.36539562    0.08821785    0.07045775   -0.02854047    0.00453646    0.00812950
H    3.49970685    0.17059157    0.19609141    0.03104187    0.00710375    0.00338690
   15
   -420.45826733
H   -2.74402883    0.62854906   -0.01583545   -0.04758830   -0.05262779   -0.01557206
O   -1.99881782    1.42722675    0.19941471    0.01071075    0.09968833    0.02538363
O   -2.00372358   -1.24550141   -0.24386851    0.04808180    0.03433727   -0.00232321
C   -0.72511464    0.67703824    0.07425049    0.15043164    0.04027068   -0.02476787
C   -0.89966232   -0.89251107    0.03837947   -0.09687169   -0.06211078    0.01088520
C    0.21913053    1.48429508   -0.17197988   -0.15863627   -0.07960859    0.03602286
C    0.41608101   -1.67814428    0.07395939   -0.01858328   -0.03007552   -0.00021094
C    1.67308831    1.25392684   -0.03597102    0.01778831    0.00513862   -0.00234787
C    1.79181823   -1.23482252   -0.01492463    0.03240014    0.02049909   -0.05234750
H    0.23936254    2.51391317   -0.62706666    0.03421378    0.01493360   -0.02051448
H    0.28283372   -2.72594565    0.29382546    0.00166201    0.00760903    0.00509055
H    2.23594016    2.18449626    0.04486146   -0.00169544    0.00204628    0.00366103
H    2.52976494   -2.00111650    0.36859043    0.01681964   -0.00697044    0.02309373
C    2.36655857    0.08218866    0.07368687    0.00387734   -0.00324261    0.01477502
H    3.45644962    0.20550159    0.16489713    0.00751200    0.00999550   -0.00082527
   15
   -420.46728366
H   -2.72343568    0.75519999   -0.05318556   -0.02194020   -0.01992939   -0.01032895
O   -1.99930470    1.43329815    0.18864942   -0.01510276    0.06720205    0.01663435
O   -1.99031131   -1.23578837   -0.23324581    0.08010845    0.05134139    0.00765920
C   -0.73490652    0.67467266    0.09123677    0.11156236    0.01554645   -0.01140742
C   -0.89330881   -0.91983332    0.03442051   -0.11873696   -0.08447725    0.00022047
C    0.23144514    1.49626531   -0.17414341   -0.10323973   -0.06966379    0.03425280
C    0.42671893   -1.67621901    0.06540672   -0.01079372   -0.00903888   -0.00388714
C    1.64923665    1.24207046   -0.03197382   -0.01093333   -0.01679454   -0.00418666
C    1.77826095   -1.24140653   -0.01537520    0.00781779    0.00897929   -0.05114893
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   15
   -420.46378712
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C   -0.75140575    0.67138036    0.10889888    0.06449327   -0.01205648    0.00480899
C   -0.87988093   -0.94208918    0.03042636   -0.11962421   -0.09838898   -0.00617252
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C    1.62604118    1.23118259   -0.02772804   -0.03863797   -0.02960974   -0.00508476
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   15
   -420.45681821
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O   -1.97478477   -1.22372636   -0.21321773    0.08374106    0.06436978    0.01252451
C   -0.77182747    0.66877434    0.12627038    0.02129598   -0.03147082    0.02102059
C   -0.85935128   -0.95843356    0.02678048   -0.09457946   -0.10453473   -0.00763017
C    0.27041782    1.53103256   -0.18394448    0.03600135   -0.01058315    0.00912804
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C    1.60516499    1.22203991   -0.02317882   -0.06266871   -0.03329689   -0.00514565
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C    2.35913128    0.06544734    0.07709216    0.07373378   -0.00449334    0.01944788
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   15
   -420.46481052
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O   -1.97283509   -1.22197569   -0.20403877    0.05523007    0.06210451    0.00883809
C   -0.79357382    0.66801002    0.14238063   -0.01467020   -0.03888209    0.03525817
C   -0.83320182   -0.96848354    0.02358072   -0.04974228   -0.10511231   -0.00603792
C    0.28880271    1.55032043   -0.19009319    0.09043014    0.02545649   -0.00798923
C    0.45944977   -1.67190798    0.04194456    0.03056301    0.03733934   -0.01074356
C    1.58803567    1.21486948   -0.01832348   -0.07803255   -0.02868554   -0.00419530
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   15
   -420.45344927
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O   -1.97336511   -1.22303133   -0.19525794    0.01959122    0.05671373    0.00435823
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C   -0.80408311   -0.97219322    0.02074425    0.00296937   -0.10227248   -0.00401596
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C    1.57555722    1.20939911   -0.01322032   -0.08000438   -0.01741287   -0.00209424
C    1.73155672   -1.26123521    0.00929145   -0.05960779   -0.06197204   -0.01870740
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   15
   -420.43130674
H   -2.90965420    1.11578065   -0.33049706   -0.07382401   -0.00120471   -0.03800725
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O   -1.97479475   -1.22665431   -0.18667839   -0.01344576    0.04961969    0.00080398
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C   -0.77512685   -0.96972928    0.01815601    0.05242697   -0.09711715   -0.00305690
C    0.30764272    1.58188959   -0.19986212    0.12998956    0.09555514   -0.03968616
C    0.47375983   -1.67840518    0.02927812    0.04825637    0.02954911   -0.00850957
C    1.56785560    1.20498370   -0.00799414   -0.07019389   -0.00697091    0.00074577
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C    2.32043013    0.05133751    0.07050207   -0.00402393   -0.00075783    0.00918875
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   15
   -420.42289366
H   -2.91690409    1.14238504   -0.36369887   -0.07721525    0.00081930   -0.04148494
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O   -1.97564363   -1.23252523   -0.17814073   -0.03885586    0.04160032   -0.00132937
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C   -0.74928914   -0.96140212    0.01575896    0.09165413   -0.08988747   -0.00334555
C    0.30563367    1.59009611   -0.20161600    0.12864272    0.09877261   -0.04495583
C    0.47676387   -1.68453026    0.02376149    0.04593217    0.01741684   -0.00743120
C    1.56439291    1.20106438   -0.00281388   -0.05894750   -0.01088111    0.00384160
C    1.72646645   -1.25392783    0.03067814   -0.07889637   -0.02753396   -0.00677249
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H    2.14644023    2.06411642    0.01395885   -0.03452173   -0.03023176    0.00351570
H    2.46784314   -2.05357265    0.05815687   -0.00068578    0.00005804    0.00129480
C    2.30613566    0.04698413    0.06689703   -0.01487580    0.00430789    0.00510479
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   15
   -420.43331076
H   -2.86948389    1.16821047   -0.36748167   -0.06367859    0.00644211   -0.03661263
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O   -1.97476158   -1.24028184   -0.16954725   -0.05577717    0.03305975   -0.00227214
C   -0.85630774    0.68530790    0.17984457   -0.09963023   -0.00956204    0.06223730
C   -0.72892870   -0.94765051    0.01356839    0.11785376   -0.08027266   -0.00445442
C    0.29585994    1.59245467   -0.20067269    0.12331884    0.07778629   -0.04585508
C    0.47702339   -1.69171585    0.01869961    0.03706028    0.00654503   -0.00732355
C    1.56452786    1.19789586    0.00213006   -0.05345674   -0.03222708    0.00772521
C    1.73079096   -1.24707819    0.04216386   -0.07057480    0.00693417    0.00219798
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H    2.18421077    2.06039790   -0.00440612   -0.02154696   -0.01724882    0.00292646
H    2.46289579   -2.09565603   -0.00656632    0.00688450   -0.01759196   -0.00330521
C    2.29269093    0.04237940    0.06298384   -0.01558655    0.00757417    0.00091264
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   15
   -420.44776538
H   -2.77824646    1.18889941   -0.34598329   -0.01470207    0.02093002   -0.01275774
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O   -1.97137585   -1.24953720   -0.16085354   -0.06544594    0.02420542   -0.00247128
C   -0.85953328    0.69248801    0.18043255   -0.10818904   -0.00325960    0.06252453
C   -0.71562970   -0.92905888    0.01164892    0.13083656   -0.06771495   -0.00591594
C    0.27868544    1.59013053   -0.19695218    0.10681944    0.05163430   -0.04722980
C    0.47505342   -1.69931868    0.01408222    0.02581318   -0.00037247   -0.00750666
C    1.56790235    1.19669083    0.00660051   -0.04931217   -0.05662540    0.01276974
C    1.73930424   -1.24064907    0.05350975   -0.04660256    0.04175996    0.01252633
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H    2.23707878    2.06874769   -0.02481139   -0.00153359    0.00189544    0.00130058
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C    2.28012501    0.03733765    0.05901484   -0.00393411    0.00662192   -0.00314038
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   15
   -420.44528222
H   -2.68016896    1.19328630   -0.31744776    0.08900500    0.05407928    0.04276137
O   -1.93700361    1.44728942    0.09672924   -0.05330319   -0.03073625   -0.06043147
O   -1.96504273   -1.25989051   -0.15204914   -0.06912044    0.01528410   -0.00227383
C   -0.85627021    0.69987653    0.17725216   -0.10594900    0.00101882    0.06019971
C   -0.71018118   -0.90638796    0.01008719    0.13134035   -0.05198930   -0.00736528
C    0.25513110    1.58466137   -0.19037443    0.07448893    0.02936442   -0.04872792
C    0.47151106   -1.70690798    0.00991489    0.01669411   -0.00558927   -0.00692249
C    1.57423684    1.19885563    0.01029809   -0.04095724   -0.07063028    0.01792508
C    1.75058482   -1.23671765    0.06410227   -0.01241322    0.07095818    0.02207890
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H    2.29125633    2.07610768   -0.04611448    0.01544274    0.01516154   -0.00094943
H    2.43769301   -2.13497171   -0.12473750    0.00521346   -0.03157944   -0.01374900
C    2.26775957    0.03192530    0.05523274    0.01410594   -0.00022805   -0.00658218
H    3.30805142    0.08426327    0.03328025   -0.03458723   -0.00619464   -0.00242041
   15
   -420.44749608
H   -2.64199686    1.15960895   -0.31757349    0.12081550    0.06922127    0.06088303
O   -1.93290569    1.44725168    0.08814855   -0.07587122   -0.04571753   -0.07780984
O   -1.95559492   -1.27093865   -0.14314250   -0.06698518    0.00667894   -0.00179660
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C   -0.71261689   -0.88058717    0.00896965    0.12004473   -0.03347174   -0.00853890
C    0.22714869    1.57740203   -0.18086178    0.02677209    0.00989576   -0.04787179
C    0.46693547   -1.71414892    0.00616054    0.01214933   -0.01273430   -0.00522303
C    1.58302289    1.20522083    0.01291829   -0.02757800   -0.07052409    0.02176417
C    1.76259984   -1.23701961    0.07337365    0.02512513    0.08855368    0.02882246
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H    2.33474112    2.07310947   -0.06674671    0.02530281    0.01920545   -0.00296695
H    2.41859562   -2.12229919   -0.17087347   -0.00342827   -0.02499804   -0.01611383
C    2.25462064    0.02655229    0.05184322    0.01659830   -0.01187574   -0.00897407
H    3.28109535    0.03940830    0.03927681   -0.04975380   -0.01112303   -0.00124231
   15
   -420.47082719
H   -2.68170998    1.08010573   -0.35632963    0.02005080    0.02683541    0.00366356
O   -1.92592872    1.44903957    0.08277292    0.03113827   -0.00413547   -0.02053052
O   -1.94313037   -1.28229296   -0.13415564   -0.05886680   -0.00112456   -0.00097533
C   -0.83167778    0.71400774    0.16032964   -0.05886256    0.02004941    0.04661173
C   -0.72226067   -0.85277111    0.00836878    0.09835231   -0.01330549   -0.00951912
C    0.19761239    1.56954347   -0.16847548   -0.03388532   -0.00925024   -0.04281031
C    0.46160562   -1.72060283    0.00271884    0.01143956   -0.02311825   -0.00289906
C    1.59345727    1.21578220    0.01423357   -0.01024473   -0.05653056    0.02333321
C    1.77310646   -1.24259186    0.08092485    0.06045176    0.08938001    0.03107604
H   -0.18227476    2.65034415   -0.20108110   -0.02522224    0.02837291    0.00677776
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H    2.36049219    2.05681150   -0.08529704    0.02694720    0.01429276   -0.00407321
H    2.40221114   -2.09218160   -0.20563540   -0.01604746   -0.00930002   -0.01467195
C    2.24062880    0.02189538    0.04899321   -0.00893131   -0.02317172   -0.01074184
H    3.28792275    0.00246459    0.04618173   -0.03276210   -0.01442010   -0.00026864
   15
   -420.47258776
H   -2.73885351    0.98067801   -0.39943311   -0.04499572   -0.01091889   -0.03327105
O   -1.92015529    1.45104887    0.07843704    0.09716353    0.03377784    0.01634937
O   -1.92801711   -1.29360168   -0.12512588   -0.04484040   -0.00744947    0.00020128
C   -0.81321243    0.71958919    0.14741018   -0.01135763    0.03684235    0.03522622
C   -0.73781405   -0.82414855    0.00834283    0.06886035    0.00648838   -0.01030686
C    0.17016318    1.56224207   -0.15352199   -0.10194951   -0.02779537   -0.03348762
C    0.45557938   -1.72564706   -0.00054650    0.01171837   -0.03581877   -0.00076083
C    1.60449491    1.22969434    0.01415149    0.01039453   -0.02905250    0.02213763
C    1.77999317   -1.25348743    0.08661902    0.08832708    0.07436743    0.02907480
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H    3.31752059   -0.02412666    0.05326487   -0.00189438   -0.01705027    0.00091719
   15
   -420.45944329
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O   -1.91860215    1.45159272    0.07345558    0.11291458    0.05423065    0.02751145
O   -1.91089159   -1.30458187   -0.11610638   -0.02490949   -0.01120068    0.00166777
C   -0.79409847    0.72293825    0.13236934    0.04346139    0.05420921    0.02215919
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C    0.14886799    1.55660395   -0.13655388   -0.16733737   -0.04284839   -0.02213338
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C    1.78161604   -1.26885701    0.09055442    0.10052582    0.05473722    0.02722691
H   -0.04815437    2.61848289   -0.14589901    0.00559024   -0.00249400    0.00869220
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H    2.41340871   -2.02664498   -0.24738774   -0.03513881    0.02405686   -0.00587115
C    2.21631958    0.01712559    0.04536003   -0.06396351   -0.03166313   -0.01467740
H    3.34897282   -0.03852655    0.05968831    0.02169977   -0.01823688    0.00208617
   15
   -420.44965081
H   -2.74933086    0.81612501   -0.41018772   -0.06171081   -0.03940096   -0.04282617
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O   -1.89265569   -1.31506796   -0.10716317    0.00027285   -0.01133281    0.00327467
C   -0.77757302    0.72304821    0.11598079    0.09026067    0.06346598    0.01058907
C   -0.77923269   -0.76909842    0.01019199   -0.00388078    0.03810587   -0.01105963
C    0.13760391    1.55352884   -0.11823739   -0.21489785   -0.05243660   -0.01267864
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H    2.35185856    1.99240495   -0.12630015   -0.01257405   -0.03717181    0.00126953
H    2.45369428   -2.01390254   -0.26008703   -0.02507843    0.02068164   -0.00834922
C    2.20921021    0.01752670    0.04481220   -0.06934211   -0.02875948   -0.01635907
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   15
   -420.45420371
H   -2.68870098    0.77223466   -0.36977939   -0.04503122   -0.04076162   -0.03478530
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O   -1.87444351   -1.32505475   -0.09836798    0.02841024   -0.00762371    0.00470852
C   -0.76638713    0.71941897    0.09892994    0.11360172    0.05320262    0.00323616
C   -0.80072910   -0.74457856    0.01211016   -0.04103435    0.04905133   -0.01054211
C    0.13917682    1.55360220   -0.09912889   -0.23096733   -0.05725639   -0.00804515
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C    1.62870281    1.27302495    0.00693633    0.05097458    0.05891743    0.01008074
C    1.76760327   -1.30883338    0.09320101    0.06075492    0.03176736    0.03726592
H    0.07278091    2.59423070   -0.11488553    0.02599052   -0.03106227    0.00721545
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H    2.35103673    2.00592692   -0.13918989   -0.01429622   -0.03775077    0.00150640
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C    2.20623010    0.01964839    0.04524951   -0.06163175   -0.02213268   -0.01719691
H    3.35937731   -0.02877111    0.06754310    0.03160529   -0.01508068    0.00314014
   15
   -420.46758014
H   -2.59715295    0.75643974   -0.30504496   -0.00269947   -0.01970201   -0.01443045
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O   -1.85751658   -1.33470627   -0.08978403    0.05550013   -0.00119322    0.00552874
C   -0.76191590    0.71269694    0.08166320    0.10641848    0.01869442   -0.00017819
C   -0.81977084   -0.72301631    0.01466113   -0.07280101    0.05820674   -0.00907954
C    0.15453731    1.55710981   -0.07951360   -0.21125544   -0.05622879   -0.00732035
C    0.42554220   -1.71662448   -0.01360357    0.00447691   -0.06882505    0.00178900
C    1.63112495    1.28217569    0.00300381    0.03207965    0.05097736    0.01017121
C    1.75428159   -1.33198215    0.09135113    0.02598189    0.01612089    0.04067458
H    0.10835751    2.61134016   -0.10751662    0.02902321   -0.02073281    0.00528764
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H    2.35952181    2.04546140   -0.15294081   -0.00037231   -0.01957231   -0.00179264
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H    3.33116115   -0.00686608    0.06822089    0.01825853   -0.01113613    0.00292161
   15
   -420.46788410
H   -2.50581505    0.75192937   -0.23081185    0.07137123    0.04582422    0.01836402
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O   -1.84308677   -1.34430448   -0.08144747    0.07714688    0.00527709    0.00542218
C   -0.76375597    0.70492397    0.06439977    0.07473550   -0.03130179   -0.00202930
C   -0.83445955   -0.70497366    0.01775606   -0.09477448    0.06709439   -0.00660564
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C    1.63163399    1.28829138   -0.00154609    0.00733196    0.03319190    0.01078229
C    1.73937331   -1.35606969    0.08707093   -0.00600679   -0.00656039    0.03831832
H    0.12328944    2.64283115   -0.10391491    0.02775314   -0.00121405    0.00270211
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H    2.36818956    2.09880453   -0.16535060    0.01537399    0.00371396   -0.00599701
H    2.61772562   -2.02805976   -0.24330346    0.03387031   -0.00720211   -0.02101658
C    2.21005236    0.02734331    0.04920219   -0.00934432   -0.00354097   -0.01514966
H    3.29057620    0.02300171    0.06681675   -0.00771550   -0.00631984    0.00235726
   15
   -420.46190577
H   -2.46358478    0.71563697   -0.16820693    0.10576751    0.08471411    0.02572522
O   -1.96971700    1.41675294    0.03369282   -0.06655773   -0.04560956   -0.02207501
O   -1.83212210   -1.35413282   -0.07335443    0.09018834    0.00869265    0.00446454
C   -0.77007322    0.69903259    0.04725848    0.03452064   -0.07913290   -0.00370766
C   -0.84347068   -0.69099145    0.02124742   -0.10591052    0.07604573   -0.00352584
C    0.22018198    1.57367174   -0.03899501   -0.09315674   -0.03294262   -0.00391795
C    0.40813332   -1.68893392   -0.02084924    0.01760115   -0.04242276    0.01170127
C    1.63168586    1.29238698   -0.00673934   -0.01508278    0.01748850    0.00978259
C    1.72479347   -1.37974146    0.08049782   -0.03094264   -0.03315105    0.03104415
H    0.11849904    2.67532979   -0.10224625    0.02220663    0.01642385   -0.00011876
H   -0.02977211   -2.60239878   -0.41442810   -0.00941202    0.00919312   -0.01207409
H    2.36628703    2.14984935   -0.17353771    0.02321170    0.02109270   -0.00871514
H    2.64046139   -2.02860670   -0.20962829    0.03963132   -0.00518420   -0.01784591
C    2.21373850    0.03180091    0.05259540    0.02490095    0.00664264   -0.01258039
H    3.25580458    0.05744004    0.06371458   -0.03698994   -0.00180283    0.00180865
   15
   -420.47233641
H   -2.49167388    0.62596605   -0.12212728    0.05380163    0.01498889    0.00340639
O   -1.97995283    1.40847325    0.02622323   -0.02169171    0.02382835    0.00089914
O   -1.82521490   -1.36433438   -0.06546104    0.09409403    0.00650321    0.00269875
C   -0.77851987    0.69783739    0.03034240    0.00193398   -0.10954010   -0.00569720
C   -0.84612259   -0.68159808    0.02495133   -0.10759780    0.08278431   -0.00021401
C    0.26343969    1.58536061   -0.01831028   -0.01747184   -0.01878677    0.00136360
C    0.39807869   -1.67076824   -0.02535723    0.02592605   -0.02585849    0.01711570
C    1.63263555    1.29539180   -0.01251569   -0.03458777    0.00832157    0.00707791
C    1.71202682   -1.40140171    0.07206310   -0.04414589   -0.06121061    0.02056736
H    0.09791297    2.69646366   -0.10050710    0.01344043    0.02651738   -0.00269334
H   -0.04467286   -2.59475219   -0.42412555   -0.01135962    0.00202787   -0.01528880
H    2.34822232    2.18624839   -0.17557600    0.02181599    0.02940757   -0.00934477
H    2.63523996   -2.02572616   -0.16326434    0.03550919    0.00202358   -0.01193970
C    2.21603376    0.03585649    0.05674739    0.03684667    0.01671672   -0.00953775
H    3.24645626    0.09320302    0.05929070   -0.04645607    0.00234067    0.00153653
   15
   -420.47493338
H   -2.55900391    0.52428679   -0.07954225    0.00321715   -0.04469520   -0.00525601
O   -1.98915158    1.39919485    0.01878039    0.01625846    0.08156859    0.00959897
O   -1.82254457   -1.37480889   -0.05768717    0.08933801   -0.00147409    0.00017119
C   -0.78714761    0.70314864    0.01378069   -0.01825979   -0.11663310   -0.00952361
C   -0.84231634   -0.67718105    0.02866336   -0.09939013    0.08356963    0.00401026
C    0.30776018    1.59819956    0.00228667    0.05701726   -0.00719425    0.00768238
C    0.38648176   -1.65102259   -0.03088666    0.02921693   -0.01238339    0.01987700
C    1.63566269    1.29785037   -0.01871403   -0.05095860    0.00777376    0.00316800
C    1.70184596   -1.41935560    0.06239089   -0.04083198   -0.09013568    0.00886665
H    0.06772798    2.69905351   -0.09686415    0.00335784    0.02745453   -0.00465564
H   -0.05150561   -2.58873824   -0.42292452   -0.01145129   -0.00239007   -0.01668161
H    2.31493896    2.20203924   -0.17100538    0.01213294    0.02808559   -0.00797003
H    2.60511025   -2.02460518   -0.10838432    0.02047184    0.01422786   -0.00471583
C    2.21627394    0.03891211    0.06147201    0.01613281    0.02476628   -0.00567469
H    3.26868162    0.12720744    0.05377126   -0.02627869    0.00755518    0.00108102
   15
   -420.46768352
H   -2.63011337    0.45219858   -0.03380226   -0.02365928   -0.06243984   -0.00300672
O   -1.99899015    1.38638497    0.01094070    0.02893005    0.09565957    0.00763404
O   -1.82389975   -1.38520189   -0.04991898    0.07710738   -0.01331679   -0.00288137
C   -0.79471262    0.71540656   -0.00219521   -0.03012615   -0.10244020   -0.01528606
C   -0.83255457   -0.67777763    0.03212709   -0.08018767    0.07638365    0.00935460
C    0.34867922    1.61148003    0.02242292    0.12200191    0.00330160    0.01326190
C    0.37316054   -1.63050893   -0.03760081    0.02411846   -0.00263519    0.01922736
C    1.64173636    1.29978546   -0.02510096   -0.06017359    0.01771708   -0.00138332
C    1.69405984   -1.43186079    0.05217378   -0.02345487   -0.11805741   -0.00107207
H    0.03506580    2.68241874   -0.08992529   -0.00573422    0.01925886   -0.00569330
H   -0.05023210   -2.58125342   -0.40984417   -0.00918918   -0.00268745   -0.01582940
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H    2.56070511   -2.03390820   -0.05003518   -0.00163049    0.02901820    0.00123389
C    2.21559815    0.04048059    0.06653434   -0.01690520    0.03078844   -0.00075774
H    3.30925441    0.15573354    0.04751472    0.00389304    0.01333136   -0.00000788
   15
   -420.45934623
H   -2.68492236    0.42405972    0.01396427   -0.03766721   -0.06215834    0.00188120
O   -2.01010485    1.36930956    0.00276230    0.03123649    0.08888927    0.00331355
O   -1.82873178   -1.39498687   -0.04201950    0.05910486   -0.02619071   -0.00600281
C   -0.80047399    0.73378475   -0.01724193   -0.03820302   -0.07324882   -0.02197882
C   -0.81799616   -0.68295680    0.03502228   -0.05044574    0.06182520    0.01523656
C    0.38231439    1.62455156    0.04176552    0.16813741    0.01555313    0.01724759
C    0.35842603   -1.60982446   -0.04546360    0.01000678    0.00489843    0.01578665
C    1.65138641    1.30060348   -0.03140335   -0.05722862    0.03617246   -0.00607202
C    1.68770569   -1.43727681    0.04199780   -0.00889144   -0.13549809   -0.00658190
H    0.00634711    2.65239390   -0.07895230   -0.01175978    0.00316329   -0.00564930
H   -0.04245819   -2.57206345   -0.38547478   -0.00501799    0.00080369   -0.01316216
H    2.23572577    2.18334459   -0.14717929   -0.02669618   -0.00455269   -0.00075095
H    2.51697989   -2.06369175    0.00765862   -0.01533228    0.03660530    0.00350747
C    2.21590299    0.04019069    0.07164009   -0.04246605    0.03600858    0.00463234
H    3.34759998    0.17474803    0.04128522    0.02525256    0.01773849   -0.00144350
   15
   -420.45802214
H   -2.71308122    0.44029985    0.06037726   -0.04327624   -0.05470481    0.00676596
O   -2.02262396    1.34823687   -0.00556659    0.02953398    0.07188534   -0.00098977
O   -1.83623264   -1.40358909   -0.03384929    0.03769596   -0.03766134   -0.00868148
C   -0.80393158    0.75655702   -0.03096006   -0.04479650   -0.03684546   -0.02854404
C   -0.80043019   -0.69184609    0.03699792   -0.01208869    0.04144968    0.02071995
C    0.40591112    1.63666997    0.06007012    0.18860247    0.03003087    0.02025222
C    0.34312515   -1.58944045   -0.05427502   -0.01184762    0.01333793    0.01114032
C    1.66444496    1.29925255   -0.03734299   -0.04427337    0.05040153   -0.00985865
C    1.68199010   -1.43461569    0.03220725   -0.01282542   -0.13039261   -0.00970599
H   -0.01414312    2.62035096   -0.06396635   -0.01387017   -0.01708101   -0.00472613
H   -0.03110023   -2.56356101   -0.35167376   -0.00037492    0.00604780   -0.00976141
H    2.21701755    2.17158297   -0.13294785   -0.04335466   -0.02230951    0.00216000
H    2.48290436   -2.11866872    0.06292309   -0.00727803    0.02557426    0.00427526
C    2.21871234    0.03772750    0.07646714   -0.05542424    0.04032509    0.00974372
H    3.36854458    0.18112208    0.03608838    0.03356847    0.01996613   -0.00277397
   15
   -420.46552892
H   -2.71079218    0.49528179    0.10203240   -0.03615464   -0.03550607    0.00952107
O   -2.03645141    1.32395082   -0.01385677    0.01857927    0.04128535   -0.00341306
O   -1.84544193   -1.41049280   -0.02528801    0.01576241   -0.04641808   -0.01060186
C   -0.80468850    0.78155891   -0.04295706   -0.04954147   -0.00060126   -0.03410584
C   -0.78216042   -0.70322075    0.03772766    0.03162047    0.01681202    0.02477791
C    0.41822769    1.64698250    0.07714733    0.18419114    0.04222734    0.02375589
C    0.32856836   -1.56988822   -0.06376345   -0.03916370    0.02664881    0.00709420
C    1.68018050    1.29496824   -0.04269488   -0.03077373    0.04288267   -0.01210163
C    1.67709739   -1.42416769    0.02301272   -0.02587504   -0.10603223   -0.01431681
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H   -0.01939812   -2.55930498   -0.31080511    0.00297571    0.00948800   -0.00690186
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   15
   -420.47113475
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O   -1.85537516   -1.41530144   -0.01624863   -0.00386298   -0.05227583   -0.01171769
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C    1.69779365    1.28819239   -0.04731510   -0.02014172    0.01598903   -0.01428463
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   15
   -420.46134778
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C   -0.75397470   -0.72740079    0.03460178    0.11177483   -0.03405533    0.02687079
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   15
   -420.45967622
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O   -1.87408112   -1.41766022    0.00343898   -0.02876276   -0.05788494   -0.01215267
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C   -0.74882327   -0.73718159    0.03061375    0.13185260   -0.05013694    0.02603567
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C    1.73596650    1.27328109   -0.05373056    0.00428336   -0.02504135   -0.02222786
C    1.67219825   -1.36141506    0.00188878   -0.01278752   -0.02579103   -0.02612133
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   15
   -420.47063243
H   -2.73342852    0.59678818    0.27949729   -0.01168055    0.02176918    0.00437115
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O   -1.88172751   -1.41495359    0.01410811   -0.03311958   -0.05820621   -0.01179271
C   -0.78073216    0.86597650   -0.06837829    0.00039377    0.08245964   -0.04061294
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C    0.37238516    1.66557153    0.12773427    0.04740984   -0.00851498    0.04207788
C    0.30923526   -1.51996961   -0.10454338   -0.09526451    0.08471585   -0.00496745
C    1.75505582    1.26756045   -0.05505459    0.01713526   -0.02529124   -0.02633651
C    1.67294848   -1.33537919   -0.00222031    0.00470009   -0.00769274   -0.02492969
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H    2.20557638   -2.33854787    0.23883516    0.00245198   -0.04322585    0.01720034
C    2.27104203   -0.01112803    0.08766365    0.01554647    0.01238425    0.02121400
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   15
   -420.47136494
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O   -1.88788900   -1.40961296    0.02531100   -0.03266728   -0.05665351   -0.01110710
C   -0.77179054    0.87693613   -0.06859749    0.02820426    0.09176389   -0.03708962
C   -0.76203838   -0.74756137    0.01794429    0.10877538   -0.04810851    0.02551815
C    0.34745230    1.66846358    0.13453796   -0.00125382   -0.02647806    0.04008231
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C    1.77311294    1.26330481   -0.05479119    0.02929548   -0.01265723   -0.02937985
C    1.67340144   -1.30883651   -0.00484078    0.02472051    0.00206333   -0.01994031
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H    2.12003805   -2.30095598    0.23993408   -0.01810481   -0.02503055    0.01230386
C    2.28242480   -0.02593850    0.08637122   -0.00962918   -0.00906028    0.02202688
H    3.34474711   -0.03636372    0.05370447   -0.02109788    0.00252410   -0.00362558
   15
   -420.46389275
H   -2.79707289    0.46898469    0.37922176   -0.06535118   -0.03216200    0.03744607
O   -2.08871725    1.20964573   -0.07220983    0.02315913   -0.00262999   -0.02698260
O   -1.89258578   -1.40171025    0.03701668   -0.02751180   -0.05282956   -0.01011965
C   -0.76454583    0.88236573   -0.06658388    0.05418557    0.09705054   -0.03154210
C   -0.77904668   -0.74825099    0.00929394    0.07281708   -0.03614341    0.02589084
C    0.32257746    1.67291690    0.13893092   -0.04635798   -0.03638565    0.03544994
C    0.33178298   -1.52228828   -0.12392216   -0.03218963    0.04402653   -0.01540651
C    1.78939189    1.25976069   -0.05275842    0.04261350    0.01062113   -0.03093201
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H    0.15872421    2.81019417    0.13935590   -0.00304238    0.03353585   -0.00297423
H    0.02759721   -2.57575444   -0.01670132   -0.00583551   -0.00482451    0.00885353
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H    2.04768968   -2.24619377    0.23241212   -0.04093554    0.00669909    0.00360435
C    2.29441128   -0.04019397    0.08375423   -0.03976896   -0.03197619    0.02140160
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   15
   -420.45504516
H   -2.76415385    0.43334563    0.39304078   -0.06024152   -0.03585985    0.03965721
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O   -1.89605271   -1.39142081    0.04918079   -0.01743747   -0.04630126   -0.00895460
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C   -0.80042435   -0.74675511   -0.00091971    0.02984872   -0.02395915    0.02577483
C    0.30045426    1.67950816    0.14118331   -0.08117013   -0.03380135    0.03016204
C    0.34706271   -1.52817888   -0.13237363    0.00741701    0.01586360   -0.01837079
C    1.80308454    1.25555107   -0.04886349    0.05721645    0.03805428   -0.03078946
C    1.66871112   -1.25599532   -0.00701575    0.05457470    0.00294448   -0.00356819
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H    2.57564780    1.99297144   -0.04212425    0.00028316   -0.01860437    0.00021509
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C    2.30873945   -0.05252035    0.07985042   -0.05800889   -0.05382199    0.01931229
H    3.45276113   -0.14995153    0.07831190    0.03062160   -0.00849260   -0.00255964
   15
   -420.45388740
H   -2.68870311    0.42293949    0.37877639   -0.04042760   -0.02882650    0.03338882
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O   -1.89874601   -1.37904136    0.06175103   -0.00272636   -0.03694043   -0.00780015
C   -0.76078395    0.87577480   -0.05724389    0.07552576    0.08622843   -0.01810531
C   -0.82360203   -0.74379484   -0.01268696   -0.01423709   -0.01472193    0.02462292
C    0.28316313    1.68806114    0.14160432   -0.10073891   -0.01496412    0.02629944
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C    1.81335028    1.24908875   -0.04311415    0.06481767    0.05573027   -0.02914007
C    1.66184891   -1.22993297   -0.00750174    0.04780012    0.02819869   -0.00324550
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H    2.60187295    1.93443187   -0.03112756   -0.01061681   -0.03708931   -0.00025760
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C    2.32650110   -0.06161468    0.07478217   -0.06130015   -0.07100273    0.01650076
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   15
   -420.45719421
H   -2.58541908    0.43176181    0.34145733    0.00039603    0.00413171    0.01051648
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O   -1.90132704   -1.36499440    0.07467595    0.01494746   -0.02536174   -0.00687371
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C    1.81979118    1.23936909   -0.03560644    0.05432851    0.05172080   -0.02666728
C    1.65218925   -1.20567361   -0.00775605    0.02282055    0.07144954   -0.00967009
H    0.32560376    2.76583829    0.26938518    0.02146386   -0.00630146    0.00157702
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H    2.04064634   -2.16954381    0.21129516   -0.04314329    0.00897170    0.00051221
C    2.34789292   -0.06645925    0.06871585   -0.04898962   -0.07942973    0.01372984
H    3.48522236   -0.23984467    0.10970017    0.03212866   -0.01676954    0.00088733
   15
   -420.44908097
H   -2.48325863    0.43547621    0.29764068    0.05188650    0.06689129   -0.02686335
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O   -1.90458575   -1.34979846    0.08791423    0.03242605   -0.01337403   -0.00632934
C   -0.77416680    0.84914695   -0.04353873    0.04436749    0.03761562   -0.00378008
C   -0.86498852   -0.73551783   -0.04052330   -0.08815882   -0.00464783    0.01850117
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C    0.38252081   -1.54694972   -0.15096563    0.08553924   -0.02140934   -0.01841082
C    1.82301686    1.22661372   -0.02648723    0.03031658    0.02967306   -0.02388890
C    1.64119694   -1.18566827   -0.00742852   -0.01172774    0.10262373   -0.01579327
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H    2.11001736   -2.17506377    0.20721170   -0.02002506   -0.01934633    0.00644534
C    2.37215752   -0.06655329    0.06181501   -0.01881138   -0.07744802    0.01177087
H    3.46593682   -0.26808484    0.12510331    0.01337671   -0.01755480    0.00188874
   15
   -420.44127796
H   -2.41597227    0.39442790    0.27096623    0.06577980    0.07540018   -0.03015611
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O   -1.90930025   -1.33398722    0.10144096    0.04575679   -0.00362026   -0.00607697
C   -0.78547165    0.83159507   -0.03612097    0.02036565    0.00786899    0.00307381
C   -0.87875696   -0.73083140   -0.05622286   -0.11193690    0.00033871    0.01367731
C    0.26764158    1.71068541    0.13345218   -0.08515658    0.07660989    0.02468178
C    0.38564706   -1.55107337   -0.15489938    0.09319663   -0.01650229   -0.01808962
C    1.82439593    1.21209388   -0.01592456    0.00843397    0.00126017   -0.02084846
C    1.63091271   -1.17174384   -0.00616680   -0.04627833    0.10960966   -0.01789232
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H    2.69782785    1.90932381    0.00385612    0.03051724   -0.01305090   -0.00086757
H    2.19389081   -2.16754471    0.19867747    0.00204985   -0.03347110    0.00913693
C    2.39747610   -0.06200324    0.05419481    0.02725666   -0.06748941    0.01122138
H    3.43775807   -0.28390776    0.13924278   -0.01703825   -0.01474940    0.00129381
   15
   -420.44278191
H   -2.39414288    0.30404525    0.26367604    0.04842226    0.00978008    0.00219454
O   -2.11920555    1.15361698   -0.11618375   -0.02956661   -0.03058878   -0.01804819
O   -1.91606232   -1.31799217    0.11524228    0.05157493    0.00095227   -0.00546389
C   -0.79803942    0.81354282   -0.02888216    0.00219176   -0.01721265    0.00861238
C   -0.88581037   -0.72617926   -0.07274314   -0.12459699    0.00791035    0.00751496
C    0.27358562    1.71115592    0.12772440   -0.07433047    0.07859928    0.01932641
C    0.38318668   -1.55420594   -0.15773865    0.09087773   -0.01012092   -0.01783745
C    1.82520630    1.19749524   -0.00410226   -0.00216958   -0.02684088   -0.01755498
C    1.62339189   -1.16436009   -0.00384400   -0.07380247    0.09888091   -0.01581837
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   15
   -420.44441891
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O   -1.92513144   -1.30201324    0.12928555    0.04864711   -0.00147235   -0.00323781
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   15
   -420.45038090
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C   -0.87765621   -0.71889688   -0.10658403   -0.10405647    0.02657514   -0.01296151
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C    2.45514326   -0.02829289    0.02742805    0.06885990   -0.00056432    0.00240618
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   15
   -420.45700465
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O   -1.94933109   -1.26948490    0.15754457    0.02256391   -0.01620789    0.01013290
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C    0.31538739    1.68601625    0.10556856   -0.03132591    0.06044494   -0.00358947
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C    1.82696404    1.16916140    0.03690401    0.03286329   -0.08333082   -0.00727208
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   15
   -420.45895221
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O   -1.96330402   -1.25229955    0.17115844    0.00615406   -0.02009310    0.02005623
C   -0.84456214    0.76039285   -0.00799007   -0.02937530   -0.04991900    0.02798324
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C    0.33441557    1.66995500    0.09804665   -0.01179034    0.06177616   -0.00726289
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C    1.82500974    1.16863985    0.05172867    0.05454114   -0.08201074   -0.00384479
C    1.64135269   -1.18038684    0.01079953   -0.03560594   -0.01400363    0.01709296
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   15
   -420.45890527
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O   -1.97756250   -1.23421996    0.18386298   -0.00865390   -0.01941618    0.02980915
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C    1.81979923    1.17304360    0.06678591    0.06788695   -0.07408776   -0.00043466
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C    2.47903316    0.00709002   -0.00013543    0.02228783    0.04202630   -0.01596007
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   15
   -420.46268116
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O   -1.99143776   -1.21527340    0.19522089   -0.02101354   -0.01495905    0.03803307
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C    1.81056255    1.18194259    0.08187048    0.06584342   -0.06848047    0.00277459
C    1.66931301   -1.19211252    0.01442229   -0.00607961   -0.03431643    0.02592287
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   15
   -420.46654646
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O   -2.00436769   -1.19565727    0.20486110   -0.03122958   -0.00797063    0.04414265
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C    1.79741415    1.19499411    0.09678890    0.04982769   -0.06462799    0.00567388
C    1.68405334   -1.19494076    0.01397943   -0.02006989   -0.01156574    0.02754143
H    0.07045961    2.56089397    0.41691157   -0.01257752   -0.02003784    0.00391028
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H    2.46763849   -1.94327460    0.01429376    0.01568634    0.02658404   -0.00365995
C    2.48625407    0.01953461   -0.01437074    0.04668476    0.02689119   -0.01855881
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   15
   -420.46472364
H   -2.64148842    0.10907343   -0.13922903   -0.02992014   -0.00924630   -0.01337185
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O   -2.01588636   -1.17568546    0.21250684   -0.03989899    0.00061639    0.04799453
C   -0.86161118    0.74738415   -0.01368430   -0.06369853    0.01013734    0.03977730
C   -0.77908937   -0.73430921   -0.16388773    0.10895229   -0.01347034   -0.06986585
C    0.40533032    1.56598494    0.07224758    0.07415533    0.05202950   -0.00692966
C    0.28605086   -1.56138180   -0.14629446   -0.10450450    0.01268800   -0.00345957
C    1.78129666    1.21192219    0.11136523    0.02480695   -0.05467254    0.00834962
C    1.69997399   -1.19707699    0.01187282   -0.02838732    0.01334096    0.02872854
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C    2.48610781    0.02302473   -0.01982500    0.07259757    0.01401918   -0.01775830
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   15
   -420.46011792
H   -2.60959441    0.14588768   -0.19761710   -0.01953624   -0.00360598   -0.01769023
O   -2.10105565    1.11665715   -0.12262530   -0.01400441   -0.02700117   -0.00300599
O   -2.02559949   -1.15574550    0.21798352   -0.04724268    0.01025790    0.04954684
C   -0.85742848    0.74535764   -0.02085799   -0.06785911    0.02686734    0.03830364
C   -0.77467004   -0.73851205   -0.16066587    0.11829122   -0.02157642   -0.07036024
C    0.41529517    1.53070471    0.06681131    0.10393970    0.02002026   -0.01051106
C    0.28847673   -1.56194492   -0.14219484   -0.10372171    0.01636654    0.00050104
C    1.76370387    1.23210704    0.12543807   -0.00510845   -0.03508959    0.01070207
C    1.71754719   -1.19998651    0.00803278   -0.02417129    0.03185946    0.02913104
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H    2.46187700   -2.10800191   -0.01466944    0.03478538   -0.02705389   -0.00372416
C    2.48161715    0.02566311   -0.02419815    0.08897787    0.00164726   -0.01833955
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   15
   -420.45863587
H   -2.56401161    0.18498059   -0.24346878   -0.00289730    0.00722918   -0.01854620
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O   -2.03317612   -1.13627342    0.22122044   -0.05264700    0.02055477    0.04885776
C   -0.84916483    0.74173155   -0.03033684   -0.06733410    0.03859356    0.03458280
C   -0.77733288   -0.74144587   -0.15319790    0.11335513   -0.02264191   -0.06899098
C    0.41898493    1.49424287    0.06200672    0.13119609   -0.01789523   -0.01339125
C    0.29711683   -1.56346044   -0.13812512   -0.09127949    0.01273386    0.00439011
C    1.74641790    1.25437540    0.13886613   -0.03440324   -0.00777243    0.01259320
C    1.73653002   -1.20478297    0.00243587   -0.00944794    0.04233059    0.02855134
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H    0.07404507   -2.63414400   -0.28002055   -0.00441283   -0.00945757   -0.00913443
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C    2.47189395    0.02820504   -0.02744743    0.07727579   -0.01133128   -0.02165560
H    3.50800258    0.15233798    0.07539121   -0.02961052    0.01330560    0.00046090
   15
   -420.46018645
H   -2.51650955    0.21857171   -0.27619531    0.01616256    0.02243556   -0.01571101
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O   -2.03837682   -1.11773480    0.22224812   -0.05458842    0.03103735    0.04615328
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C   -0.78678540   -0.74304032   -0.14156764    0.09528253   -0.01777390   -0.06557444
C    0.41481870    1.45884466    0.05799974    0.14281923   -0.05242102   -0.01396449
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C    1.73116781    1.27708813    0.15153240   -0.05475485    0.02475480    0.01455037
C    1.75604670   -1.21208977   -0.00488266    0.01287082    0.04265137    0.02695179
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H    2.19637859    2.28322069    0.29128018   -0.01122361    0.02536207    0.00162542
H    2.36546373   -2.20480118   -0.03327831    0.01400514   -0.03947281   -0.00245043
C    2.45760751    0.03144030   -0.02938537    0.04427610   -0.02555370   -0.02532631
H    3.52297303    0.20001151    0.04622665   -0.00604076    0.01859595    0.00172119
   15
   -420.46137174
H   -2.48027897    0.23640351   -0.29763101    0.02900141    0.03080824   -0.01256179
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O   -2.04112107   -1.10060382    0.22118795   -0.05108662    0.04134668    0.04175771
C   -0.82106439    0.72721597   -0.05521949   -0.03906509    0.04526079    0.02304936
C   -0.80194626   -0.74357528   -0.12598402    0.06636142   -0.00981648   -0.05966813
C    0.40214835    1.42658234    0.05483009    0.12819959   -0.08027220   -0.01313515
C    0.32952250   -1.56811469   -0.13095525   -0.04258028   -0.01033449    0.00915705
C    1.71914657    1.29828667    0.16331293   -0.05897847    0.06053413    0.01762004
C    1.77475844   -1.22190029   -0.01382608    0.04043747    0.02788264    0.02433327
H    0.03554460    2.47414941    0.23715666   -0.01493221    0.00652146    0.00383866
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   15
   -420.45973368
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C   -0.80296440    0.71590293   -0.06993721   -0.00620540    0.04412038    0.01746291
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   15
   -420.45461649
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   15
   -420.45064567
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   15
   -420.44929540
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C    0.41304924   -1.56598710   -0.12245418    0.04145484   -0.02329365    0.00197218
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C    1.81099640   -1.25947937   -0.06213521    0.07731836   -0.02748100    0.00994402
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   15
   -420.44895809
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C   -0.88959852   -0.74468009   -0.00734108   -0.12124488    0.01198395    0.00393575
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C    1.69773394    1.32295488    0.20339364   -0.01518381    0.07695007    0.01079499
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   15
   -420.45317408
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O   -2.00539304    1.16733929   -0.10425743   -0.00069342   -0.00507040    0.02669199
O   -2.03710005   -1.05375388    0.18738757    0.06317764    0.09449673   -0.00874148
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C   -0.89330281   -0.74634667    0.01905264   -0.12673667    0.02002798    0.01404664
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C    1.69742792    1.31038663    0.20822934   -0.00658210    0.04874985    0.00475608
C    1.80088464   -1.26792773   -0.09074458    0.02669630   -0.00300752    0.00197475
H    0.13625937    2.42690517   -0.01779570    0.02711533   -0.01730365   -0.00552539
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C    2.34683776    0.10506089   -0.00231677    0.00887109    0.03668462   -0.00781135
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   15
   -420.46286832
H   -2.57277721    0.34913811   -0.12610889   -0.00171395   -0.01877130   -0.00385507
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O   -2.04173924   -1.05917457    0.18088736    0.05398172    0.09101026   -0.01279455
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C   -0.88945128   -0.74924401    0.04461153   -0.11078757    0.03178201    0.02129587
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C    1.69748506    1.29488264    0.21276796    0.00887617    0.01820470    0.00056760
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H    2.43462253   -2.26789713   -0.13011281    0.01475110   -0.05246011    0.00481869
C    2.33193995    0.11615774    0.00545222   -0.01253529    0.06618766    0.00183946
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   15
   -420.47100940
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O   -2.04877826   -1.06870324    0.17496133    0.03177004    0.08190973   -0.01517509
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C    0.26587018    1.40581142    0.05802511   -0.05664135   -0.05522500    0.01039611
C    0.46096163   -1.54866146   -0.11619478    0.06892961    0.03987902   -0.00660071
C    1.69697688    1.27826768    0.21725891    0.02991403   -0.01021822   -0.00100653
C    1.78418469   -1.27456490   -0.11985578   -0.01754622   -0.03009147   -0.00490886
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H    2.49850359   -2.21001165   -0.15645218    0.02329304   -0.04458686    0.00439096
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   15
   -420.47280942
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O   -2.05723985   -1.08193850    0.16972247    0.00443993    0.06990251   -0.01710805
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C    0.26830733    1.42979017    0.05986610   -0.02753749   -0.03212297    0.02033562
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C    1.69465315    1.26222947    0.22179601    0.05202844   -0.03063683    0.00030172
C    1.77676783   -1.27564912   -0.13406519   -0.02767325   -0.05508804   -0.00752966
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H    2.54607555   -2.12067386   -0.18597342    0.02392272   -0.02575257    0.00430368
C    2.30637418    0.12451841    0.01994369   -0.06713903    0.11988605    0.02294205
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   15
   -420.47032161
H   -2.64582002    0.59196344    0.05937314    0.00856845    0.01733800    0.00204826
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O   -2.06590884   -1.09834447    0.16526023   -0.02147417    0.05749821   -0.01913139
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C   -0.84582405   -0.77181448    0.11210975   -0.00797299    0.04718972    0.04068901
C    0.27243830    1.45571698    0.06049052   -0.00398231   -0.01011453    0.02766818
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C    1.68921866    1.24799539    0.22630596    0.06688338   -0.04179251    0.00330001
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C    2.29887405    0.11862669    0.02542589   -0.07379123    0.12626751    0.02734135
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   15
   -420.46554447
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O   -2.07362125   -1.11736264    0.16166577   -0.04276191    0.04591342   -0.02110101
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C    1.67982176    1.23627341    0.23062066    0.06568789   -0.04970094    0.00555531
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C    2.29574665    0.10520950    0.02928559   -0.06256077    0.11080124    0.02560122
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   15
   -420.46156097
H   -2.71721643    0.70548942    0.17300548   -0.03490904   -0.00227746    0.01820075
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O   -2.07941335   -1.13846759    0.15902731   -0.05879384    0.03530084   -0.02269728
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C   -0.81038255   -0.80038358    0.14545951    0.04775099    0.02327225    0.05504351
C    0.28056371    1.50811474    0.05652537    0.02045914    0.03230127    0.03251574
C    0.44841984   -1.56464510   -0.10305296    0.02782379    0.04886661   -0.01688523
C    1.66653713    1.22756215    0.23460663    0.04804650   -0.05804610    0.00649711
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   15
   -420.46047199
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O   -1.90133798    1.27714127   -0.14372917    0.06950727    0.00350529    0.00335610
O   -2.08255550   -1.16117789    0.15741648   -0.07010632    0.02564891   -0.02370344
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C   -0.79619123   -0.81719260    0.15735757    0.06770439    0.00787629    0.06015989
C    0.28307607    1.53202478    0.05163881    0.02219582    0.05175159    0.03081164
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C    1.65038382    1.22234210    0.23819868    0.02289875   -0.06260505    0.00754875
C    1.75836788   -1.23319603   -0.18483056   -0.00371113   -0.07293918   -0.01060300
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C    2.29903305    0.06069247    0.03288047   -0.00211879    0.02653532    0.00741756
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   15
   -420.46065167
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O   -1.89351049    1.29525497   -0.15192201    0.05960799    0.00266378    0.00379261
O   -2.08253190   -1.18505551    0.15687865   -0.07734188    0.01696395   -0.02404880
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C    2.30192132    0.03461412    0.03368927    0.02137119   -0.02780705   -0.00405667
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   15
   -420.46046763
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O   -1.88832392    1.31326945   -0.16031533    0.03313981   -0.00379937    0.01159065
O   -2.07901307   -1.20970676    0.15742949   -0.08082590    0.00932097   -0.02372624
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C   -0.78087675   -0.85140900    0.17010156    0.09016918   -0.01785497    0.06341419
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C    1.61533475    1.22295429    0.24390042   -0.02042257   -0.04876278    0.01117362
C    1.75148267   -1.18421501   -0.20651629   -0.01364980    0.03562654    0.00841793
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H    2.68542752   -1.77177502   -0.45657521    0.04016564    0.02278306   -0.00315778
C    2.30365104    0.01022469    0.03474307    0.01934176   -0.08352938   -0.01555242
H    3.35525078    0.12704224    0.04664816   -0.02170093    0.00259717   -0.00047037
   15
   -420.45922787
H   -2.61500759    0.90848084    0.25158125    0.02644656    0.03395268   -0.00511618
O   -1.88461210    1.33146504   -0.16925338    0.00019473   -0.01196088    0.02358736
O   -2.07184140   -1.23478469    0.15905427   -0.08041676    0.00275464   -0.02271885
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C   -0.78110255   -0.86726992    0.17075110    0.09077698   -0.02623046    0.06145579
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C    0.40930581   -1.62317722   -0.07515856   -0.02213756    0.00441984   -0.01137359
C    1.59904043    1.22795676    0.24579553   -0.03455456   -0.03153414    0.01293634
C    1.74920301   -1.16119141   -0.21780521    0.00054613    0.09337884    0.01846755
H   -0.18626845    2.54650793    0.02722253   -0.01612531   -0.01716104   -0.00397600
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C    2.30431186   -0.00913295    0.03674091   -0.00211230   -0.13485887   -0.02753755
H    3.37301525    0.15810129    0.09862902   -0.00384018    0.00989959    0.00363902
   15
   -420.46018328
H   -2.58847191    0.92290935    0.25799282    0.03551866    0.03678724   -0.01001725
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O   -2.06103794   -1.25999182    0.16170734   -0.07546379   -0.00264873   -0.02102976
C   -0.75193520    0.63531640   -0.18199003   -0.01846746   -0.00960877   -0.05145967
C   -0.78677588   -0.88156021    0.16769477    0.08288329   -0.03149625    0.05730919
C    0.28094025    1.59122009    0.01587678    0.01588830    0.04063828    0.00888923
C    0.40140328   -1.64015773   -0.06616756   -0.02423145   -0.00540762   -0.00954415
C    1.58480878    1.23483736    0.24690835   -0.04331262   -0.00858737    0.01470749
C    1.74685988   -1.14374055   -0.23019253    0.02080286    0.13614441    0.02476969
H   -0.15773746    2.58757151    0.07125322   -0.01687885   -0.00290082    0.00013663
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H    2.22396912    2.12390064    0.38630127   -0.00070400    0.01016079   -0.00658848
H    2.61509234   -1.83459938   -0.55891583    0.04021995    0.00171686   -0.01210626
C    2.30509262   -0.02041767    0.04039503   -0.02248384   -0.16959388   -0.03753104
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   15
   -420.46570874
H   -2.58563707    0.91198347    0.27045651    0.01533193    0.02183638    0.00303423
O   -1.87693015    1.36919871   -0.19023862    0.00464918    0.01052849    0.00784372
O   -2.04683160   -1.28508444    0.16531236   -0.06491381   -0.00660609   -0.01870832
C   -0.73577867    0.65372650   -0.16274272    0.00645454    0.00005865   -0.03927863
C   -0.79741583   -0.89395659    0.16118217    0.06591554   -0.03454553    0.05120501
C    0.27782997    1.59772977    0.00452418    0.00869614    0.01568610   -0.00166609
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C    1.57317290    1.24222154    0.24713151   -0.04758825    0.01721222    0.01653492
C    1.74326926   -1.13438065   -0.24403935    0.03920598    0.15077443    0.02343924
H   -0.11717999    2.63067479    0.11511111   -0.01558360    0.01230177    0.00543246
H    0.28401902   -2.74132910    0.07766163   -0.00094701   -0.00643321    0.01117829
H    2.21258523    2.09439801    0.38434109   -0.01045861   -0.00658491   -0.00962581
H    2.53551384   -1.87146837   -0.59850008    0.02681322   -0.00217725   -0.01267230
C    2.30715089   -0.02159100    0.04628525   -0.02699394   -0.17575849   -0.04087191
H    3.40537367    0.19457126    0.19129229    0.02114588    0.01928745    0.01206554
   15
   -420.47126899
H   -2.59364330    0.88560535    0.28055113   -0.00914124    0.00193094    0.01962934
O   -1.87309712    1.38774639   -0.20160083    0.02661588    0.03384908   -0.01286283
O   -2.02970498   -1.30988460    0.16976441   -0.04772489   -0.00857477   -0.01588919
C   -0.72002228    0.67213030   -0.14112458    0.03326687    0.01020523   -0.02616817
C   -0.81199847   -0.90426750    0.15158122    0.04025247   -0.03686605    0.04341115
C    0.27422784    1.60327587   -0.00672601   -0.00510410   -0.00639575   -0.01253036
C    0.38978219   -1.67251664   -0.04655244   -0.01650069   -0.02655529   -0.00599813
C    1.56441620    1.24858994    0.24635938   -0.05227496    0.03782664    0.01751513
C    1.73733367   -1.13397663   -0.25925306    0.05257303    0.13354486    0.01220514
H   -0.06561293    2.66523489    0.15505792   -0.01079151    0.02240051    0.01071766
H    0.23624487   -2.75513847    0.09133804   -0.00637913   -0.00792624    0.01272110
H    2.20860358    2.06949146    0.38927766   -0.01799888   -0.02070671   -0.01192400
H    2.43704041   -1.90716705   -0.62918656    0.00655464    0.00050033   -0.00947741
C    2.31074339   -0.01229011    0.05459905   -0.01223027   -0.15142769   -0.03475149
H    3.40250526    0.19341460    0.22609171    0.01889551    0.01822289    0.01337627
   15
   -420.47375486
H   -2.59584033    0.85748179    0.27700274   -0.02143402   -0.01245692    0.02850741
O   -1.87042919    1.40478524   -0.21240970    0.03804193    0.05043883   -0.02606663
O   -2.01043975   -1.33430640    0.17493670   -0.02348006   -0.00768750   -0.01287986
C   -0.70626819    0.68992011   -0.11792302    0.05814411    0.01965391   -0.01320312
C   -0.82897886   -0.91234387    0.13936154    0.00730172   -0.04013027    0.03427052
C    0.27095427    1.60917029   -0.01722745   -0.02283929   -0.02079064   -0.02157210
C    0.38561719   -1.68661533   -0.03614749   -0.01085158   -0.03795970   -0.00338681
C    1.55885812    1.25274760    0.24454074   -0.06397499    0.04355385    0.01602652
C    1.72824293   -1.14153948   -0.27516664    0.06086210    0.09492339   -0.00639819
H   -0.00645079    2.68413856    0.18736384   -0.00305869    0.02456167    0.01469559
H    0.19297553   -2.76341200    0.09589055   -0.01037633   -0.00662534    0.01367392
H    2.21699731    2.05875536    0.40266034   -0.01616209   -0.02289589   -0.01185770
H    2.33399231   -1.94355356   -0.65323784   -0.01591754    0.00830918   -0.00331471
C    2.31500303    0.00606527    0.06497158    0.01680588   -0.10658438   -0.02018455
H    3.38661707    0.17934314    0.25144060    0.00690597    0.01371811    0.01166949
   15
   -420.47259252
H   -2.58340302    0.83785926    0.25345128   -0.02028273   -0.01888119    0.02850930
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O   -1.99013078   -1.35839166    0.18069405    0.00638242   -0.00357216   -0.01008983
C   -0.69599911    0.70653546   -0.09391801    0.07675786    0.02626422   -0.00120913
C   -0.84637888   -0.91798303    0.12507360   -0.02990929   -0.04534729    0.02426340
C    0.26906017    1.61626508   -0.02644110   -0.04022676   -0.02380798   -0.02726348
C    0.38211455   -1.69842337   -0.02554287   -0.00636720   -0.04832298    0.00025119
C    1.55720108    1.25435293    0.24176916   -0.08155082    0.03339458    0.01139327
C    1.71550677   -1.15484059   -0.29069555    0.06203149    0.05563070   -0.02454348
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H    0.15707194   -2.76703289    0.09063828   -0.01261489   -0.00335464    0.01391788
H    2.23643263    2.06376124    0.42440162   -0.00478099   -0.01302364   -0.00887740
H    2.24204120   -1.98576122   -0.67483926   -0.03238633    0.01327395    0.00171836
C    2.31822672    0.03083875    0.07654336    0.04944809   -0.05590353   -0.00139137
H    3.36612570    0.15548085    0.26854452   -0.01091562    0.00776486    0.00743534
   15
   -420.46826970
H   -2.55710145    0.83126528    0.20983850   -0.00664627   -0.01561921    0.02052107
O   -1.87015421    1.43176519   -0.23037699    0.02764005    0.05483133   -0.02665650
O   -1.97011556   -1.38232383    0.18691114    0.03722048    0.00278013   -0.00784757
C   -0.69032383    0.72158717   -0.06983267    0.08578887    0.02798784    0.00937525
C   -0.86197699   -0.92087202    0.10931980   -0.06562616   -0.05199455    0.01394102
C    0.26957594    1.62473183   -0.03402508   -0.05307366   -0.01345362   -0.02917840
C    0.37900555   -1.70732469   -0.01495921   -0.00353873   -0.05551831    0.00502155
C    1.56045476    1.25398089    0.23831799   -0.09497912    0.01456918    0.00488189
C    1.69906499   -1.17159211   -0.30478224    0.05429140    0.03247252   -0.03470591
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H    0.13014650   -2.76825607    0.07541027   -0.01315298    0.00021145    0.01339829
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H    2.17271399   -2.03679477   -0.69732883   -0.03760730    0.00661837    0.00119549
C    2.31852189    0.05901752    0.08820657    0.06964692   -0.00959145    0.01600597
H    3.35319577    0.12594626    0.28030613   -0.02355742    0.00302942    0.00307898
   15
   -420.46166802
H   -2.52671308    0.83521333    0.15181783    0.01817523   -0.00083341    0.00645681
O   -1.87207666    1.44152027   -0.23750269    0.00669323    0.03956338   -0.01599936
O   -1.95176402   -1.40637954    0.19348548    0.06131376    0.00833617   -0.00597093
C   -0.68978380    0.73497363   -0.04630680    0.08432830    0.02435149    0.01845153
C   -0.87365490   -0.92062196    0.09272297   -0.09160244   -0.05749207    0.00354550
C    0.27326283    1.63395909   -0.03985813   -0.05829612    0.00710859   -0.02845767
C    0.37611527   -1.71289551   -0.00468444   -0.00160382   -0.05733717    0.01080184
C    1.56938555    1.25274339    0.23457201   -0.09532443   -0.00764553   -0.00176654
C    1.67937128   -1.19038680   -0.31681306    0.04022731    0.02456994   -0.03649404
H    0.15771920    2.66224946    0.21888090    0.02179037   -0.01452515    0.01226101
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H    2.12995706   -2.09201418   -0.72038689   -0.03429496   -0.00935492   -0.00407691
C    2.31474174    0.08780480    0.09893086    0.06349691    0.03136245    0.02786223
H    3.35616817    0.09411855    0.28967611   -0.01930087   -0.00002543    0.00144971
   15
   -420.45433428
H   -2.50944361    0.83946768    0.08905624    0.04257203    0.01769490   -0.00569279
O   -1.87429776    1.44949999   -0.24390074   -0.01457456    0.02007173   -0.00619003
O   -1.93614002   -1.43079429    0.20032899    0.07110402    0.00887079   -0.00360136
C   -0.69430003    0.74690498   -0.02388956    0.07416855    0.01725842    0.02605889
C   -0.87988044   -0.91691946    0.07591401   -0.10030132   -0.05812932   -0.00732148
C    0.28043129    1.64275822   -0.04396923   -0.05481132    0.02720143   -0.02790940
C    0.37331871   -1.71503251    0.00493431    0.00102876   -0.05254056    0.01718051
C    1.58400156    1.25197871    0.23092820   -0.07993698   -0.03187564   -0.00749413
C    1.65726020   -1.21068335   -0.32665650    0.02288116    0.02016450   -0.03423425
H    0.18831973    2.65940273    0.20940924    0.02480975   -0.02618098    0.00980678
H    0.10386531   -2.77216981    0.01714565   -0.01063869    0.00111248    0.00971388
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   15
   -420.45100942
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   15
   -420.45135943
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   15
   -420.44978414
H   -2.61622889    0.79610775   -0.08502715   -0.01113245   -0.02254480    0.00714259
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O   -1.90650866   -1.50467125    0.22100687    0.02115154   -0.03015068    0.01279822
C   -0.73065675    0.77801044    0.03248792    0.01923868    0.00379475    0.04165352
C   -0.86609058   -0.88689424    0.03111004   -0.03235077   -0.02249784   -0.04468880
C    0.31854698    1.65846351   -0.04559657   -0.00549377    0.02080521   -0.03443912
C    0.36320964   -1.70531454    0.02601665    0.02071414   -0.01323156    0.03481729
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   15
   -420.44680765
H   -2.66255848    0.79449328   -0.14809432   -0.02851746   -0.03062332    0.00520143
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C   -0.85517711   -0.87295050    0.02055207   -0.00065359   -0.00711692   -0.05550514
C    0.33349852    1.66052943   -0.04214575    0.01608874    0.01336360   -0.03288041
C    0.35795561   -1.69931210    0.02927210    0.02718167   -0.00163762    0.03865010
C    1.67216005    1.27989244    0.22238134    0.03113053   -0.06384014   -0.00812099
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C    2.27440108    0.15739228    0.12141454   -0.02467694    0.16149159    0.04440075
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   15
   -420.44507080
H   -2.68915865    0.81424167   -0.21474661   -0.03232870   -0.02702241    0.00050886
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O   -1.89329687   -1.54831938    0.23238562   -0.01652431   -0.06110882    0.02388824
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C    0.34748858    1.66176408   -0.03671920    0.03539651    0.01046892   -0.02878996
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   15
   -420.44416073
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O   -1.89652433    1.46726531   -0.27069118    0.04473635    0.02296688   -0.00672944
O   -1.88596518   -1.56632108    0.23656839   -0.02606388   -0.07131018    0.02675772
C   -0.77734153    0.80562260    0.06671713   -0.03778447    0.01913970    0.04570863
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C    0.34244710   -1.68736275    0.02861741    0.02584422    0.00742754    0.04355181
C    1.71226514    1.31691269    0.22173073    0.02075469   -0.02079119   -0.01186245
C    1.54061599   -1.32428541   -0.34639778   -0.09328588   -0.09944532   -0.03309545
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C    2.26520130    0.12440540    0.11252374    0.03890068    0.09440857    0.04107305
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   15
   -420.44200957
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O   -1.87747359   -1.58110002    0.23954436   -0.02955820   -0.07803619    0.02766492
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C   -0.82821407   -0.83124792    0.01065318    0.06126458    0.02038736   -0.06968310
C    0.36825992    1.66213108   -0.02098165    0.05720704    0.01948921   -0.01805328
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C    1.53507209   -1.33001859   -0.34321440   -0.10285993   -0.10507082   -0.03354252
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H    0.13666757   -2.70728669   -0.25650023    0.01370568    0.00763095   -0.01124425
H    2.28409287    2.15217613    0.71830440   -0.00633310    0.00698228    0.01340467
H    2.33469240   -1.97651859   -0.65948577    0.00105180    0.01467353    0.00011945
C    2.25816765    0.09816957    0.10429688    0.05078286    0.05265646    0.03286087
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   15
   -420.43807099
H   -2.67780372    0.93756916   -0.40801668    0.03101096    0.03368474   -0.00028749
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O   -1.86766114   -1.59234906    0.24127164   -0.02763835   -0.08183077    0.02681035
C   -0.79924509    0.81884859    0.07586200   -0.05438338    0.03531249    0.04232942
C   -0.82530347   -0.81924046    0.01556424    0.06792956    0.02432104   -0.06828461
C    0.37373647    1.66073013   -0.01130746    0.05699990    0.02872174   -0.01384812
C    0.32118955   -1.67691820    0.01743218    0.00081454    0.00279614    0.04808543
C    1.74740303    1.35889178    0.22398570    0.00500241    0.02673893   -0.01733873
C    1.53571915   -1.32944973   -0.33800678   -0.10632150   -0.10025854   -0.03313272
H    0.03966403    2.68954165   -0.13096148   -0.00676868   -0.00367460   -0.00192796
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C    2.24820168    0.06872570    0.09411232    0.03616549    0.01531381    0.01895502
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   15
   -420.43588048
H   -2.69237684    0.95280471   -0.46931642    0.02439286    0.03227046    0.00034983
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O   -1.85661318   -1.59989527    0.24178834   -0.02076390   -0.08291898    0.02437076
C   -0.80546647    0.82250362    0.07653620   -0.05381958    0.04185889    0.03956216
C   -0.82646249   -0.80869712    0.02459130    0.06687378    0.02685981   -0.06413177
C    0.37579557    1.65761163   -0.00079027    0.05092715    0.03403196   -0.01060257
C    0.31005788   -1.67203948    0.00754948   -0.01663849    0.00015280    0.05069959
C    1.76432012    1.37818533    0.22662008    0.00936387    0.05134320   -0.01424828
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H    0.02231657    2.65182319   -0.18895346   -0.00546728   -0.01719368   -0.00277329
H    0.09980602   -2.68712529   -0.28245975    0.01262684    0.00973288   -0.01098279
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C    2.23610165    0.03833366    0.08279099    0.01055504   -0.01763054    0.00306133
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   15
   -420.43615855
H   -2.72295857    0.94583696   -0.53032105   -0.00698461    0.01411155   -0.00742239
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O   -1.84464030   -1.60368988    0.24120477   -0.00928534   -0.08115799    0.02046876
C   -0.80845751    0.82363878    0.07482070   -0.04832129    0.04605487    0.03621010
C   -0.83162673   -0.79977218    0.03748334    0.05798718    0.02816335   -0.05726273
C    0.37478596    1.65248848    0.01036304    0.04250202    0.02906613   -0.00630232
C    0.29992917   -1.66717214   -0.00539437   -0.03342143   -0.00217298    0.05227425
C    1.78063026    1.39437530    0.23009565    0.02181155    0.07564227   -0.00710175
C    1.55567665   -1.31096740   -0.32161231   -0.07841514   -0.06945734   -0.03151460
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C    2.22335083    0.00899236    0.07127655   -0.01312008   -0.04747977   -0.01137978
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   15
   -420.43668104
H   -2.74896814    0.92850019   -0.58590440   -0.03218857   -0.00154255   -0.01662697
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O   -1.83226196   -1.60381453    0.23969763    0.00645066   -0.07609668    0.01521576
C   -0.80854620    0.82200560    0.07091753   -0.03882433    0.04690255    0.03239101
C   -0.84026073   -0.79254236    0.05382542    0.04164448    0.02778505   -0.04774632
C    0.37120743    1.64565694    0.02188391    0.03357507    0.01454194    0.00060875
C    0.29180496   -1.66216676   -0.02148596   -0.04691104   -0.00578461    0.05113360
C    1.79559090    1.40599463    0.23398538    0.04024282    0.09901370    0.00302929
C    1.57329605   -1.29491308   -0.31053336   -0.04633975   -0.04432204   -0.02841636
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H    2.46362929   -1.90630591   -0.55079957    0.02535779    0.01673200   -0.00023508
C    2.21136726   -0.01748467    0.06043783   -0.03163085   -0.07588049   -0.02333035
H    3.32845006   -0.10674795    0.33423309    0.03114006    0.00372293    0.01493156
   15
   -420.43765298
H   -2.75284164    0.91173296   -0.62979983   -0.04036406   -0.00835047   -0.02125601
O   -1.95966102    1.46141164   -0.28036685    0.02579292    0.01097613    0.00673246
O   -1.82019049   -1.60050072    0.23750442    0.02596871   -0.06725610    0.00884187
C   -0.80630023    0.81755398    0.06505757   -0.02666000    0.04414049    0.02813234
C   -0.85138064   -0.78698022    0.07304280    0.01878381    0.02484413   -0.03578146
C    0.36560440    1.63795662    0.03336052    0.02343173   -0.00222029    0.00896130
C    0.28649388   -1.65679761   -0.04065028   -0.05563750   -0.01212094    0.04608824
C    1.80810813    1.41164287    0.23769005    0.06039437    0.11874171    0.01341684
C    1.59367835   -1.27621382   -0.29775147   -0.00643741   -0.01210445   -0.02224510
H   -0.00188060    2.61086980   -0.34357022   -0.01206514   -0.00179767   -0.01489840
H   -0.01061219   -2.69253286   -0.26257364   -0.00486952   -0.00833506   -0.00847186
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   15
   -420.43916493
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   15
   -420.43946707
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   15
   -420.43838221
H   -2.62820629    0.88073415   -0.68399927    0.01707715    0.02406120    0.00645445
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C   -0.88467992   -0.77749984    0.14021698   -0.06544012   -0.00188693    0.00824596
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   15
   -420.44191376
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   15
   -420.45211029
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O   -1.79708207   -1.55105789    0.22663841    0.10418278   -0.00415334   -0.01882676
C   -0.78537505    0.76495707    0.01662604    0.01840670   -0.00758245   -0.00217381
C   -0.89051570   -0.77180950    0.18407393   -0.09262276   -0.01370222    0.03613638
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   15
   -420.46108652
H   -2.54872527    0.74942518   -0.74378327    0.00024195   -0.01693667   -0.01193043
O   -2.01927453    1.45888663   -0.28331278   -0.03033669    0.04961361    0.00403074
O   -1.80505453   -1.53874669    0.22626763    0.09153606   -0.00684277   -0.02045127
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C   -0.88536125   -0.76786460    0.20313721   -0.08608864   -0.00933601    0.04804594
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C    1.65650960   -1.22199192   -0.21278425    0.07037877    0.07789058    0.01217877
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   15
   -420.46503230
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O   -1.81713966   -1.52610044    0.22682232    0.06817441   -0.01596224   -0.02140485
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C   -0.87506261   -0.76338382    0.21930158   -0.06721194    0.00067396    0.05856283
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C    1.64960051   -1.23211253   -0.20072275    0.03839751    0.03777244    0.00762745
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H    2.23208102   -2.15607224   -0.34922797   -0.01372707   -0.01829581    0.00056078
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H    3.32713489   -0.24140094    0.09994304    0.02159218   -0.02939102   -0.00053659
   15
   -420.46485440
H   -2.52037485    0.68634332   -0.76115270   -0.00324968   -0.03471641   -0.02067209
O   -2.02585112    1.44915471   -0.28181824   -0.02463863    0.07309470    0.01536065
O   -1.83229776   -1.51272056    0.22834711    0.03935759   -0.02756170   -0.02205714
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C    0.32433416    1.58559289    0.09134020   -0.01754450    0.02607498    0.01449176
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C    1.77374323    1.24021207    0.23457101    0.05943073   -0.07142199    0.00349965
C    1.64040297   -1.24451174   -0.18912031   -0.00033376   -0.00356491    0.00259067
H    0.16173340    2.59598765   -0.26347120    0.00684330   -0.00547280   -0.00849371
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   15
   -420.46274620
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C   -0.78302508    0.72666015   -0.02250199    0.01404334   -0.04790865   -0.02418332
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C    0.35833111   -1.52615550   -0.24904253    0.06887749    0.01213131   -0.05450416
C    1.75551779    1.21431119    0.23163499    0.07542552   -0.09819969    0.00096432
C    1.63124111   -1.25672892   -0.17767495   -0.04208192   -0.03825954   -0.00234806
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C    2.25213653    0.06991699    0.05412489   -0.08384364    0.17990782    0.01900629
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   15
   -420.46189138
H   -2.49025572    0.70934021   -0.72706028    0.02470467    0.00378717    0.00321349
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C   -0.82653302   -0.75287890    0.24460339    0.01756880    0.02698960    0.07765733
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C    1.73282253    1.19422660    0.22862449    0.07338971   -0.10123300    0.00163653
C    1.62461272   -1.26669487   -0.16609215   -0.08140393   -0.06061336   -0.00635866
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C    2.28049053    0.07684939    0.05723558   -0.05232614    0.18826276    0.02005069
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   15
   -420.46464765
H   -2.49572273    0.72571468   -0.70797440    0.03882265    0.02712776    0.01577761
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O   -1.88348996   -1.46340273    0.23894995   -0.03338765   -0.04804782   -0.02105366
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C    0.32656867    1.55063674    0.09824086    0.01654538   -0.00778008    0.01297828
C    0.36456064   -1.48535881   -0.27318097    0.08486170    0.03937540   -0.04867140
C    1.70583752    1.18017121    0.22548971    0.04272356   -0.08585524    0.00716927
C    1.62285897   -1.27306682   -0.15413555   -0.11099018   -0.06894056   -0.00823856
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C    2.31189381    0.07258896    0.05917195    0.00063285    0.15904773    0.01362103
H    3.36078231    0.00595064   -0.01405347   -0.02561702   -0.00310428   -0.00134597
   15
   -420.47268856
H   -2.52782912    0.72428633   -0.69908661    0.03206265    0.02364849    0.01022477
O   -2.01997874    1.39855381   -0.28205063   -0.05957417    0.00940782   -0.01721102
O   -1.89880887   -1.44287778    0.24444152   -0.04598406   -0.04756693   -0.01891940
C   -0.79080671    0.72447455   -0.03812664    0.01354607   -0.02895768   -0.02632202
C   -0.79635278   -0.75289306    0.23876416    0.06532081    0.02062747    0.07439111
C    0.32629446    1.53914878    0.09877235    0.02982776   -0.01139974    0.00760627
C    0.36010329   -1.46815818   -0.28071640    0.06461857    0.04625665   -0.04283060
C    1.67636607    1.17127217    0.22190627   -0.00703755   -0.06299166    0.01557754
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H    0.18340407   -2.54637466   -0.31306607    0.01609760   -0.00266460    0.01144545
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   15
   -420.48061209
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C   -0.78649282   -0.75491295    0.22901773    0.08276929    0.01092205    0.06732912
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C    1.64732090    1.16618330    0.21738742   -0.05732860   -0.04003830    0.02278378
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   15
   -420.47989644
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O   -1.92296625   -1.39554198    0.25784843   -0.05294334   -0.03817453   -0.01198779
C   -0.80010441    0.73235361   -0.04065912    0.01947182    0.00830715   -0.02095831
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   15
   -420.47338977
H   -2.68664830    0.68066103   -0.66596716   -0.03241231   -0.01992938   -0.02707672
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O   -1.93148583   -1.36915410    0.26545205   -0.04815105   -0.03008461   -0.00790590
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C   -0.78240768   -0.76018971    0.19794360    0.09852215   -0.01323806    0.04604295
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C    1.60172324    1.16213666    0.20404869   -0.11568171   -0.00475072    0.02639679
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H    2.38081884   -2.10724556   -0.24012582    0.01465662   -0.00050450    0.00498697
C    2.41908007   -0.01102445    0.06302250    0.04417131   -0.03343612   -0.00161622
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   15
   -420.46923994
H   -2.71017237    0.68651464   -0.62385103   -0.03314435   -0.01333979   -0.02439976
O   -1.98397847    1.33052138   -0.27797854    0.02376122    0.01346692    0.01641096
O   -1.93784000   -1.34140891    0.27341542   -0.03817118   -0.01993311   -0.00407959
C   -0.81398284    0.73817962   -0.03813575    0.01891862    0.04774237   -0.01476601
C   -0.78911121   -0.76200394    0.17788828    0.09211190   -0.02400495    0.03476021
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C    0.32575164   -1.42942088   -0.28909661   -0.07186091    0.05385314   -0.01502733
C    1.58866410    1.16104056    0.19500798   -0.11645806    0.00833549    0.02317363
C    1.71386959   -1.25020869   -0.09059908   -0.03286838   -0.01862884    0.01559982
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C    2.43833037   -0.03401430    0.06412739    0.04000602   -0.06982136   -0.00131465
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   15
   -420.46911172
H   -2.71073706    0.70139209   -0.56451453   -0.01868847    0.00296951   -0.01594619
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O   -1.94248131   -1.31276672    0.28156681   -0.02309943   -0.00780181   -0.00105144
C   -0.82266514    0.73735675   -0.03544151    0.01283198    0.06236274   -0.01205606
C   -0.80132410   -0.76238048    0.15572349    0.07352302   -0.03197067    0.02488097
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C    1.58256188    1.15944350    0.18457694   -0.10021018    0.02062451    0.01774409
C    1.74513146   -1.23899976   -0.07921581    0.00293237    0.00064456    0.02198163
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C    2.45514072   -0.05281987    0.06531717    0.04017622   -0.09835790   -0.00207066
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   15
   -420.46815741
H   -2.69868638    0.71368197   -0.49380000    0.00883312    0.02599958   -0.00604615
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O   -1.94609204   -1.28377748    0.28977071   -0.00335258    0.00610321    0.00071860
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C   -0.81792411   -0.76084085    0.13204414    0.04319305   -0.03646665    0.01691479
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C    0.32603383   -1.42916435   -0.28599259   -0.08160391    0.03880901   -0.00746029
C    1.58247037    1.15661003    0.17307683   -0.07416862    0.03033919    0.01150493
C    1.77622892   -1.22785244   -0.06916231    0.03612568    0.02433481    0.02842733
H    0.08309901    2.55023057    0.31511872    0.00244542    0.00515751    0.01383252
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H    2.39871301   -2.08816882   -0.25702751    0.00236509    0.01276864    0.00395899
C    2.46948118   -0.06572605    0.06664135    0.04862224   -0.11692403   -0.00465139
H    3.51219041    0.32534265   -0.11517813    0.01611490    0.03395890   -0.01062941
   15
   -420.46408331
H   -2.69252509    0.70778721   -0.41830615    0.02778985    0.03961413   -0.00278849
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O   -1.94956244   -1.25506914    0.29794753    0.01945228    0.02101752    0.00105241
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C   -0.83709492   -0.75711506    0.10733408    0.00472513   -0.03706534    0.01046512
C    0.25655702    1.48004842    0.10640220   -0.00864460   -0.04153401   -0.02312356
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C    1.58686736    1.15199151    0.16087903   -0.04854835    0.03013035    0.00555834
C    1.80517263   -1.21819028   -0.06082875    0.06322024    0.05054037    0.03497914
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H    1.99771985    2.12881837    0.13451746   -0.03917568   -0.00974083   -0.00700028
H    2.39659137   -2.09665200   -0.26887605   -0.00028350    0.01025129    0.00217233
C    2.48080478   -0.07163092    0.06825904    0.07169638   -0.12177425   -0.00954221
H    3.47499234    0.28011647   -0.10176630   -0.01910293    0.01972441   -0.00567870
   15
   -420.46014087
H   -2.70425655    0.67504127   -0.34040935    0.01414961    0.02721910   -0.00548456
O   -1.95698915    1.26115708   -0.28241249    0.04720646   -0.06453824    0.01158825
O   -1.95391339   -1.22731274    0.30608079    0.04158042    0.03544196    0.00030664
C   -0.85052068    0.71105896   -0.02362481   -0.02653281    0.05962235   -0.00277413
C   -0.85654436   -0.75117167    0.08198866   -0.03505608   -0.03278630    0.00449419
C    0.24094370    1.47834824    0.11123066   -0.02979883   -0.03303763   -0.02224395
C    0.34529205   -1.43808725   -0.28093609   -0.05414127    0.01403369   -0.00673499
C    1.59424106    1.14563041    0.14834692   -0.03065903    0.01466845   -0.00080071
C    1.83033117   -1.21157211   -0.05460858    0.08275787    0.07413779    0.04108669
H    0.01855397    2.54667457    0.37217383   -0.00406602    0.01535587    0.01602258
H    0.07075457   -2.35472761   -0.83030869   -0.01012157    0.00240206   -0.01544198
H    1.99708391    2.13479355    0.18004170   -0.03633808   -0.00383724   -0.00493464
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C    2.48775424   -0.07022831    0.07045396    0.10025833   -0.11576125   -0.01420673
H    3.45189299    0.22083657   -0.08430187   -0.05813110    0.00365058   -0.00038617
   15
   -420.45941261
H   -2.72527772    0.62345931   -0.25884818   -0.01450220    0.00202381   -0.00414091
O   -1.95366505    1.25017781   -0.28448170    0.08794724   -0.04292879    0.01160579
O   -1.96012753   -1.20115398    0.31420025    0.05745183    0.04710901   -0.00043500
C   -0.85778557    0.69455014   -0.01907112   -0.03930881    0.03801937    0.00281790
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C    0.22711347    1.47860020    0.11738802   -0.04721927   -0.01542038   -0.01811116
C    0.36030863   -1.44420920   -0.27779748   -0.03653900    0.00323998   -0.00659085
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H    2.02220474    2.14302450    0.22901140   -0.02668306    0.01034108   -0.00121405
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C    2.48881149   -0.06182537    0.07347391    0.09613856   -0.10838038   -0.01246983
H    3.46842481    0.15823147   -0.06618761   -0.06134359   -0.00188452   -0.00087051
   15
   -420.45983240
H   -2.73658396    0.56998509   -0.17463239   -0.03233618   -0.01702087    0.00246117
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O   -1.96890505   -1.17711461    0.32233345    0.06194371    0.05404711    0.00039785
C   -0.86269701    0.67579824   -0.01469708   -0.04744152    0.00533011    0.01020229
C   -0.88726102   -0.73409366    0.03091248   -0.08590836   -0.00339366   -0.01106376
C    0.21611321    1.47975154    0.12462764   -0.05955225    0.00862525   -0.01142053
C    0.37754344   -1.45054191   -0.27426450   -0.02055480   -0.00462778   -0.00562160
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C    1.86498905   -1.21248950   -0.04986457    0.10068154    0.08807442    0.04719270
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H    0.02627645   -2.29413724   -0.88804541   -0.01921471    0.01180721   -0.01474479
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C    2.48428211   -0.04690711    0.07721647    0.05004596   -0.09283961   -0.00485787
H    3.52622212    0.09658829   -0.04712166   -0.01928821   -0.00121386   -0.00637978
   15
   -420.45562836
H   -2.72553749    0.52815488   -0.09224729   -0.03477247   -0.02606609    0.01016386
O   -1.95974239    1.23320067   -0.28978259    0.10936964   -0.00899880   -0.00695999
O   -1.98044313   -1.15550760    0.33043817    0.05334422    0.05578566    0.00393424
C   -0.86476333    0.65676263   -0.01094480   -0.05080122   -0.03490880    0.01851999
C   -0.89549878   -0.72473937    0.00612985   -0.08799476    0.02208978   -0.02203841
C    0.20868702    1.48038157    0.13255367   -0.06635665    0.03234225   -0.00392833
C    0.39603654   -1.45661155   -0.27039700   -0.00752134   -0.00914188   -0.00356529
C    1.62554297    1.12750485    0.11317492   -0.01065448   -0.05612975   -0.02864737
C    1.87340152   -1.22083064   -0.05169928    0.09979354    0.07124788    0.04509138
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H    2.39524329   -2.15400032   -0.31318130   -0.00504586   -0.01027553   -0.00527140
C    2.47671926   -0.02647788    0.08125982    0.00335987   -0.05774706    0.00175936
H    3.59782580    0.03618285   -0.02360099    0.02600864   -0.00577984   -0.00993228
   15
   -420.44919039
H   -2.69018415    0.50460849   -0.01706308   -0.02481044   -0.02679156    0.01588815
O   -1.97013165    1.22567637   -0.29220390    0.09253089   -0.00120024   -0.01728524
O   -1.99436155   -1.13641674    0.33835392    0.03419351    0.05358103    0.01015315
C   -0.86377548    0.63984064   -0.00831080   -0.05048498   -0.07552624    0.02651312
C   -0.89848059   -0.71673458   -0.01731370   -0.07701959    0.05012774   -0.03424438
C    0.20524399    1.47911097    0.14072637   -0.06717674    0.04516949    0.00181852
C    0.41499795   -1.46214586   -0.26631977    0.00286270   -0.01011251   -0.00031119
C    1.63766312    1.12647959    0.10411948   -0.00500995   -0.06808370   -0.03655518
C    1.87580230   -1.23342036   -0.05624342    0.09412472    0.04251019    0.03951270
H   -0.07507784    2.47437764    0.37093118   -0.00397680   -0.02201412    0.00214131
H    0.03525096   -2.26717304   -0.90357658   -0.02055270    0.01958115   -0.01291056
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H    2.40092619   -2.15543801   -0.31669082   -0.00788783   -0.00686245   -0.00400522
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   15
   -420.44489772
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O   -2.00981034   -1.11975072    0.34580340    0.00941405    0.04966405    0.01787040
C   -0.85974830    0.62744190   -0.00727413   -0.04731329   -0.10728646    0.03331954
C   -0.89684058   -0.71173852   -0.03868836   -0.05873876    0.07357221   -0.04603939
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C    0.43379151   -1.46708830   -0.26223025    0.01222233   -0.00713034    0.00425545
C    1.65007604    1.12952674    0.09725801    0.00262789   -0.07099472   -0.04112960
C    1.87252919   -1.24856223   -0.06316591    0.08455595    0.00998217    0.03168833
H   -0.09025776    2.47921931    0.36019584   -0.00635696   -0.01543178    0.00206319
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   15
   -420.44298631
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O   -2.00210998    1.21090442   -0.29447078    0.02926515   -0.01135314   -0.02266753
O   -2.02568361   -1.10533928    0.35244199   -0.01615663    0.04599109    0.02562135
C   -0.85287522    0.62144531   -0.00824589   -0.04094910   -0.12199449    0.03879111
C   -0.89165767   -0.71113240   -0.05728755   -0.03842785    0.08527677   -0.05609259
C    0.21018835    1.46890457    0.15660867   -0.05494569    0.02237926    0.00588123
C    0.45183903   -1.47162165   -0.25840456    0.02294994    0.00025899    0.01009331
C    1.66232046    1.13681857    0.09286305    0.01208703   -0.06422155   -0.04159626
C    1.86417002   -1.26432883   -0.07200246    0.06936499   -0.01857580    0.02334772
H   -0.10074430    2.49470136    0.34791451   -0.01046628   -0.00112513    0.00316406
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H    2.43076709   -2.14747709   -0.31656093   -0.00997201    0.00210935   -0.00046466
C    2.45755832    0.04375567    0.09205453   -0.02871266    0.08261132    0.00788563
H    3.64702980   -0.09461710    0.08720060    0.05226374   -0.02916529   -0.00492564
   15
   -420.44219310
H   -2.54025781    0.52038003    0.14355327    0.04036970    0.01183177    0.00172727
O   -2.02088045    1.20410060   -0.29407580   -0.00303017   -0.02420210   -0.01724588
O   -2.04083386   -1.09301958    0.35792233   -0.03911274    0.04360821    0.03224898
C   -0.84354879    0.62272200   -0.01155752   -0.02996282   -0.11605386    0.04300156
C   -0.88414323   -0.71560599   -0.07250635   -0.01951805    0.08170096   -0.06376129
C    0.21786929    1.46127789    0.16405570   -0.04827167   -0.00020082    0.00737582
C    0.46848080   -1.47619282   -0.25519315    0.03716343    0.01203278    0.01666170
C    1.67383695    1.14795511    0.09096711    0.02072483   -0.04980280   -0.03885251
C    1.85165863   -1.27901341   -0.08225512    0.04572032   -0.03911787    0.01577330
H   -0.10372763    2.51107192    0.33339941   -0.01393114    0.01208368    0.00358424
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H    2.32423660    1.93460157    0.42561200    0.00416868   -0.02844548    0.00823999
H    2.45621043   -2.14415058   -0.31534266   -0.00575414    0.00140505   -0.00023748
C    2.45450970    0.06081366    0.09478606   -0.00828158    0.10905825    0.00844817
H    3.58712972   -0.10306683    0.13370878    0.02979929   -0.03094734   -0.00255112
   15
   -420.44189149
H   -2.52675018    0.52438377    0.18625398    0.04242202    0.01506351   -0.00064273
O   -2.03956746    1.19835211   -0.29287698   -0.02160865   -0.02643374   -0.01714903
O   -2.05422584   -1.08268463    0.36194639   -0.05775108    0.04284460    0.03704276
C   -0.83243863    0.63092677   -0.01746179   -0.01344289   -0.09216874    0.04557351
C   -0.87543307   -0.72495291   -0.08388232   -0.00359510    0.06472087   -0.06876347
C    0.22848231    1.45365089    0.17105101   -0.04400266   -0.02044900    0.00995283
C    0.48285491   -1.48150802   -0.25298722    0.05531899    0.02704840    0.02275633
C    1.68413245    1.16209510    0.09142019    0.02292979   -0.03366817   -0.03596226
C    1.83642766   -1.29136794   -0.09346691    0.01322824   -0.05263459    0.00919730
H   -0.09681490    2.51914932    0.31639252   -0.01514051    0.01861071    0.00255731
H    0.20962339   -2.37953555   -0.82078211   -0.00437813    0.01086158   -0.01591779
H    2.36382416    1.90312165    0.43008868    0.00214397   -0.04071400    0.00431299
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C    2.45183528    0.07137712    0.09699722    0.03668557    0.11564842    0.01096209
H    3.50712741   -0.08964388    0.18221130   -0.01469886   -0.02595177   -0.00285361
   15
   -420.44061196
H   -2.54272663    0.51844389    0.22867393    0.02724691    0.00401347    0.00860817
O   -2.05732742    1.19375377   -0.29086178   -0.02648631   -0.01641908   -0.02641879
O   -2.06501521   -1.07429937    0.36429764   -0.07170082    0.04360348    0.03976480
C   -0.82053441    0.64465279   -0.02611046    0.00672254   -0.05770110    0.04577856
C   -0.86648962   -0.73817555   -0.09111410    0.00918886    0.04003871   -0.07086966
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C    0.49387357   -1.48846354   -0.25214707    0.07528489    0.04292335    0.02673330
C    1.69309367    1.17829268    0.09406187    0.01511745   -0.02150270   -0.03556753
C    1.82042025   -1.30055570   -0.10523794   -0.02373495   -0.06275915    0.00322949
H   -0.07916198    2.51433720    0.29761573   -0.01362901    0.01662550    0.00031668
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H    2.40144098    1.90016147    0.43123072    0.00690297   -0.04004587    0.00400833
H    2.51355387   -2.13708546   -0.31164760    0.01015997   -0.00719118   -0.00210255
C    2.44687276    0.07503013    0.09852304    0.09225806    0.10609890    0.01735442
H    3.43841855   -0.05784350    0.23307841   -0.06799892   -0.01639802   -0.00779578
   15
   -420.44394271
H   -2.57804354    0.50969027    0.26472396    0.00699478   -0.00873574    0.02089615
O   -2.07390121    1.18990164   -0.28764479   -0.02694627   -0.00627675   -0.03671470
O   -2.07256765   -1.06789701    0.36485177   -0.08131081    0.04557176    0.04061401
C   -0.80903155    0.66185843   -0.03751333    0.02587831   -0.02110186    0.04310847
C   -0.85808894   -0.75381307   -0.09407498    0.01935870    0.01393575   -0.06994237
C    0.25754728    1.44286145    0.18299923   -0.03817596   -0.04050818    0.01803247
C    0.50035444   -1.49800374   -0.25290539    0.09211144    0.05653694    0.02708079
C    1.70117091    1.19581341    0.09886274    0.00138752   -0.01364876   -0.03668486
C    1.80582716   -1.30595316   -0.11720685   -0.05638993   -0.07165401   -0.00218992
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H    2.43376662    1.92540706    0.42930690    0.01680067   -0.02896970    0.00661683
H    2.53436342   -2.12753044   -0.30792215    0.01589144   -0.00901537   -0.00260959
C    2.43657913    0.07228296    0.09901760    0.10053684    0.09218924    0.01965594
H    3.41580340   -0.01394934    0.28938766   -0.07540769   -0.01078422   -0.00944632
   15
   -420.45232545
H   -2.61866113    0.50683464    0.28604511   -0.00911133   -0.01525639    0.02815035
O   -2.08924456    1.18636310   -0.28278638   -0.02926568   -0.00343766   -0.04081485
O   -2.07644489   -1.06356488    0.36356878   -0.08715324    0.04815820    0.03995799
C   -0.79906485    0.68036348   -0.05150867    0.03938514    0.01102578    0.03750230
C   -0.85084794   -0.77031012   -0.09282057    0.02728384   -0.00896275   -0.06605268
C    0.27562249    1.44090107    0.18746777   -0.03182449   -0.03831762    0.02267922
C    0.50131057   -1.51093634   -0.25527955    0.09983826    0.06479167    0.02311474
C    1.70915751    1.21416085    0.10587544   -0.01121930   -0.00605618   -0.03649886
C    1.79457255   -1.30702640   -0.12904864   -0.07484027   -0.07863559   -0.00653899
H   -0.01778010    2.47756038    0.26160107   -0.00372236   -0.00959315   -0.00561233
H    0.38228175   -2.54986969   -0.64497748    0.01522939   -0.00920254   -0.01302992
H    2.45405780    1.97129687    0.42262320    0.02575955   -0.01416794    0.00925176
H    2.54400945   -2.11171313   -0.30235972    0.01701325   -0.00702339   -0.00234313
C    2.42053487    0.06398787    0.09840058    0.04801830    0.07259284    0.00808718
H    3.44377528    0.03776407    0.35162359   -0.02542173   -0.00594721    0.00208499
   15
   -420.45576209
H   -2.65317747    0.51451058    0.28754539   -0.01742704   -0.01423894    0.02787976
O   -2.10324506    1.18300967   -0.27610578   -0.03554965   -0.00841074   -0.03706358
O   -2.07638057   -1.06141839    0.36047745   -0.08954086    0.05074040    0.03806317
C   -0.79143942    0.69824263   -0.06775895    0.04489771    0.03511827    0.02927649
C   -0.84524509   -0.78629290   -0.08758499    0.03279012   -0.02639305   -0.05942967
C    0.29559396    1.44124366    0.19056669   -0.01982078   -0.03346415    0.02694660
C    0.49629459   -1.52774851   -0.25903240    0.09459471    0.06536409    0.01532610
C    1.71779728    1.23285627    0.11508069   -0.01879907    0.00501642   -0.03338895
C    1.78774074   -1.30336297   -0.14050310   -0.07297270   -0.08181707   -0.00928396
H    0.01898563    2.46389138    0.24853882    0.00177290   -0.02396763   -0.00777056
H    0.42422570   -2.59921262   -0.56563094    0.02055282   -0.01179469   -0.00873030
H    2.45613295    2.02749177    0.40939598    0.02927824   -0.00096412    0.00998348
H    2.54171805   -2.09107318   -0.29514901    0.01291587   -0.00116446   -0.00143091
C    2.40157953    0.05136209    0.09731393   -0.00631207    0.04185269   -0.00765588
H    3.49029521    0.09340501    0.41216071    0.02361063    0.00412572    0.01726841
   15
   -420.45612695
H   -2.67572227    0.53195927    0.26945205   -0.01608385   -0.00505546    0.01955841
O   -2.11561115    1.18006676   -0.26777301   -0.04755145   -0.02106480   -0.02550227
O   -2.07226759   -1.06157162    0.35566404   -0.08812767    0.05266818    0.03486176
C   -0.78649090    0.71404214   -0.08577030    0.04279516    0.05041715    0.01915288
C   -0.84160969   -0.80070837   -0.07876737    0.03513880   -0.03806523   -0.05036480
C    0.31672941    1.44364230    0.19204040   -0.00103673   -0.03472688    0.03035051
C    0.48561901   -1.54847079   -0.26370028    0.07727229    0.05738623    0.00516071
C    1.72753911    1.25122718    0.12628997   -0.01938514    0.02018311   -0.02721848
C    1.78522431   -1.29478171   -0.15140529   -0.05190142   -0.07887901   -0.01018633
H    0.05463944    2.46680434    0.24098915    0.00459215   -0.02733779   -0.00859066
H    0.45148070   -2.64022864   -0.48004099    0.02397167   -0.01159846   -0.00371606
H    2.43754327    2.08464127    0.38912808    0.02585614    0.00788060    0.00829058
H    2.53036924   -2.06975119   -0.28692196    0.00485203    0.00718777   -0.00029666
C    2.38288424    0.03623263    0.09666330   -0.03777147    0.00548453   -0.01851844
H    3.52140378    0.14600449    0.46061578    0.04730753    0.01550852    0.02702335
   15
   -420.45761184
H   -2.68730178    0.55251656    0.23770396   -0.00476952    0.01273550    0.00434867
O   -2.12579222    1.17810866   -0.25830875   -0.06651675   -0.04105358   -0.00750077
O   -2.06417392   -1.06411130    0.34927477   -0.08189677    0.05374313    0.03008137
C   -0.78410401    0.72683223   -0.10493537    0.03537570    0.05778707    0.00810082
C   -0.84007795   -0.81284640   -0.06691472    0.03316207   -0.04479130   -0.03909254
C    0.33790434    1.44818819    0.19168390    0.02227877   -0.04484350    0.03268833
C    0.47030341   -1.57262418   -0.26867773    0.05323488    0.04162234   -0.00552504
C    1.73841175    1.26836487    0.13913327   -0.01175800    0.03781019   -0.01864495
C    1.78579259   -1.28147768   -0.16170123   -0.02013577   -0.06639950   -0.00912394
H    0.08716757    2.48856876    0.23954578    0.00453024   -0.01723040   -0.00806859
H    0.46160715   -2.67303024   -0.39176872    0.02502010   -0.00919404    0.00117902
H    2.40072665    2.13645069    0.36301591    0.01596363    0.01108034    0.00454081
H    2.51553897   -2.05353914   -0.27845310   -0.00335323    0.01433125    0.00037232
C    2.36639544    0.02076862    0.09710813   -0.05338633   -0.03048053   -0.02446898
H    3.51955258    0.18756310    0.48995130    0.05217341    0.02487246    0.03107633
   15
   -420.45989074
H   -2.69564753    0.56377108    0.20278466    0.00914963    0.03191026   -0.00987041
O   -2.13295013    1.17801532   -0.24850072   -0.08606216   -0.06085421    0.00910417
O   -2.05238732   -1.06908746    0.34152764   -0.06953131    0.05428073    0.02342402
C   -0.78384486    0.73615974   -0.12459050    0.02556240    0.05869288   -0.00294320
C   -0.84052294   -0.82229423   -0.05270792    0.02542056   -0.04774226   -0.02578686
C    0.35773536    1.45545702    0.18935591    0.04503263   -0.05710996    0.03390585
C    0.45176818   -1.59926796   -0.27332652    0.02897345    0.02058173   -0.01514028
C    1.74995873    1.28321791    0.15309868    0.00314318    0.05492498   -0.00899527
C    1.78758310   -1.26422353   -0.17145453    0.01099193   -0.04109450   -0.00628585
H    0.11649849    2.52238332    0.24384701    0.00353844   -0.00109406   -0.00646608
H    0.45384197   -2.69926497   -0.30429446    0.02369682   -0.00593257    0.00526803
H    2.35267320    2.18059749    0.33369283    0.00186397    0.00899213   -0.00019578
H    2.50282862   -2.04727078   -0.27019496   -0.00679873    0.01529895    0.00009915
C    2.35308791    0.00712660    0.09901479   -0.05899688   -0.06209680   -0.02663000
H    3.48088165    0.21139310    0.49717509    0.04398259    0.03124100    0.03050672
   15
   -420.46267409
H   -2.70969212    0.55303358    0.17410976    0.00890729    0.03526863   -0.01053379
O   -2.13626522    1.18061599   -0.23905028   -0.08983417   -0.06348629    0.01178851
O   -2.03747288   -1.07652766    0.33272516   -0.05000576    0.05498557    0.01480278
C   -0.78513154    0.74196264   -0.14407124    0.01566285    0.05455451   -0.01327936
C   -0.84247081   -0.82886749   -0.03695034    0.01077978   -0.04808526   -0.01070961
C    0.37486868    1.46614970    0.18498301    0.06278574   -0.06362930    0.03401643
C    0.43145957   -1.62714807   -0.27706908    0.00877226   -0.00215403   -0.02290366
C    1.76129910    1.29477559    0.16761205    0.02124456    0.06662709   -0.00012672
C    1.78874817   -1.24454216   -0.18083159    0.03464921   -0.00458103   -0.00272191
H    0.14322620    2.55715849    0.25276280    0.00346654    0.01235268   -0.00415753
H    0.42914031   -2.72117918   -0.22055327    0.02022685   -0.00345981    0.00837881
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   15
   -420.46163380
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   15
   -420.45218692
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   15
   -420.44932684
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   15
   -420.45857184
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   15
   -420.46282216
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   15
   -420.46145416
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C    2.29822348    0.03924744    0.13146159   -0.08715454    0.01317102    0.00441930
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   15
   -420.46081074
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O   -1.93634597   -1.19755522    0.27461891    0.03765077    0.01891700   -0.01385921
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   15
   -420.46431631
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O   -1.93015320   -1.22211731    0.26921343    0.01423609    0.00174966   -0.00771113
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   15
   -420.47206065
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C    2.31173503    0.07419528    0.14104452   -0.02389813    0.08096489    0.03242710
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   15
   -420.47735009
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C   -0.75122875   -0.77519104    0.03607184    0.05644099    0.02548207    0.02670058
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C    1.74308918    1.30034867    0.27622976    0.01193704   -0.00883556    0.01982279
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   15
   -420.46948838
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O   -1.91195379   -1.29337644    0.25400920   -0.03347897   -0.04170453    0.00876771
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C   -0.73808438   -0.76856342    0.03004180    0.07644318    0.02713284    0.01734100
C    0.31596441    1.65799740    0.02817295   -0.01346658    0.01801427   -0.01446659
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   15
   -420.46019487
H   -2.47708152    0.34751489   -0.28344406    0.00439243   -0.02900007   -0.01556166
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O   -1.90361552   -1.31413601    0.24845076   -0.03926586   -0.05073831    0.01223150
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C   -0.72953575   -0.76355845    0.02296438    0.09088884    0.02514766    0.00770820
C    0.29972841    1.66844067    0.01107621   -0.03561383    0.02217760   -0.01906985
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C    1.71627242    1.30556024    0.28463490   -0.02122676    0.00670994    0.01571395
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   15
   -420.46793834
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O   -1.95222324    1.24588126   -0.12913712    0.02762310    0.03366523    0.02389847
O   -1.89351401   -1.33260473    0.24234217   -0.04011843   -0.05671803    0.01439768
C   -0.71196682    0.75877624   -0.19365985    0.00091886    0.01587256   -0.03273741
C   -0.72645142   -0.76006320    0.01542037    0.09876956    0.02093847   -0.00183371
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   15
   -420.47050552
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O   -1.88161360   -1.34851040    0.23558471   -0.03526768   -0.05977708    0.01535682
C   -0.69278740    0.76653626   -0.17814514    0.02353322    0.03983469   -0.02391730
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C    0.28753147   -1.67668783   -0.12748905    0.03129244    0.02419173    0.00395389
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   15
   -420.46391933
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O   -1.86813934   -1.36171539    0.22813474   -0.02338893   -0.05969273    0.01514852
C   -0.67502580    0.77190108   -0.16118169    0.04500408    0.06093008   -0.01553378
C   -0.73804585   -0.75657302    0.00119449    0.08790417    0.01146377   -0.01854028
C    0.26933223    1.69097959   -0.03245679   -0.09135922    0.01397015   -0.03003204
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C    1.68492873    1.30984453    0.29031953   -0.01451634    0.02176961    0.01400758
C    1.49758447   -1.26749639   -0.22641759   -0.15389198   -0.06217608   -0.01074287
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   15
   -420.45855480
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O   -1.85363511   -1.37222614    0.22000232   -0.00318423   -0.05578643    0.01363858
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C   -0.75205237   -0.75600914   -0.00448309    0.06618533    0.00701705   -0.02447559
C    0.26901274    1.69612429   -0.04364820   -0.09209466   -0.00366892   -0.03245535
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C    1.67681190    1.30905873    0.29056182   -0.00116260    0.02719656    0.01715406
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H   -0.13097380    2.69538800    0.05492134   -0.00922158   -0.00722564    0.00143727
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C    2.24267588    0.03939197    0.09705785   -0.01503470    0.02280786    0.02420503
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   15
   -420.45953565
H   -2.59729936    0.62676803   -0.25465809    0.00812797    0.02896513   -0.00019929
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O   -1.83901966   -1.38022313    0.21125667    0.02581539   -0.04722423    0.01064313
C   -0.64858455    0.77091046   -0.12485142    0.06987274    0.07601941   -0.00253501
C   -0.77000610   -0.75586652   -0.00869224    0.03340368    0.00193853   -0.02806905
C    0.27420774    1.70145515   -0.05289284   -0.08183696   -0.01450889   -0.03175801
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C    1.66877070    1.30664674    0.28976847    0.01115575    0.02886448    0.01986296
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C    2.21785020    0.02656647    0.08340496   -0.03365964    0.00718911    0.01494554
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   15
   -420.46442478
H   -2.62634241    0.65659117   -0.23896809   -0.00549973    0.02177175   -0.00209568
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O   -1.82560325   -1.38609636    0.20203359    0.06204564   -0.03373486    0.00625448
C   -0.64138469    0.76366340   -0.10627218    0.06863042    0.06593280    0.00235419
C   -0.78993538   -0.75583386   -0.01121619   -0.00810792   -0.00453253   -0.02922987
C    0.28430961    1.70759181   -0.06023134   -0.06309987   -0.01142945   -0.02820209
C    0.27065145   -1.61778804   -0.05461399   -0.02257997    0.02197549    0.03667322
C    1.66008193    1.30252912    0.28779294    0.01832530    0.02277052    0.01890066
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H    2.31179464    2.00297968    0.78022721   -0.00700776   -0.01167594    0.00869863
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C    2.19502297    0.01332184    0.06885714   -0.04415512   -0.01149451    0.00389486
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   15
   -420.46445147
H   -2.65124725    0.67089371   -0.22175159   -0.02222816    0.01161645   -0.00440092
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C   -0.63829987    0.75247557   -0.08783337    0.06033516    0.04655774    0.00683656
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C    0.26625640   -1.60728840   -0.04069175   -0.04747640    0.01703809    0.04457105
C    1.65030958    1.29707279    0.28469664    0.02064145    0.00928608    0.01370588
C    1.55314731   -1.26236606   -0.19398287   -0.04107175    0.00087445    0.01315816
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C    2.17476359    0.00078082    0.05407823   -0.03353777   -0.03164170   -0.00791593
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   15
   -420.45022760
H   -2.66068061    0.67655157   -0.20145550   -0.03046647    0.00579084   -0.00530726
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O   -1.80895922   -1.39403512    0.18296243    0.13283258   -0.00109482   -0.00268010
C   -0.63884871    0.73849839   -0.06980771    0.04892276    0.02186126    0.01122953
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C    0.26469698   -1.59783299   -0.02945925   -0.06535511    0.01477726    0.05128731
C    1.63930172    1.29106468    0.28077923    0.02031630   -0.00618564    0.00702740
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H   -0.14414010    2.73744501   -0.13478288   -0.02094070    0.01317808   -0.00608711
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H    2.19027734    2.08668521    0.82457297   -0.01235745    0.01411002    0.01887143
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C    2.15633076   -0.00986597    0.03976474    0.01496415   -0.04786714   -0.01687954
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   15
   -420.42867411
H   -2.64890181    0.67769241   -0.17741972   -0.02667135    0.00573387   -0.00484699
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O   -1.80887399   -1.39754353    0.17350742    0.14925128    0.00805118   -0.00402099
C   -0.64235611    0.72320745   -0.05246115    0.03736375   -0.00457679    0.01561330
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C    0.26704539   -1.58927859   -0.02131702   -0.07434288    0.01400246    0.05571953
C    1.62707806    1.28540994    0.27642928    0.01729694   -0.01762068    0.00173874
C    1.60397145   -1.25372497   -0.18063372    0.03122814    0.04921635    0.02377232
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H    2.11241080   -2.16835555   -0.62141877   -0.01186567   -0.03132098   -0.01944405
C    2.13697784   -0.01765125    0.02643633    0.06018035   -0.05889809   -0.01989284
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   15
   -420.42722689
H   -2.61855363    0.67439134   -0.14993430   -0.01240826    0.01080635   -0.00371589
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O   -1.81547754   -1.40137923    0.16422377    0.14403414    0.00686080   -0.00232615
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C    0.34834294    1.72659272   -0.07556845    0.03118831    0.08116694   -0.00979088
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C    1.61383364    1.28078062    0.27196288    0.00922170   -0.02110744   -0.00135430
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H    2.10570922    2.13348436    0.81714145   -0.02176035    0.02606079    0.01977363
H    2.11500174   -2.14883691   -0.62512581   -0.01808517   -0.02227708   -0.01639861
C    2.11454040   -0.02181875    0.01434545    0.00734752   -0.07893154   -0.02910901
H    3.08316970    0.14156035    0.15289785   -0.09495928    0.00915856   -0.00676451
   15
   -420.43446517
H   -2.57949056    0.66320201   -0.11975960    0.00526806    0.01736712   -0.00277658
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O   -1.82854137   -1.40548844    0.15503800    0.11909544   -0.00419972    0.00135616
C   -0.65553099    0.69498277   -0.02085950    0.01742260   -0.05313179    0.02403292
C   -0.83779336   -0.74632188    0.00219593   -0.09574341    0.01225753   -0.03324954
C    0.36312106    1.72293223   -0.07729510    0.05634657    0.09120175   -0.00547656
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C    1.60006702    1.27738046    0.26756978   -0.00575809   -0.01530301   -0.00272825
C    1.64771643   -1.25606696   -0.17269467    0.07979632    0.05063382    0.01761221
H   -0.01412844    2.69842842   -0.24204202    0.00025687   -0.02062823   -0.00582853
H    0.06595122   -2.54802189   -0.46338730    0.00635019    0.00464755   -0.01950692
H    2.08507193    2.13034517    0.79186516   -0.02758118    0.02198291    0.01512371
H    2.13075719   -2.11380470   -0.61729971   -0.02654804   -0.00466469   -0.00889975
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H    3.14411774    0.15514735    0.19685022   -0.01610853    0.01889550    0.00668338
   15
   -420.43635121
H   -2.54371490    0.63993218   -0.08756943    0.01477343    0.01705461   -0.00202006
O   -1.83375899    1.28601123   -0.11474137    0.02819642   -0.02612986    0.00261296
O   -1.84696422   -1.40938739    0.14579078    0.08222614   -0.02047915    0.00503294
C   -0.66399113    0.68496730   -0.00711176    0.00884898   -0.07152116    0.02767848
C   -0.82931066   -0.74383939    0.01040338   -0.06510736    0.03159449   -0.03484105
C    0.37447497    1.71385916   -0.07869964    0.08437657    0.08124605    0.00051901
C    0.30038932   -1.56872003   -0.01714405   -0.05362412    0.01634206    0.05058465
C    1.58667545    1.27487062    0.26333693   -0.02599192   -0.00266317   -0.00318372
C    1.66303477   -1.26194405   -0.17046828    0.08820137    0.02742137    0.00915415
H    0.03564935    2.70539642   -0.26874809    0.00231285   -0.01489211   -0.00682560
H    0.05761191   -2.54281696   -0.44006160    0.00461871    0.00711038   -0.01737568
H    2.08425931    2.11171515    0.75580554   -0.03271111    0.01234058    0.00873380
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   15
   -420.44009804
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   15
   -420.44911653
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   15
   -420.46038503
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   15
   -420.46923405
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   15
   -420.46897770
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   15
   -420.45827877
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   15
   -420.45792347
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   15
   -420.46704386
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   15
   -420.46893136
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   15
   -420.47012865
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O   -2.00750984   -1.32912370    0.04826255   -0.08792375   -0.03313311   -0.02119937
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   15
   -420.47675505
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   15
   -420.48494822
H   -2.73893162    0.71008309    0.04293426   -0.02726856   -0.00980843    0.00699948
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O   -1.99733672   -1.28665250    0.03486540   -0.03983315   -0.00246911   -0.02212866
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C    1.77251638   -1.24115943   -0.19592346    0.02828283    0.02875910   -0.03265581
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H    2.58442409   -1.99685730   -0.09740749    0.01855270   -0.00103385    0.01400465
C    2.28704778    0.03655587    0.07032868   -0.07192779   -0.00801269   -0.00283602
H    3.51531826    0.00911635    0.15929359    0.06233515   -0.00690418    0.00351297
   15
   -420.48860719
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   15
   -420.48053167
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   15
   -420.45804040
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O   -1.97460168   -1.22493697    0.02164594    0.10070753    0.06446980   -0.00802354
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C   -0.86975232   -0.85593821    0.15969589   -0.10127191   -0.05663006    0.04546152
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   15
   -420.44237816
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O   -1.97309927   -1.20881628    0.01831962    0.13529309    0.08063104   -0.00333899
C   -0.88026615    0.71215105    0.04469314   -0.07767456   -0.00344874   -0.00055538
C   -0.87987502   -0.85354766    0.15193189   -0.13001337   -0.06017227    0.03930881
C    0.30899420    1.54418722   -0.05556378    0.04483362    0.04550209   -0.01691725
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H    2.43846226   -2.12571021   -0.04387116    0.00156998   -0.02083275    0.01623882
C    2.44159353   -0.00435167    0.10725050    0.13565850   -0.06596002    0.01412996
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   15
   -420.44339740
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O   -1.97762270   -1.19631234    0.01515727    0.14041936    0.08587180   -0.00185827
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C   -0.88227912   -0.84756901    0.14177797   -0.13049844   -0.05372050    0.03555631
C    0.31799406    1.54401694   -0.04580495    0.05341518    0.06597445   -0.01528884
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   15
   -420.44218615
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O   -1.98839730   -1.18766138    0.01209054    0.11425590    0.07978313   -0.00329471
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C   -0.87694120   -0.83839286    0.12946253   -0.10162773   -0.03720341    0.03393375
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   15
   -420.44088846
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O   -2.00428317   -1.18260258    0.00917638    0.06879243    0.06630351   -0.00557213
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C    0.32599162    1.53160008   -0.02378745    0.06285334    0.06086196   -0.00504766
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C    1.78881924   -1.22529034   -0.14010517    0.04344698   -0.00920779   -0.02978538
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C    2.50771277    0.00670977    0.12692654    0.01543928   -0.06785945    0.02669124
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   15
   -420.44743509
H   -2.90811443    0.70808892   -0.12749865   -0.03288463   -0.00865790   -0.00498824
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O   -2.02327767   -1.18054395    0.00651070    0.01961033    0.05052673   -0.00675949
C   -0.89363621    0.65984146    0.05000897   -0.06759409   -0.06731486    0.00624015
C   -0.85078638   -0.81468233    0.09878218   -0.00796224    0.00671153    0.02880373
C    0.32443321    1.51963815   -0.01214099    0.06099967    0.03995899    0.00220247
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C    1.76008497    1.26394679    0.05011369    0.02816068    0.04924703   -0.01007247
C    1.78108625   -1.23186521   -0.12368571    0.01414267    0.00018797   -0.02627586
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   15
   -420.45832328
H   -2.88590483    0.68410854   -0.14179644   -0.02446772   -0.00438462   -0.00526485
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O   -2.04318717   -1.18078285    0.00414494   -0.02319780    0.03594278   -0.00616386
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C    2.54243433    0.03441729    0.13250935    0.02940424   -0.03236047    0.03211924
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   15
   -420.46680943
H   -2.84659959    0.66281313   -0.15241047   -0.00757367    0.00758027   -0.00379636
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O   -2.06208145   -1.18266259    0.00205331   -0.05622172    0.02397114   -0.00407101
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C   -0.82208649   -0.79222114    0.06132922    0.06030051    0.03382347    0.01477409
C    0.31101602    1.48984486    0.01037453    0.03116316   -0.00252556    0.01357606
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C    1.76340243    1.25059831    0.00600978   -0.00139894    0.01991050   -0.02910006
C    1.76522416   -1.24595232   -0.08656397   -0.05080424    0.01953740   -0.01014320
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C    2.55741468    0.05178137    0.13246090    0.05662777   -0.00976637    0.03243524
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   15
   -420.46738821
H   -2.80182661    0.63596557   -0.16034362    0.00878952    0.02061377   -0.00153675
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O   -2.07846038   -1.18564075    0.00014288   -0.07977359    0.01480951   -0.00103737
C   -0.86089777    0.65829865    0.05054787   -0.01859531   -0.06828206    0.00839242
C   -0.81226148   -0.78369929    0.04103117    0.07850467    0.03649074    0.00547752
C    0.30095472    1.47454818    0.02056157    0.00452028   -0.01694852    0.01652166
C    0.45059463   -1.66613402   -0.05673100    0.03009562   -0.02934467    0.00746198
C    1.76468817    1.24156273   -0.01370015   -0.01549963    0.00542368   -0.03725345
C    1.76094075   -1.25455215   -0.06681413   -0.06977202    0.01240586   -0.00180147
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C    2.56884765    0.06973314    0.13046172    0.10761689    0.01320300    0.03061857
H    3.64592598    0.08291600    0.10489983   -0.00283516    0.00223315   -0.00199057
   15
   -420.45962939
H   -2.76260628    0.59501823   -0.16704523    0.01278209    0.02171013   -0.00127536
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O   -2.09124988   -1.18930069   -0.00172238   -0.09526182    0.00819537    0.00250100
C   -0.84622896    0.66636907    0.04974768    0.00621857   -0.05367860    0.00862826
C   -0.80714011   -0.77735034    0.02040510    0.08783539    0.03237988   -0.00448680
C    0.29064506    1.46024507    0.02975907   -0.02698789   -0.02511883    0.01758736
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C    1.76687980    1.23216568   -0.03117219   -0.02327135   -0.00260150   -0.04240146
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H    0.25226089   -2.69739153   -0.36203309    0.00110090   -0.01860601   -0.01228355
H    2.33233948    2.21616552    0.11860238    0.01570353    0.02442685    0.01314275
H    2.46966667   -2.16170032   -0.31555268    0.02350556   -0.03313668   -0.01497772
C    2.57369877    0.08691045    0.12661887    0.16910783    0.03182118    0.02724480
H    3.57806676    0.02709578    0.11171600   -0.06697119   -0.00122029   -0.00106004
   15
   -420.45559513
H   -2.73182186    0.53941309   -0.17262293    0.00451661    0.00742675   -0.00422930
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O   -2.09974267   -1.19334020   -0.00370174   -0.10391279    0.00368185    0.00622065
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C   -0.80729361   -0.77293227    0.00005180    0.08965656    0.02281171   -0.01471314
C    0.28197324    1.44742911    0.03790019   -0.05954110   -0.02708440    0.01717948
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C    1.76515601   -1.27297751   -0.02734549   -0.06418362   -0.02471677    0.00788857
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   15
   -420.45538866
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O   -2.16764144    1.31597882   -0.01191255   -0.06763304    0.04017007    0.00087102
O   -2.10354313   -1.19755301   -0.00596302   -0.10653531    0.00084134    0.00983839
C   -0.81978803    0.69089641    0.04654589    0.06373862   -0.00846417    0.01011412
C   -0.81283713   -0.76987594   -0.01941250    0.08498265    0.00971887   -0.02475014
C    0.27688286    1.43623633    0.04500524   -0.08821352   -0.02636638    0.01617475
C    0.44969771   -1.59304528   -0.02495811    0.04641805   -0.00171975    0.02827447
C    1.77520279    1.21404361   -0.05840992   -0.00728875   -0.00940414   -0.04071238
C    1.77328992   -1.28055920   -0.00819518   -0.03477930   -0.05390322    0.00582952
H    0.29786792    2.49316769   -0.03333356    0.02949737   -0.02231753   -0.00376830
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H    2.47096631   -2.04286535   -0.34554279    0.00256539    0.00920709   -0.00861066
C    2.55354992    0.11423223    0.11425581    0.10125821    0.08472175    0.01645113
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   15
   -420.44616443
H   -2.67359604    0.42504186   -0.17187489   -0.00809145   -0.02202763   -0.01046438
O   -2.16125018    1.30342190   -0.00470040   -0.06052032    0.04713397    0.00357578
O   -2.10253090   -1.20180946   -0.00866901   -0.10345646   -0.00054885    0.01300350
C   -0.81144695    0.70465954    0.04405388    0.08696053    0.01407607    0.01147430
C   -0.82349124   -0.76740189   -0.03738419    0.07445172   -0.00447268   -0.03392019
C    0.27708341    1.42666639    0.05113015   -0.10796733   -0.03119314    0.01548359
C    0.44390237   -1.56800106   -0.01733385    0.03869330   -0.00016758    0.03051695
C    1.78036700    1.20574684   -0.06827317    0.01632318   -0.01165634   -0.03483341
C    1.78347222   -1.28487460    0.01062552    0.00471461   -0.08345016   -0.00030115
H    0.30568331    2.47127191    0.00673167    0.02916266   -0.03448930   -0.00350086
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H    2.46387783   -1.98449552   -0.34952909   -0.01856383    0.03755357    0.00182452
C    2.53233785    0.12116040    0.10640074    0.02805155    0.12152127    0.00696561
H    3.63703065   -0.12177723    0.13715778    0.02361826   -0.02818935    0.00112426
   15
   -420.43821881
H   -2.63753282    0.38678288   -0.16123777   -0.00459522   -0.02509790   -0.01073375
O   -2.15209780    1.28876265    0.00235690   -0.05737604    0.04446538    0.00432180
O   -2.09684719   -1.20604712   -0.01196169   -0.09433255   -0.00026531    0.01533067
C   -0.80829907    0.71760417    0.04086829    0.09697734    0.03013920    0.01275368
C   -0.83861875   -0.76466409   -0.05331342    0.05808580   -0.01743569   -0.04128416
C    0.28374195    1.41904009    0.05631863   -0.11329492   -0.04665520    0.01473702
C    0.43578209   -1.54294967   -0.01154837    0.02791485    0.00190257    0.03139132
C    1.78453701    1.19816280   -0.07603179    0.04099468   -0.01567008   -0.02858940
C    1.79343097   -1.28423932    0.02943593    0.03226770   -0.09422435   -0.00072962
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H    0.04784489   -2.44341080   -0.46803335   -0.01774044    0.02535046   -0.00938023
H    2.42119462    2.03615133    0.01514771    0.00155999   -0.03598999    0.00840523
H    2.46934953   -1.95214757   -0.35449283   -0.02644660    0.04920113    0.00658301
C    2.50928820    0.12079936    0.09812518   -0.01838653    0.14670804   -0.00272120
H    3.67266873   -0.14346264    0.14550309    0.04855060   -0.03479422    0.00353430
   15
   -420.44505276
H   -2.59848093    0.36612443   -0.14298801    0.00427153   -0.02018509   -0.00908194
O   -2.14033631    1.27212141    0.00922444   -0.05576849    0.03225216    0.00336295
O   -2.08690925   -1.21028118   -0.01594574   -0.07825394    0.00227327    0.01654465
C   -0.81092197    0.72877124    0.03691506    0.08839585    0.03736999    0.01330678
C   -0.85722731   -0.76088519   -0.06675977    0.03531406   -0.02777453   -0.04586719
C    0.29715338    1.41425331    0.06062249   -0.09909097   -0.06546697    0.01273060
C    0.42596970   -1.51802905   -0.00766256    0.01773878    0.00699555    0.03239596
C    1.78628929    1.19155980   -0.08205016    0.05367327   -0.02601100   -0.02441477
C    1.80157086   -1.27805511    0.04821849    0.03519582   -0.07669197    0.01212591
H    0.26131559    2.49385718    0.09447199    0.01897922   -0.00731001   -0.00231099
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H    2.42530727    2.02278015   -0.02969822   -0.00180930   -0.03910916    0.00721264
H    2.49234794   -1.95361816   -0.36332164   -0.01064423    0.03538479   -0.00227117
C    2.48724183    0.11166144    0.09000372   -0.04275467    0.15281134   -0.01034704
H    3.67442271   -0.14048690    0.15132640    0.05497002   -0.03473549    0.00556834
   15
   -420.46208695
H   -2.56269920    0.35957969   -0.11827312    0.01633066   -0.00831153   -0.00620621
O   -2.12604864    1.25405063    0.01594373   -0.05296782    0.01108231    0.00124872
O   -2.07345127   -1.21462887   -0.02067555   -0.05407434    0.00760696    0.01648851
C   -0.81879808    0.73771356    0.03216317    0.06154287    0.03768258    0.01266868
C   -0.87793506   -0.75544166   -0.07744943    0.00525806   -0.03512816   -0.04702000
C    0.31646023    1.41338408    0.06416359   -0.06575904   -0.07642128    0.00934544
C    0.41507359   -1.49354957   -0.00573966    0.00966375    0.01559713    0.03405420
C    1.78489022    1.18655603   -0.08658286    0.04817770   -0.04102627   -0.02197535
C    1.80762696   -1.26730020    0.06624378    0.02888221   -0.04533507    0.02982256
H    0.21648674    2.51997618    0.14114609    0.00897933    0.01301934    0.00087391
H    0.01158166   -2.38598054   -0.47346922   -0.02254531    0.02781884   -0.01095427
H    2.43010937    2.03648737   -0.07972189    0.00450986   -0.02477685    0.00571272
H    2.52256951   -1.98000094   -0.37019071    0.01289187    0.01172287   -0.01666389
C    2.46768955    0.09339838    0.08248930   -0.04837190    0.13570028   -0.01427158
H    3.63739114   -0.11281937    0.15317910    0.04741050   -0.02923889    0.00689080
   15
   -420.47703047
H   -2.53863518    0.35884960   -0.08908122    0.02751272    0.00606345   -0.00346137
O   -2.10937679    1.23549700    0.02260686   -0.04492573   -0.01505595   -0.00098210
O   -2.05757095   -1.21933277   -0.02614910   -0.02172277    0.01582866    0.01526419
C   -0.83033563    0.74438651    0.02665104    0.02265092    0.03605480    0.01085824
C   -0.89892382   -0.74788685   -0.08531292   -0.03207071   -0.03981919   -0.04469360
C    0.33968679    1.41707892    0.06714148   -0.02106310   -0.07614517    0.00551360
C    0.40358391   -1.47002320   -0.00587525    0.00341602    0.02610193    0.03548483
C    1.78063427    1.18400516   -0.08978712    0.03144220   -0.05068842   -0.01951418
C    1.81190174   -1.25380166    0.08249339    0.02866907   -0.01366780    0.04241007
H    0.16527616    2.53724017    0.18713884   -0.00237771    0.02494756    0.00492453
H    0.01690072   -2.38760805   -0.46491806   -0.02343306    0.01980559   -0.01436813
H    2.43149312    2.06759923   -0.13372820    0.01375175   -0.00304520    0.00214298
H    2.54401542   -2.01517079   -0.36533759    0.02865225   -0.00682017   -0.02688193
C    2.45095102    0.06704708    0.07581412   -0.03154619    0.09520563   -0.01347786
H    3.56732525   -0.06440063    0.15015324    0.02105899   -0.01880573    0.00680115
   15
   -420.48082565
H   -2.53393832    0.35420252   -0.05730072    0.03130008    0.01305494   -0.00222734
O   -2.09070809    1.21760794    0.02931019   -0.02591194   -0.03638555   -0.00216178
O   -2.04072578   -1.22476194   -0.03231183    0.01594851    0.02583170    0.01314711
C   -0.84322536    0.74886524    0.02048622   -0.01990014    0.03697545    0.00824115
C   -0.91794955   -0.73793761   -0.09048792   -0.07386245   -0.04167412   -0.03948254
C    0.36418250    1.42533604    0.06978388    0.02472235   -0.06728296    0.00207884
C    0.39188211   -1.44807243   -0.00814832   -0.00171498    0.03602886    0.03523852
C    1.77447905    1.18445965   -0.09181482    0.01401023   -0.04879946   -0.01636800
C    1.81440162   -1.23946760    0.09621453    0.03656797    0.01629609    0.04780709
H    0.11571817    2.53715846    0.22960448   -0.01278581    0.02654033    0.00864916
H    0.03893318   -2.40334648   -0.44604063   -0.02164560    0.00919886   -0.01743684
H    2.42324717    2.10114635   -0.18917796    0.01871290    0.01497308   -0.00306569
H    2.54543902   -2.04594670   -0.34149399    0.03425799   -0.01676544   -0.03098533
C    2.43599224    0.03501966    0.06993040    0.00917517    0.03878827   -0.00805681
H    3.48360161   -0.00255643    0.14236625   -0.02884543   -0.00676123    0.00458962
   15
   -420.47447966
H   -2.55105104    0.34099615   -0.02384740    0.02329798    0.00681978   -0.00208029
O   -2.07091724    1.20132424    0.03610874    0.00681555   -0.04636041   -0.00269126
O   -2.02459776   -1.23135958   -0.03906965    0.05174933    0.03474744    0.01066715
C   -0.85492702    0.75108841    0.01382498   -0.05947642    0.04154936    0.00521244
C   -0.93252213   -0.72549084   -0.09328420   -0.11268451   -0.03885451   -0.03245326
C    0.38721794    1.43763285    0.07229561    0.06368157   -0.05239137   -0.00036253
C    0.38028142   -1.42828734   -0.01253946   -0.00629320    0.04339625    0.03239375
C    1.76744677    1.18781826   -0.09285533    0.00228629   -0.03745266   -0.01270984
C    1.81465766   -1.22611669    0.10707596    0.05107606    0.04559513    0.04682440
H    0.07518452    2.51854633    0.26591846   -0.02013641    0.01835752    0.01106135
H    0.07635366   -2.42574076   -0.41472710   -0.01657757   -0.00095398   -0.01864417
H    2.40191767    2.12442875   -0.24241727    0.01720238    0.02449838   -0.00831313
H    2.52267710   -2.06513746   -0.29563731    0.03161480   -0.01839196   -0.02998854
C    2.42050932    0.00065906    0.06452483    0.04122907   -0.02102666   -0.00095272
H    3.42051415    0.06449685    0.13130591   -0.07379626    0.00043122    0.00204430
   15
   -420.46829105
H   -2.58443427    0.32324068    0.01105634    0.00695731   -0.00542250   -0.00119008
O   -2.05146395    1.18712143    0.04303346    0.04676831   -0.05021527   -0.00424262
O   -2.01077338   -1.23951368   -0.04631195    0.07580103    0.03831487    0.00835704
C   -0.86306831    0.75079437    0.00684923   -0.09173835    0.04686539    0.00203053
C   -0.94034875   -0.71073540   -0.09412059   -0.13778532   -0.02782378   -0.02480953
C    0.40646025    1.45307002    0.07482122    0.09111751   -0.03184839   -0.00118190
C    0.36906069   -1.41110969   -0.01887600   -0.01076232    0.04744235    0.02681465
C    1.76023958    1.19341365   -0.09312686   -0.00226688   -0.02023652   -0.00914296
C    1.81179044   -1.21550871    0.11513539    0.07231042    0.07155811    0.03991165
H    0.04886132    2.48723191    0.29439954   -0.02265607    0.00155658    0.01127564
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H    2.36855521    2.13063341   -0.28976194    0.00973563    0.02457948   -0.01201401
H    2.47759008   -2.07162786   -0.22844304    0.02148892   -0.01082846   -0.02466027
C    2.40287521   -0.03241301    0.05919094    0.01083744   -0.08428063    0.00379624
H    3.40681276    0.13118447    0.11856839   -0.06133385    0.00875709    0.00247509
   15
   -420.45935124
H   -2.62280136    0.30916463    0.04672565   -0.01006184   -0.01434113    0.00116363
O   -2.03411318    1.17520163    0.05015651    0.08160180   -0.05456461   -0.00723605
O   -2.00031521   -1.24937315   -0.05393524    0.08075978    0.03321561    0.00650008
C   -0.86571628    0.74768973   -0.00024886   -0.11297243    0.04740786   -0.00126815
C   -0.93995376   -0.69435359   -0.09345583   -0.14092794   -0.00575516   -0.01729045
C    0.42025844    1.47040741    0.07740718    0.10540992   -0.00637243    0.00017304
C    0.35849320   -1.39678566   -0.02682302   -0.01573620    0.04846884    0.01900086
C    1.75314180    1.20020873   -0.09283958   -0.00126368    0.00177280   -0.00675172
C    1.80452635   -1.20916464    0.12080475    0.09775136    0.08473488    0.02852443
H    0.03851302    2.45514494    0.31491635   -0.01960272   -0.02081800    0.00896693
H    0.18069396   -2.46371108   -0.31313613    0.00171824   -0.01181118   -0.01398712
H    2.32847624    2.11970356   -0.32862837   -0.00261405    0.01527024   -0.01284911
H    2.41746258   -2.07095776   -0.14367577    0.00435853    0.00706926   -0.01636668
C    2.38476576   -0.06037278    0.05363121   -0.05455692   -0.14883047    0.00773823
H    3.43513724    0.19104706    0.10400125   -0.01383201    0.02454602    0.00372000
   15
   -420.44638573
H   -2.65418841    0.30507762    0.08151679   -0.02268304   -0.01780655    0.00420077
O   -2.02040732    1.16575677    0.05760932    0.10131073   -0.05865617   -0.01053690
O   -1.99344968   -1.26070773   -0.06185433    0.06693125    0.01975953    0.00488740
C   -0.86160426    0.74176905   -0.00726838   -0.11975608    0.03787028   -0.00495749
C   -0.93114826   -0.67767308   -0.09174435   -0.12191440    0.02597884   -0.00995733
C    0.42773472    1.48813386    0.07997565    0.10926584    0.01797892    0.00282298
C    0.34888356   -1.38538395   -0.03591258   -0.02191129    0.04780217    0.00987241
C    1.74610353    1.20688109   -0.09213378    0.00305350    0.02651246   -0.00626440
C    1.79138440   -1.20783792    0.12474548    0.11587882    0.07761375    0.01792067
H    0.04207060    2.43790291    0.32905050   -0.01322111   -0.04040930    0.00556690
H    0.23457684   -2.47154462   -0.24614246    0.01274506   -0.01118325   -0.00917636
H    2.29044207    2.09821834   -0.35844493   -0.01750037   -0.00108998   -0.01040309
H    2.35430239   -2.07566665   -0.04704651   -0.01403060    0.02884057   -0.00938498
C    2.36983594   -0.07944794    0.04759975   -0.09896999   -0.19078482    0.01219008
H    3.47435440    0.23343426    0.08686978    0.02084804    0.03756154    0.00324408
   15
   -420.44317873
H   -2.66962597    0.31358457    0.11330758   -0.02881264   -0.01734285    0.00686568
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O   -1.98957692   -1.27292195   -0.06999462    0.04133513    0.00186034    0.00316482
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   15
   -420.45663595
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O   -1.98756744   -1.28522192   -0.07827755    0.01228837   -0.01573966    0.00121097
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C    1.73131477    1.21438324   -0.08960025    0.00273846    0.04854886   -0.00296169
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   15
   -420.47480870
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C   -0.86944901   -0.64519896   -0.08480876   -0.00583561    0.10898100    0.01245229
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C    1.72362107    1.21394780   -0.08799653   -0.00885538    0.03336872    0.00424951
C    1.71411857   -1.22814465    0.13097339    0.02319675    0.03479369    0.00381287
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H    2.23023435   -2.20254781    0.27810769   -0.00011486   -0.01873100    0.00245654
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   15
   -420.48235749
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O   -1.98404708   -1.30706858   -0.09491477   -0.03595372   -0.04043771   -0.00281173
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C   -0.84486010   -0.64574323   -0.08340007    0.03178316    0.10999273    0.01909546
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C    0.32790238   -1.36996666   -0.07273890   -0.04012811    0.07334079   -0.02289246
C    1.71647277    1.21152954   -0.08665027   -0.02246313    0.01094134    0.01159497
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H    3.43294717    0.12606983    0.00534329   -0.00896531    0.01792439   -0.00022624
   15
   -420.47738864
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O   -1.98036147   -1.31549510   -0.10308754   -0.05128856   -0.04729740   -0.00461588
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C    0.37102625    1.56034131    0.09085811    0.03857341   -0.01456514    0.00186848
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C    1.71066188    1.20843745   -0.08598801   -0.03203212   -0.00948093    0.01563060
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   15
   -420.47332138
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C    0.34662505    1.57479434    0.09285712   -0.00291376   -0.01582160    0.00606844
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C    1.70675150    1.20589465   -0.08625152   -0.03430734   -0.02516271    0.01576737
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H    2.12197679   -2.24164657    0.57559651    0.00698149   -0.04306546    0.02703875
C    2.37706149   -0.00125054   -0.00352192    0.08104656    0.03048758   -0.00531208
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   15
   -420.47186804
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O   -1.96566736   -1.32576213   -0.11873548   -0.06309458   -0.05265711   -0.00746652
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C   -0.78941604   -0.68245363   -0.08736522    0.09709844    0.03524617    0.03290013
C    0.32240631    1.59016979    0.09448493   -0.04559224   -0.01005538    0.01111463
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C    1.70487332    1.20484629   -0.08745249   -0.02816851   -0.03530950    0.01265576
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H    2.39528442    2.05806334   -0.35786500    0.01637731    0.01114344   -0.01407410
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C    2.37533191    0.02110791   -0.01271763    0.04924813    0.06481542   -0.00723151
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   15
   -420.46189547
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O   -2.00714168    1.18839220    0.13190893   -0.01482872    0.00971928   -0.00029471
O   -1.95412531   -1.32735777   -0.12608263   -0.05900054   -0.05161137   -0.00817245
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C   -0.78141336   -0.70141698   -0.09234506    0.09676511    0.00476785    0.03554915
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C    0.33579356   -1.42796648   -0.08968865    0.03687421    0.11361655   -0.02991256
C    1.70466250    1.20589648   -0.08940640   -0.01490239   -0.03808345    0.00709957
C    1.58907178   -1.28511930    0.14549226   -0.11567872   -0.07109634   -0.02164671
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H    2.02900030   -2.12463253    0.69086783   -0.01528206   -0.00296137    0.01494241
C    2.37063925    0.03955123   -0.02148689    0.01223396    0.09766189   -0.00698306
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   15
   -420.44591466
H   -2.55264708    0.30640223    0.20267161   -0.01807925   -0.03236087    0.00816939
O   -2.00455530    1.19929002    0.14172083   -0.01006585    0.02832517    0.00054432
O   -1.93993540   -1.32662245   -0.13306207   -0.04709710   -0.04767198   -0.00806000
C   -0.67585147    0.73789761   -0.02741590    0.13571731    0.00054835   -0.02144848
C   -0.77920107   -0.72069695   -0.09946831    0.08408493   -0.02020866    0.03688521
C    0.28436144    1.62175630    0.09541884   -0.10809314    0.02396831    0.02020939
C    0.33573561   -1.45887724   -0.08941337    0.05027253    0.10357648   -0.02858298
C    1.70533598    1.20920897   -0.09178465    0.00153901   -0.03299729    0.00060445
C    1.58177255   -1.28910611    0.15223446   -0.09802246   -0.09601055   -0.00570083
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C    2.36511132    0.05214326   -0.02983742   -0.00687788    0.11978851   -0.00594161
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   15
   -420.43955703
H   -2.53117548    0.30601531    0.19330495   -0.01369291   -0.03395764    0.00652430
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C   -0.67317781    0.74848919   -0.02265183    0.13779887    0.01510524   -0.01865478
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C    0.33270825   -1.49600228   -0.08740800    0.04965381    0.08359366   -0.02748220
C    1.70593821    1.21450327   -0.09420620    0.01350450   -0.02531833   -0.00458564
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H    0.26522991    2.67037903    0.14467732    0.02386566   -0.03703567   -0.00590485
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H    2.40737093    1.99465544   -0.21804071   -0.00784439   -0.03044162    0.00224578
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C    2.35991637    0.05757052   -0.03783029   -0.00926650    0.12607716   -0.00455439
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   15
   -420.45189973
H   -2.50033951    0.32935714    0.17929143   -0.00091371   -0.02327084    0.00403735
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O   -1.90619698   -1.31905061   -0.14598223    0.00437838   -0.02829461   -0.00510624
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C   -0.78838269   -0.75455710   -0.12034847    0.02491983   -0.05206963    0.03362231
C    0.27133661    1.64822060    0.09163327   -0.11607644    0.02740820    0.02240816
C    0.32674750   -1.53813903   -0.08373930    0.03523782    0.05488411   -0.02660016
C    1.70578776    1.22135759   -0.09636242    0.01318065   -0.02293538   -0.00750495
C    1.58340218   -1.27974860    0.16619325   -0.05262643   -0.07339013   -0.00194298
H    0.23872971    2.69720062    0.11263287    0.02113349   -0.02439920   -0.00595169
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H    1.99925039   -1.97924326    0.82137124   -0.03358684    0.02849873   -0.00537308
C    2.35521118    0.05545933   -0.04554683    0.00284442    0.11511290   -0.00338432
H    3.47251676   -0.28548318   -0.15239496    0.03678594   -0.03813437   -0.00500004
   15
   -420.46882210
H   -2.46929427    0.36860608    0.16234036    0.01914942    0.00106980    0.00206574
O   -1.99364699    1.22411693    0.17069658   -0.02541852    0.00435078    0.00466521
O   -1.88898229   -1.31309413   -0.15205527    0.04327910   -0.01270296   -0.00271503
C   -0.69174945    0.76675109   -0.00992349    0.09480247    0.01744071   -0.01229788
C   -0.79622196   -0.76719861   -0.13390401   -0.01674586   -0.06108811    0.02822023
C    0.27534560    1.65882831    0.08772295   -0.09783205    0.01164109    0.02300701
C    0.31870606   -1.58356146   -0.07846417    0.01091696    0.01955596   -0.02523743
C    1.70489753    1.22963064   -0.09806916    0.00184873   -0.02641210   -0.00950782
C    1.58963490   -1.26774460    0.17321110   -0.03472187   -0.03086356   -0.01946149
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H   -0.26484437   -2.42933186    0.30243253   -0.03558876    0.02701246    0.00342972
H    2.42427351    2.03319100   -0.12456654    0.00125079   -0.01502050    0.00512776
H    2.03972556   -1.97569226    0.87562737   -0.01758840    0.00495533    0.01692202
C    2.35024699    0.04647108   -0.05305075    0.03243745    0.08732336   -0.00383188
H    3.41346433   -0.26282114   -0.16898089    0.00924167   -0.02980563   -0.00416324
   15
   -420.47356054
H   -2.45201930    0.40686320    0.14377807    0.03836730    0.02767819    0.00198001
O   -1.98821200    1.23094521    0.18000131   -0.03237953   -0.02127321    0.00318523
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C   -0.71041914    0.77425298   -0.00234638    0.05473403    0.01057584   -0.00820993
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   15
   -420.47165398
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   15
   -420.47672814
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   15
   -420.47939053
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   15
   -420.46953759
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   15
   -420.45263214
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   15
   -420.44200984
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   15
   -420.44572933
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   15
   -420.45305242
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   15
   -420.45081670
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   15
   -420.44780209
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   15
   -420.45547761
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C    1.69274929    1.33694854   -0.07917601   -0.01800660    0.01130663    0.01416593
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C    2.14106200    0.02572781   -0.12443373    0.03308701   -0.00054711   -0.04316843
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   15
   -420.45990797
H   -2.69243348    0.62590845    0.01576956   -0.02954037   -0.01201855   -0.00929291
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   15
   -420.45137998
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   15
   -420.43655082
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   15
   -420.42906672
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   15
   -420.43577628
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   15
   -420.44730545
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   15
   -420.45385215
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   15
   -420.45786612
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C   -0.80601069   -0.90939387   -0.11784014   -0.11073593   -0.08309678   -0.02359558
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C    2.10919599    0.05063327   -0.02475062    0.01416274    0.03508390   -0.02218067
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   15
   -420.47112947
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   15
   -420.48282000
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C   -0.79785312   -0.90187276   -0.06165772   -0.05079198   -0.07698030    0.00930373
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   15
   -420.48172576
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   15
   -420.47004394
H   -2.58106205    0.58621466    0.14246427   -0.00204463   -0.00529682   -0.00377670
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O   -1.95383409   -1.15740683   -0.43548326   -0.01476385    0.02526850   -0.02501804
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H    2.45451138   -2.05928885    0.28260924   -0.03378088    0.03451680   -0.00123785
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   15
   -420.45969940
H   -2.56314208    0.61655318    0.17395865    0.02163580    0.01876645    0.00172080
O   -1.87670684    1.27782170    0.30760495    0.00755419    0.00335673    0.01086119
O   -1.96128310   -1.16160275   -0.45148023   -0.03310007    0.01450941   -0.03502833
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   15
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   15
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   15
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   15
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   15
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   15
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   15
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   15
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   15
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   15
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   15
   -420.53494349
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   15
   -420.53128060
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   15
   -420.52746385
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O   -1.92262404   -1.28304724    0.07018067    0.01648840    0.00415600    0.00299512
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C    1.63481927    1.21112029   -0.04916873   -0.00542938   -0.04609080   -0.02727941
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   15
   -420.52486078
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O   -1.91691955   -1.28637030    0.08388854    0.01766688    0.00401997    0.00329312
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C   -0.78331200   -0.78663105   -0.02538906    0.03012648   -0.02990565   -0.00440327
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C    0.35157902   -1.56692842   -0.07530369   -0.05463811    0.03218790   -0.00237538
C    1.62572867    1.20848007   -0.05513164   -0.00559236   -0.02999155   -0.03019543
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   15
   -420.52664009
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O   -1.91201598   -1.28987324    0.09744684    0.01862988    0.00324558    0.00363615
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C   -0.78514849   -0.78333000   -0.02890654    0.02063310   -0.02500326   -0.00449960
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C    1.61700731    1.20767943   -0.05926918   -0.01177939   -0.01877650   -0.03290205
C    1.69492014   -1.26468051   -0.01068304   -0.02152887   -0.02926662   -0.00268941
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   15
   -420.53096445
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O   -1.90795547   -1.29352097    0.11083972    0.01898245    0.00181364    0.00409450
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C   -0.78822163   -0.77852618   -0.03215313    0.00890634   -0.01821226   -0.00435354
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   15
   -420.53227693
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   15
   -420.52959482
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O   -1.90236383   -1.30096046    0.13703781    0.01558538   -0.00294433    0.00552610
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C    1.59834168    1.21187159   -0.05930046   -0.04911826   -0.01838183   -0.03511059
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C    2.33203715    0.00898105    0.11877858    0.03751016   -0.02882878    0.02731420
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   15
   -420.52727356
H   -2.69858366    0.58662381   -0.01648202   -0.02528244   -0.01312027    0.00007541
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O   -1.90067678   -1.30453723    0.14977791    0.01139292   -0.00599961    0.00654240
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C    2.32321224   -0.00207175    0.12286426    0.03085140   -0.04994080    0.02567593
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   15
   -420.52714021
H   -2.69536362    0.61786298   -0.01358644   -0.01426021   -0.00071515   -0.00007485
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C   -0.78815503    0.74203357   -0.08045828    0.00820765    0.03111484   -0.01199688
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C    1.59907015    1.21980928   -0.04883413   -0.05230241   -0.00664324   -0.02814796
C    1.72321118   -1.24279916   -0.01500982    0.00215512    0.04984438    0.00171824
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C    2.31254672   -0.01012431    0.12540207    0.01925442   -0.06701454    0.02304410
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   15
   -420.52637766
H   -2.68246497    0.64919414   -0.01058164    0.00610212    0.01822316   -0.00110496
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O   -1.89860166   -1.31072997    0.17431222    0.00040065   -0.01215986    0.00900648
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C    0.41629237   -1.60079582   -0.15659560    0.04115650   -0.02759053   -0.00334177
C    1.60417931    1.22459774   -0.04092865   -0.04403736    0.00543766   -0.02357507
C    1.73050511   -1.24374246   -0.01590177    0.01338202    0.05584463    0.00259380
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C    2.30072876   -0.01415892    0.12655025    0.00529414   -0.07706961    0.01961910
H    3.37449061    0.13570570    0.18465889   -0.00168309    0.00947841    0.00047083
   15
   -420.52460384
H   -2.67372414    0.66766733   -0.00676251    0.02212512    0.03226979   -0.00236488
O   -1.98210030    1.30687293   -0.06530366    0.00906005   -0.04358000    0.00280840
O   -1.89772130   -1.31306871    0.18599522   -0.00468599   -0.01465595    0.01030684
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C   -0.80176605   -0.74279926   -0.04611029   -0.00949075    0.02276043   -0.00653525
C    0.27098006    1.56774770    0.06032976    0.01434396   -0.03053937    0.01062095
C    0.41960730   -1.60309801   -0.16747360    0.03794418   -0.03320338   -0.00386436
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   15
   -420.52569885
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O   -1.89663332   -1.31474521    0.19721100   -0.00848976   -0.01639304    0.01151637
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C   -0.80154350   -0.73960028   -0.04731180   -0.00545550    0.02591660   -0.00752460
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C    1.62149577    1.23241275   -0.02110260   -0.01525648    0.02617980   -0.01491594
C    1.74214364   -1.25550247   -0.01816038    0.02810690    0.04372882    0.00230910
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   15
   -420.52962555
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O   -1.89516616   -1.31568141    0.20790511   -0.01071095   -0.01716934    0.01251032
C   -0.81394527    0.75395392   -0.08581512   -0.02224342    0.03867673   -0.00920456
C   -0.80098993   -0.73795983   -0.04805866   -0.00163306    0.02729542   -0.00841864
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C    0.41974698   -1.60171335   -0.18849785    0.02464890   -0.02846203   -0.00463359
C    1.63201107    1.23425430   -0.00971089   -0.00401818    0.02145544   -0.00983956
C    1.74561029   -1.26560244   -0.01950964    0.02911962    0.02872189    0.00111604
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C    2.26631146    0.00071699    0.12381619   -0.02569231   -0.04408981    0.00803763
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   15
   -420.53241085
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O   -1.99960061    1.32253601   -0.08188403    0.04105246    0.00475599   -0.00279993
O   -1.89321888   -1.31584259    0.21803281   -0.01138422   -0.01685444    0.01317349
C   -0.81799648    0.75078041   -0.08564616   -0.02458370    0.03070539   -0.00812256
C   -0.80033523   -0.73796032   -0.04829733    0.00173053    0.02671207   -0.00912134
C    0.28388303    1.55195877    0.04836187    0.01992555   -0.01887846    0.00832187
C    0.41736548   -1.59831605   -0.19860000    0.01660603   -0.01762428   -0.00444044
C    1.64279691    1.23486425    0.00226899    0.00197802    0.00397529   -0.00347519
C    1.74733389   -1.27742782   -0.02092435    0.02658491    0.01133926   -0.00047033
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H    2.44676784   -2.11051434    0.01408656   -0.00110541   -0.00125146    0.00121192
C    2.25726246    0.01246191    0.12162172   -0.03116509   -0.01524304    0.00436387
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   15
   -420.53173343
H   -2.71484064    0.59069017    0.01809432   -0.02470624   -0.01832898    0.00324731
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O   -1.89076013   -1.31524324    0.22756460   -0.01070587   -0.01537875    0.01338359
C   -0.82057204    0.74576413   -0.08498730   -0.02470900    0.01991612   -0.00677152
C   -0.79978193   -0.73956656   -0.04798576    0.00444198    0.02418612   -0.00955920
C    0.28563839    1.54988836    0.04338090    0.01261887    0.00369242    0.00999437
C    0.41398229   -1.59386508   -0.20843502    0.00804294   -0.00431524   -0.00397413
C    1.65347385    1.23525870    0.01445765    0.00576570   -0.01849373    0.00313298
C    1.74745809   -1.28993736   -0.02231071    0.02239620   -0.00642099   -0.00203954
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H    2.48276010   -2.10145094    0.02707209    0.00607121   -0.00290367    0.00274254
C    2.25009443    0.02511701    0.11916223   -0.03576395    0.01595433    0.00089466
H    3.32643097    0.05866187    0.27595837   -0.00298433   -0.00143111    0.00506228
   15
   -420.52882803
H   -2.70010168    0.58087836    0.02142420   -0.01884848   -0.01818566    0.00315878
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O   -1.88782007   -1.31395050    0.23649103   -0.00882499   -0.01272540    0.01308627
C   -0.82166051    0.73955071   -0.08392020   -0.02334722    0.00767911   -0.00516506
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C    0.28663004    1.54761801    0.03779899    0.00540229    0.02129684    0.01092508
C    0.41011330   -1.58914814   -0.21802956   -0.00063661    0.00804586   -0.00354906
C    1.66379857    1.23675025    0.02646369    0.01010050   -0.03686413    0.00841350
C    1.74622676   -1.30206224   -0.02357578    0.01843120   -0.02345154   -0.00320781
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H    2.32323129    2.11904900   -0.13619078    0.00682961    0.01176554   -0.01387248
H    2.51444272   -2.09037929    0.03808597    0.01219425   -0.00320191    0.00420495
C    2.24508591    0.03682145    0.11664721   -0.03972526    0.04431999   -0.00226399
H    3.31740151    0.03711379    0.28535443   -0.00545606   -0.00457254    0.00530503
   15
   -420.52661424
H   -2.67237774    0.58357620    0.02257557   -0.00325377   -0.00829579    0.00148388
O   -2.03054425    1.33792809   -0.09752896    0.00400937    0.02439846   -0.00427602
O   -1.88448411   -1.31208432    0.24482563   -0.00573705   -0.00901994    0.01226195
C   -0.82134258    0.73287150   -0.08254191   -0.02083093   -0.00429762   -0.00333622
C   -0.79957294   -0.74688652   -0.04562581    0.00666765    0.01430928   -0.00942188
C    0.28727575    1.54416451    0.03157014    0.00172653    0.01892860    0.00923550
C    0.40627910   -1.58489990   -0.22740757   -0.00857520    0.01688147   -0.00351052
C    1.67350736    1.24041908    0.03797242    0.01539230   -0.04492935    0.01143850
C    1.74387347   -1.31277607   -0.02465034    0.01587016   -0.03901611   -0.00369181
H    0.07264986    2.56182179    0.15813114    0.00925470   -0.03095589    0.00117425
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H    2.34929974    2.11955166   -0.11733082    0.01117120    0.01331033   -0.01398919
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C    2.24247347    0.04588350    0.11426667   -0.04235925    0.06513712   -0.00489984
H    3.31222157    0.01881199    0.29093902   -0.00666970   -0.00695796    0.00539040
   15
   -420.52486232
H   -2.64261430    0.59178725    0.02274985    0.01703900    0.00876147   -0.00155145
O   -2.04237475    1.34089204   -0.10233303   -0.02251284    0.01380854   -0.00200696
O   -1.88089269   -1.30981180    0.25260566   -0.00136738   -0.00452349    0.01096445
C   -0.81977121    0.72644307   -0.08096242   -0.01703295   -0.01446711   -0.00138808
C   -0.80004756   -0.75200638   -0.04358638    0.00535526    0.00767309   -0.00872165
C    0.28780368    1.53966389    0.02479374    0.00060537   -0.00211536    0.00545116
C    0.40295379   -1.58164868   -0.23657014   -0.01456962    0.02099311   -0.00407183
C    1.68228271    1.24673761    0.04880129    0.02122324   -0.03966282    0.01210510
C    1.74055225   -1.32114105   -0.02550564    0.01488416   -0.05238511   -0.00337102
H    0.08950909    2.58767365    0.14536446    0.00838960   -0.01065507    0.00334961
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H    2.36760942    2.11085314   -0.08849318    0.01076550    0.00846836   -0.01250222
H    2.54943017   -2.06306958    0.05027808    0.01602562    0.00265466    0.00600377
C    2.24241034    0.05106102    0.11217866   -0.04242756    0.07510152   -0.00678990
H    3.31174869    0.00546261    0.29264810   -0.00646800   -0.00834476    0.00531452
   15
   -420.52273331
H   -2.62468242    0.59397907    0.02399853    0.02994955    0.02067718   -0.00383479
O   -2.05321072    1.34321571   -0.10704409   -0.04180821    0.00712601   -0.00035509
O   -1.87724390   -1.30733556    0.25988951    0.00423627    0.00036622    0.00932339
C   -0.81717783    0.72087518   -0.07929879   -0.01164602   -0.02176132    0.00051879
C   -0.80083559   -0.75758760   -0.04102175    0.00197253    0.00048806   -0.00756506
C    0.28829809    1.53530520    0.01768693   -0.00099175   -0.02631255    0.00173964
C    0.40049390   -1.57964512   -0.24548352   -0.01742554    0.02076294   -0.00520467
C    1.68977273    1.25538919    0.05890700    0.02735945   -0.02152466    0.01100298
C    1.73632677   -1.32635375   -0.02616086    0.01470161   -0.06252052   -0.00228361
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H    0.20307779   -2.63422096   -0.42663653    0.01175004   -0.00016101   -0.00196196
H    2.37844249    2.09636740   -0.05071645    0.00588055   -0.00153167   -0.00995219
H    2.54999462   -2.05098321    0.05017375    0.01346003    0.00776502    0.00615866
C    2.24489684    0.05175584    0.11049735   -0.03924192    0.07328313   -0.00789287
H    3.31586341   -0.00194906    0.29054096   -0.00520348   -0.00857148    0.00501588
   15
   -420.52219220
H   -2.62720549    0.58245798    0.02780076    0.02523724    0.01413587   -0.00281509
O   -2.06221730    1.34514806   -0.11172648   -0.04409809    0.01726031   -0.00185655
O   -1.87379042   -1.30487563    0.26675092    0.01064372    0.00516173    0.00753229
C   -0.81388794    0.71660649   -0.07766538   -0.00476093   -0.02570264    0.00220156
C   -0.80173344   -0.76319793   -0.03800148   -0.00324359   -0.00676783   -0.00603417
C    0.28885945    1.53249597    0.01046832   -0.00393462   -0.04258531   -0.00071898
C    0.39906790   -1.57888439   -0.25408063   -0.01630230    0.01801253   -0.00662458
C    1.69561251    1.26530376    0.06834969    0.03241231    0.00413585    0.00935368
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H    0.19833327   -2.62451987   -0.43936773    0.01194848    0.00502972   -0.00111898
H    2.38516543    2.08308547   -0.00577824   -0.00100899   -0.01298538   -0.00731451
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C    2.24974194    0.04806982    0.10928983   -0.03322182    0.06128761   -0.00829410
H    3.32370113   -0.00326836    0.28484278   -0.00344672   -0.00754476    0.00441596
   15
   -420.52385429
H   -2.64719472    0.56150216    0.03347308    0.00889708   -0.00447080    0.00075293
O   -2.06926587    1.34625656   -0.11631522   -0.03518814    0.03777764   -0.00571138
O   -1.87081925   -1.30264761    0.27327034    0.01686538    0.00936159    0.00582676
C   -0.81031292    0.71387653   -0.07616363    0.00264995   -0.02652484    0.00357601
C   -0.80243176   -0.76840163   -0.03461703   -0.00910523   -0.01348503   -0.00435950
C    0.28966051    1.53220641    0.00328661   -0.00725582   -0.04778916   -0.00187325
C    0.39860682   -1.57921323   -0.26227813   -0.01101468    0.01525046   -0.00785083
C    1.69951670    1.27497983    0.07722391    0.03251429    0.02757247    0.00816301
C    1.72528734   -1.32519940   -0.02716576    0.01018543   -0.06626914    0.00141549
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H    0.18509611   -2.61827755   -0.45126525    0.01029598    0.00756046   -0.00075484
H    2.39242457    2.07884870    0.04447244   -0.00477155   -0.01932791   -0.00536888
H    2.52494079   -2.04665399    0.03685550    0.00660337    0.01428370    0.00559534
C    2.25658868    0.04071186    0.10858178   -0.02566654    0.04237519   -0.00824758
H    3.33402087    0.00078151    0.27598377   -0.00168054   -0.00545957    0.00350610
   15
   -420.52672606
H   -2.67367186    0.54352772    0.03862321   -0.00653387   -0.01973501    0.00405474
O   -2.07471410    1.34567145   -0.12064700   -0.02680870    0.05342691   -0.00907237
O   -1.86860758   -1.30084030    0.27952399    0.02156321    0.01247542    0.00448760
C   -0.80689289    0.71273857   -0.07487657    0.00902302   -0.02491218    0.00461668
C   -0.80258516   -0.77279615   -0.03096791   -0.01382642   -0.01892312   -0.00288582
C    0.29089707    1.53474839   -0.00378683   -0.00992119   -0.04122457   -0.00201243
C    0.39879451   -1.58047233   -0.27000364   -0.00229089    0.01393794   -0.00855913
C    1.70149652    1.28304238    0.08560347    0.02455070    0.04066337    0.00711936
C    1.71875935   -1.31862174   -0.02773755    0.00337666   -0.05676724    0.00371601
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H    0.16456049   -2.61722974   -0.46257422    0.00674329    0.00606197   -0.00113612
H    2.40266802    2.08791630    0.09860584   -0.00129991   -0.01578366   -0.00365157
H    2.50403268   -2.05889201    0.02403166    0.00596316    0.01217645    0.00513080
C    2.26498682    0.03080762    0.10837149   -0.01792121    0.02013113   -0.00798504
H    3.34556601    0.00872063    0.26461207   -0.00017882   -0.00263411    0.00238591
   15
   -420.52946944
H   -2.69587757    0.53915298    0.04096133   -0.01487169   -0.02502649    0.00557923
O   -2.07892353    1.34270573   -0.12457490   -0.02423983    0.05772693   -0.01043289
O   -1.86736385   -1.29959324    0.28557163    0.02351232    0.01406184    0.00376013
C   -0.80400685    0.71309867   -0.07386691    0.01310248   -0.02157863    0.00529522
C   -0.80191632   -0.77605644   -0.02714165   -0.01579206   -0.02233518   -0.00192995
C    0.29272834    1.53972487   -0.01074153   -0.01155626   -0.02313706   -0.00156310
C    0.39911201   -1.58257814   -0.27721318    0.00814970    0.01330315   -0.00893689
C    1.70201957    1.28869983    0.09355752    0.01119035    0.04320403    0.00513440
C    1.71203550   -1.30864718   -0.02853618   -0.00502972   -0.04010043    0.00643478
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   15
   -420.53047046
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O   -1.86717447   -1.29897752    0.29144594    0.02216940    0.01389183    0.00376206
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C   -0.80031043   -0.77797831   -0.02319517   -0.01419338   -0.02329130   -0.00165791
C    0.29525265    1.54606753   -0.01760113   -0.01191118    0.00095077   -0.00123205
C    0.39893982   -1.58548091   -0.28388122    0.01795533    0.01115583   -0.00951413
C    1.70186087    1.29177061    0.10120676   -0.00130519    0.04041741    0.00207068
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H    2.44828393   -2.10485000   -0.01214562    0.00806254   -0.00140939    0.00332087
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   15
   -420.53006027
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O   -1.86797991   -1.29898569    0.29714696    0.01790874    0.01202812    0.00444514
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C   -0.79786323   -0.77850363   -0.01914519   -0.00922623   -0.02184703   -0.00201896
C    0.29848178    1.55239511   -0.02438326   -0.00910710    0.01658039   -0.00142044
C    0.39769600   -1.58904100   -0.28997017    0.02496660    0.00560253   -0.01081398
C    1.70175453    1.29240029    0.10873131   -0.00865638    0.03685055   -0.00112795
C    1.69987324   -1.28273075   -0.03151170   -0.01439846    0.00201624    0.01367498
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H    3.37873818    0.03516811    0.22384967    0.00096566    0.00557436   -0.00144269
   15
   -420.52928067
H   -2.70896055    0.60794810    0.02824277    0.01021933    0.01675263   -0.00249626
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O   -1.86959106   -1.29953465    0.30264445    0.01183395    0.00884005    0.00560634
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C   -0.79486974   -0.77771752   -0.01497111   -0.00196118   -0.01845805   -0.00277741
C    0.30223329    1.55782293   -0.03108053   -0.00086200    0.01274312   -0.00139287
C    0.39496229   -1.59291976   -0.29540031    0.02800346   -0.00389127   -0.01305025
C    1.70213990    1.29079357    0.11631919   -0.00967474    0.03478888   -0.00336131
C    1.69498427   -1.26929757   -0.03412433   -0.01203610    0.01984558    0.01779637
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H    2.37136479   -2.14749610   -0.05754939    0.00260461   -0.01226979    0.00025935
C    2.30545046   -0.00803946    0.11221486    0.00521947   -0.05256983   -0.00708313
H    3.38838831    0.03833941    0.21110148    0.00031295    0.00689642   -0.00265987
   15
   -420.52831779
H   -2.71483522    0.62561758    0.02371022    0.01827627    0.02892707   -0.00512935
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O   -1.87173756   -1.30048166    0.30788684    0.00531919    0.00484808    0.00695548
C   -0.80054664    0.72463887   -0.07311308    0.00903194   -0.00136358    0.00489967
C   -0.79176169   -0.77582169   -0.01062847    0.00611331   -0.01375323   -0.00365192
C    0.30601857    1.56253980   -0.03769875    0.01091067   -0.00275165   -0.00039825
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C    1.70307978    1.28707029    0.12410106   -0.00461039    0.03519441   -0.00375836
C    1.69080417   -1.25703388   -0.03781143   -0.00593296    0.03153502    0.02155034
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C    2.31553719   -0.01205411    0.11427948    0.00940777   -0.05839401   -0.00660953
H    3.39781524    0.03660514    0.20026154   -0.00037024    0.00721438   -0.00377554
   15
   -420.52718170
H   -2.73270675    0.62368279    0.02258755    0.00807035    0.02185170   -0.00328468
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O   -1.87412830   -1.30164756    0.31281392   -0.00046469    0.00060676    0.00822427
C   -0.80138729    0.72851618   -0.07371531    0.00551105    0.00284128    0.00436808
C   -0.78902024   -0.77309696   -0.00606591    0.01365059   -0.00843793   -0.00436407
C    0.30915171    1.56740460   -0.04429515    0.02126514   -0.01509964    0.00103895
C    0.38453080   -1.59918657   -0.30370463    0.02282343   -0.02912262   -0.01915040
C    1.70427478    1.28120770    0.13209893    0.00510122    0.03759316   -0.00196020
C    1.68697530   -1.24664006   -0.04279680    0.00165837    0.03583763    0.02431143
H   -0.03699952    2.62972815   -0.11884929   -0.01496963    0.01348092   -0.00534936
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H    2.32393665    2.13997332    0.39951952   -0.00094733    0.00292166    0.00890106
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C    2.32505683   -0.01257106    0.11674203    0.01321658   -0.05745122   -0.00579031
H    3.40747856    0.02973324    0.19212968   -0.00057586    0.00657616   -0.00472819
   15
   -420.52530528
H   -2.75578453    0.60658539    0.02369140   -0.01202759    0.00525636    0.00087495
O   -2.06762799    1.29259843   -0.14227529   -0.02873267    0.00493076   -0.00252047
O   -1.87650337   -1.30284189    0.31736890   -0.00482732   -0.00340562    0.00920501
C   -0.80255619    0.73222620   -0.07458166    0.00098574    0.00614115    0.00381898
C   -0.78709793   -0.76986173   -0.00124059    0.01991103   -0.00316832   -0.00482324
C    0.31102174    1.57313190   -0.05095185    0.02710492   -0.01759975    0.00199697
C    0.37713527   -1.60008077   -0.30621729    0.01675360   -0.03853960   -0.02155463
C    1.70515480    1.27307817    0.14020840    0.01598066    0.03847510    0.00114235
C    1.68305196   -1.23838122   -0.04924565    0.00808932    0.03376791    0.02570984
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H    2.28594160    2.12490927    0.42993184   -0.01223707   -0.00833417    0.00602529
H    2.25838852   -2.15313811   -0.12528192   -0.01913998   -0.00375715   -0.00227750
C    2.33377953   -0.00964620    0.11955279    0.01652561   -0.04995528   -0.00457655
H    3.41750278    0.01817633    0.18739156    0.00007113    0.00509958   -0.00549253
   15
   -420.52407638
H   -2.77053356    0.58541073    0.02423837   -0.02711521   -0.00703015    0.00394057
O   -2.05845337    1.28349571   -0.14502437   -0.00732403    0.01260700   -0.00508697
O   -1.87866582   -1.30388372    0.32150786   -0.00748879   -0.00688569    0.00975622
C   -0.80377873    0.73556927   -0.07567900   -0.00472930    0.00855556    0.00327222
C   -0.78637127   -0.76643153    0.00387493    0.02445960    0.00143045   -0.00497920
C    0.31127933    1.57987208   -0.05772383    0.02758317   -0.00979782    0.00185456
C    0.36873031   -1.59867883   -0.30743387    0.00989100   -0.04117507   -0.02247216
C    1.70508827    1.26266233    0.14825469    0.02298592    0.03135322    0.00309184
C    1.67865761   -1.23214853   -0.05724239    0.01091338    0.02850112    0.02572665
H   -0.05873397    2.65304345   -0.16134546   -0.02202300    0.02236027   -0.00792435
H    0.06451260   -2.61593169   -0.49322783   -0.00607775    0.00776807   -0.00022143
H    2.25646218    2.11551386    0.45594194   -0.01865761   -0.01410904    0.00421131
H    2.24107135   -2.14508425   -0.14505140   -0.02314388    0.00033564   -0.00215968
C    2.34150638   -0.00372815    0.12263841    0.01916312   -0.03685139   -0.00297712
H    3.42742370    0.00299301    0.18659661    0.00157459    0.00292957   -0.00604020
   15
   -420.52574839
H   -2.76643575    0.56876810    0.02208725   -0.03102712   -0.01058353    0.00471015
O   -2.04891362    1.27385344   -0.14755113    0.00555792    0.01176153   -0.00543381
O   -1.88049496   -1.30461595    0.32520603   -0.00841272   -0.00961628    0.00980507
C   -0.80470946    0.73839920   -0.07697418   -0.01157954    0.01009319    0.00272039
C   -0.78711362   -0.76308215    0.00929004    0.02694698    0.00488595   -0.00482454
C    0.30989533    1.58715730   -0.06460044    0.02263924    0.00760132    0.00019713
C    0.35972918   -1.59482561   -0.30730015    0.00259367   -0.03619217   -0.02166708
C    1.70366526    1.25041126    0.15613030    0.02356518    0.01253409    0.00193564
C    1.67362892   -1.22764156   -0.06678962    0.00867673    0.02351340    0.02465625
H   -0.04672849    2.64121909   -0.17442905   -0.01888646    0.01186599   -0.00737952
H    0.07722554   -2.62449962   -0.49187902   -0.00470319    0.00282603   -0.00084933
H    2.23996107    2.11566675    0.47872464   -0.01766053   -0.01005451    0.00551481
H    2.24013054   -2.13704342   -0.16326962   -0.02236027    0.00071457   -0.00196990
C    2.34807746    0.00439825    0.12590256    0.02116654   -0.01970552   -0.00108246
H    3.43618289   -0.01427281    0.19013683    0.00350591    0.00031786   -0.00635575
   15
   -420.52871359
H   -2.74069654    0.55922103    0.01667979   -0.02319513   -0.00532744    0.00319989
O   -2.03959096    1.26370888   -0.14983971    0.00912545    0.00248740   -0.00354565
O   -1.88194886   -1.30491527    0.32846122   -0.00760241   -0.01144554    0.00933029
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C   -0.78947364   -0.76002137    0.01499517    0.02700078    0.00694770   -0.00433320
C    0.30716691    1.59394258   -0.07148070    0.01284364    0.03273195   -0.00307715
C    0.35057397   -1.58880932   -0.30586275   -0.00526412   -0.02606807   -0.01953967
C    1.70083847    1.23743928    0.16389998    0.01994462   -0.01343487   -0.00137148
C    1.66809985   -1.22456523   -0.07782384    0.00164969    0.02009766    0.02273403
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H    2.23587485    2.12265870    0.49739874   -0.01163554    0.00053128    0.00902528
H    2.25500230   -2.12928307   -0.18006262   -0.01680734   -0.00267359   -0.00187165
C    2.35336993    0.01370660    0.12923142    0.02285004   -0.00061091    0.00096043
H    3.44243640   -0.03175921    0.19823884    0.00512080   -0.00241977   -0.00642734
   15
   -420.52971579
H   -2.69885611    0.55302720    0.00908448   -0.00556650    0.00779542   -0.00020461
O   -2.03065048    1.25347968   -0.15197448    0.00448582   -0.01407710    0.00018265
O   -1.88306452   -1.30469904    0.33129499   -0.00500119   -0.01228102    0.00833520
C   -0.80401563    0.74221008   -0.08002450   -0.02588861    0.01018187    0.00163979
C   -0.79345228   -0.75737373    0.02096038    0.02418753    0.00759508   -0.00345082
C    0.30367188    1.59874938   -0.07817096    0.00111917    0.05709023   -0.00708169
C    0.34173943   -1.58122237   -0.30324643   -0.01354697   -0.01473290   -0.01682781
C    1.69680761    1.22527076    0.17174996    0.01573505   -0.03774614   -0.00420550
C    1.66248551   -1.22270547   -0.09022866   -0.00824724    0.01686987    0.01994797
H    0.01249149    2.60674704   -0.18625117   -0.00386024   -0.02683942   -0.00296505
H    0.11159579   -2.64241266   -0.48663342   -0.00079270   -0.01028072   -0.00255108
H    2.24012626    2.12930871    0.50960183   -0.00480738    0.01061860    0.01211830
H    2.28180032   -2.11952403   -0.19551102   -0.00832195   -0.00726076   -0.00170731
C    2.35727938    0.02305436    0.13250233    0.02475743    0.01801356    0.00297989
H    3.44506446   -0.04751466    0.21095508    0.00571845   -0.00492535   -0.00625331
   15
   -420.52918493
H   -2.65312597    0.54109406    0.00165527    0.01358785    0.02247071   -0.00381838
O   -2.02190671    1.24389422   -0.15411844   -0.00154481   -0.03143128    0.00406826
O   -1.88396040   -1.30392942    0.33375222   -0.00050743   -0.01210411    0.00690050
C   -0.80154101    0.74318323   -0.08171477   -0.03029010    0.00922931    0.00117837
C   -0.79887729   -0.75517918    0.02713195    0.01809387    0.00701027   -0.00211170
C    0.30009582    1.60019029   -0.08443960   -0.00821796    0.06450555   -0.00989932
C    0.33372255   -1.57273329   -0.29961204   -0.02148802   -0.00555370   -0.01418003
C    1.69181894    1.21534337    0.17984293    0.01263191   -0.05389910   -0.00484699
C    1.65737170   -1.22185612   -0.10383488   -0.01848843    0.01172889    0.01618079
H    0.04933465    2.61055103   -0.18801014    0.00081255   -0.03200411   -0.00165956
H    0.13040792   -2.64267492   -0.48156812    0.00227680   -0.01251965   -0.00264608
H    2.24795905    2.12862788    0.51320923    0.00011563    0.01558254    0.01305815
H    2.31457303   -2.10465122   -0.20974982    0.00050462   -0.00998035   -0.00120402
C    2.35968731    0.03132711    0.13559401    0.02749937    0.03384240    0.00481831
H    3.44365476   -0.05974825    0.22816021    0.00500499   -0.00688175   -0.00583937
   15
   -420.53005037
H   -2.61640592    0.51374585   -0.00319981    0.02031672    0.02476938   -0.00459758
O   -2.01313572    1.23568396   -0.15643543    0.00322918   -0.03565505    0.00502061
O   -1.88484011   -1.30261387    0.33589740    0.00579150   -0.01106861    0.00518702
C   -0.79725675    0.74359597   -0.08347641   -0.03027954    0.00869592    0.00074034
C   -0.80537915   -0.75340425    0.03342897    0.00853922    0.00555215   -0.00031499
C    0.29700226    1.59785718   -0.09011989   -0.01489054    0.04768769   -0.01079521
C    0.32699845   -1.56388808   -0.29511749   -0.02805742   -0.00034217   -0.01203222
C    1.68606000    1.20862029    0.18821597    0.01079282   -0.05908105   -0.00288135
C    1.65336664   -1.22170118   -0.11841498   -0.02687880    0.00366019    0.01148104
H    0.08583562    2.63607592   -0.18845881    0.00164835   -0.01612648   -0.00213260
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   15
   -420.53115516
H   -2.59334841    0.46966024   -0.00496654    0.01173848    0.00973702   -0.00187597
O   -2.00456008    1.22901968   -0.15896586    0.02011907   -0.02185925    0.00237038
O   -1.88598745   -1.30079808    0.33780729    0.01334069   -0.00951945    0.00345024
C   -0.79116920    0.74347746   -0.08528274   -0.02476998    0.00919429    0.00028162
C   -0.81238238   -0.75196252    0.03974342   -0.00396655    0.00357399    0.00180836
C    0.29481396    1.59269938   -0.09515043   -0.02229263    0.01899999   -0.01103309
C    0.32195977   -1.55500208   -0.28989209   -0.03238600    0.00093287   -0.01049382
C    1.67964244    1.20541391    0.19675157    0.01015776   -0.05312886    0.00143123
C    1.65097019   -1.22175485   -0.13368570   -0.03192228   -0.00692307    0.00606040
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H    2.37450340   -2.05468923   -0.23643092    0.01104310   -0.00422098    0.00128354
C    2.35926719    0.04113105    0.14082196    0.03577955    0.05048633    0.00713289
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   15
   -420.52950495
H   -2.57856312    0.41883154   -0.00541216   -0.00017674   -0.01006344    0.00143611
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O   -1.88774021   -1.29855068    0.33955973    0.02090120   -0.00789409    0.00197562
C   -0.78360777    0.74279826   -0.08710599   -0.01453152    0.01060988   -0.00020086
C   -0.81913895   -0.75073602    0.04594867   -0.01777949    0.00141038    0.00392242
C    0.29398307    1.58637257   -0.09951094   -0.03131293   -0.00624836   -0.01177723
C    0.31886629   -1.54616249   -0.28403039   -0.03405162    0.00028070   -0.00926813
C    1.67260694    1.20537622    0.20519323    0.01017727   -0.03849414    0.00716430
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H    0.15463721    2.70362719   -0.18413532    0.00483999    0.02712946   -0.00306183
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C    2.35594788    0.04166197    0.14282078    0.03944720    0.05000390    0.00706148
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   15
   -420.52660795
H   -2.56400856    0.37483015   -0.00679461   -0.00652948   -0.02335344    0.00323309
O   -1.99084980    1.21777789   -0.16419764    0.04407793    0.01065100   -0.00289764
O   -1.89043487   -1.29594359    0.34122057    0.02672481   -0.00665363    0.00103297
C   -0.77517842    0.74147602   -0.08891712   -0.00215535    0.01230419   -0.00068467
C   -0.82482626   -0.74959589    0.05191930   -0.03036994   -0.00052951    0.00553214
C    0.29504200    1.58037270   -0.10315664   -0.03945328   -0.02147329   -0.01306452
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C    1.66496410    1.20765214    0.21320364    0.00847373   -0.02108179    0.01245595
C    1.65196820   -1.21991295   -0.16497887   -0.03025029   -0.02806526   -0.00510057
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H    0.16617792   -2.58536606   -0.44928017    0.01184095    0.00918708    0.00182914
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H    2.40605987   -1.99529438   -0.26709138    0.00824069    0.01195109    0.00485812
C    2.35025546    0.03919537    0.14439872    0.04063330    0.04417385    0.00575280
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   15
   -420.52612903
H   -2.54516977    0.34711397   -0.01040524   -0.00599142   -0.02779878    0.00337832
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O   -1.89432882   -1.29303191    0.34283177    0.02903008   -0.00612240    0.00081727
C   -0.76661337    0.73941216   -0.09068696    0.00918453    0.01350764   -0.00114939
C   -0.82869640   -0.74842754    0.05756032   -0.03907975   -0.00169870    0.00615552
C    0.29846678    1.57561192   -0.10601150   -0.04360859   -0.02474708   -0.01451361
C    0.31875422   -1.52862939   -0.27072386   -0.02943949    0.00643054   -0.00546482
C    1.65683673    1.21122778    0.22047274    0.00129751   -0.00834441    0.01543481
C    1.65527296   -1.21676878   -0.18033289   -0.02579822   -0.03262749   -0.00951956
H    0.20841818    2.70375630   -0.17193544    0.01234878    0.02949935   -0.00048080
H    0.15658350   -2.57633865   -0.44228424    0.01056815    0.00879087    0.00198590
H    2.29094702    2.03858095    0.43417059   -0.00695214   -0.01948785   -0.00402748
H    2.41204541   -1.97535244   -0.28699911    0.00501506    0.01812260    0.00617342
C    2.34212403    0.03407949    0.14563572    0.03820026    0.03392885    0.00307788
H    3.40626325   -0.04011178    0.36418893    0.00251251   -0.00453604    0.00118181
   15
   -420.52858247
H   -2.52235244    0.33891441   -0.01637391    0.00023374   -0.02377746    0.00223207
O   -1.98460511    1.20512693   -0.16900720    0.03431101    0.01083065   -0.00172675
O   -1.89952264   -1.28983881    0.34440288    0.02676555   -0.00651491    0.00139429
C   -0.75858676    0.73653691   -0.09238742    0.01719022    0.01364432   -0.00158345
C   -0.83023197   -0.74716258    0.06283541   -0.04206803   -0.00165343    0.00552650
C    0.30449907    1.57228160   -0.10798970   -0.04188603   -0.01488739   -0.01574470
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C    1.64866472    1.21534816    0.22682119   -0.01243852   -0.00330557    0.01588917
C    1.66014047   -1.21169199   -0.19512013   -0.02174849   -0.02917622   -0.01215754
H    0.22338670    2.67129417   -0.16476627    0.01582450    0.01232320    0.00159720
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H    2.30913562    2.04174774    0.41725236   -0.00088345   -0.01369248   -0.00390522
H    2.41428322   -1.96815302   -0.31129391    0.00398283    0.01922295    0.00652241
C    2.33170066    0.02692793    0.14669240    0.03216573    0.02038459   -0.00072650
H    3.39568669   -0.02243889    0.39438841    0.00502114   -0.00200561    0.00380283
   15
   -420.53042237
H   -2.49998140    0.34733503   -0.02387889    0.01091946   -0.01140302   -0.00009145
O   -1.98397406    1.19801826   -0.17127220    0.02031365   -0.00228696    0.00098472
O   -1.90591429   -1.28634699    0.34590813    0.02011987   -0.00774862    0.00267005
C   -0.75158020    0.73284197   -0.09399227    0.02134673    0.01270978   -0.00198767
C   -0.82925398   -0.74580401    0.06778209   -0.03898755   -0.00035220    0.00374851
C    0.31303390    1.56979555   -0.10901875   -0.03410873    0.00559080   -0.01633413
C    0.32560616   -1.51293505   -0.25615063   -0.01727849    0.02442084    0.00067860
C    1.64125869    1.21969183    0.23221477   -0.02889489   -0.00289153    0.01509176
C    1.66632834   -1.20489399   -0.20918345   -0.01857374   -0.01718859   -0.01254786
H    0.22700264    2.63053573   -0.15874836    0.01853598   -0.01398617    0.00369926
H    0.11715161   -2.57264134   -0.43200759    0.00296829   -0.00366261    0.00043212
H    2.32779872    2.05450658    0.40310455    0.00777580   -0.00338175   -0.00306316
H    2.41347012   -1.97444305   -0.34020842    0.00589975    0.01453584    0.00561613
C    2.31934569    0.01855402    0.14779641    0.02343118    0.00470630   -0.00515568
H    3.38154770   -0.00335405    0.42185902    0.00655103    0.00094755    0.00625010
   15
   -420.52972882
H   -2.48555533    0.36362083   -0.03127105    0.02272588    0.00630089   -0.00310753
O   -1.98425296    1.19103602   -0.17358505    0.00345736   -0.02098634    0.00447867
O   -1.91320761   -1.28250134    0.34729040    0.01049343   -0.00959146    0.00443516
C   -0.74585152    0.72838067   -0.09547681    0.02289268    0.01131758   -0.00241247
C   -0.82594225   -0.74442825    0.07250573   -0.03111065    0.00178875    0.00124194
C    0.32360549    1.56698411   -0.10906649   -0.02106014    0.02301633   -0.01559501
C    0.33079713   -1.50701133   -0.24882845   -0.01064104    0.03021581    0.00331383
C    1.63558654    1.22421085    0.23669576   -0.04274337   -0.00270341    0.01418130
C    1.67363515   -1.19708676   -0.22249867   -0.01448892    0.00078600   -0.01081480
H    0.21735686    2.59960812   -0.15535255    0.01968309   -0.03576033    0.00509653
H    0.09268971   -2.56944625   -0.42767678   -0.00169685   -0.00847002   -0.00013852
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H    2.40833979   -1.99097249   -0.37310001    0.00892915    0.00608430    0.00361150
C    2.30558084    0.00989874    0.14921204    0.01326045   -0.01162332   -0.00955152
H    3.36282261    0.01504609    0.44487185    0.00590631    0.00393184    0.00799729
   15
   -420.52942617
H   -2.48711404    0.37570231   -0.03648268    0.02812347    0.01836506   -0.00510453
O   -1.98470449    1.18498531   -0.17609720   -0.00911039   -0.03415028    0.00692633
O   -1.92097320   -1.27821978    0.34847061   -0.00017588   -0.01164297    0.00641382
C   -0.74150365    0.72323381   -0.09681503    0.02362148    0.01008613   -0.00291722
C   -0.82076130   -0.74316197    0.07715513   -0.02073721    0.00420787   -0.00144429
C    0.33542377    1.56289640   -0.10818115   -0.00271797    0.01855023   -0.01289526
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C    1.63246886    1.22888310    0.24031781   -0.05055004   -0.00051618    0.01351291
C    1.68180264   -1.18933489   -0.23516661   -0.00737823    0.02030648   -0.00774142
H    0.19374681    2.59299077   -0.15553503    0.01717764   -0.03444373    0.00500003
H    0.06940646   -2.56041755   -0.42328651   -0.00559294   -0.00888892   -0.00002919
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H    2.39687606   -2.01186141   -0.40856077    0.01037205   -0.00277233    0.00106133
C    2.29101512    0.00194047    0.15120192    0.00285727   -0.02675017   -0.01325869
H    3.34000224    0.03063959    0.46218521    0.00263932    0.00649088    0.00871670
   15
   -420.53059560
H   -2.50810404    0.37557994   -0.03818854    0.02033883    0.01439922   -0.00438813
O   -1.98478813    1.18041962   -0.17891234   -0.01017106   -0.03119864    0.00654481
O   -1.92873325   -1.27341112    0.34936023   -0.01022590   -0.01341824    0.00829041
C   -0.73858443    0.71747735   -0.09797651    0.02426423    0.00873857   -0.00348891
C   -0.81432817   -0.74214944    0.08189047   -0.00993999    0.00647605   -0.00385552
C    0.34738247    1.55779306   -0.10652483    0.02018088   -0.00609995   -0.00854809
C    0.34277073   -1.50060740   -0.23487416   -0.00024863    0.02642059    0.00572698
C    1.63236965    1.23357346    0.24312118   -0.05064766    0.00427736    0.01317857
C    1.69039800   -1.18279565   -0.24736720    0.00330695    0.03676146   -0.00452678
H    0.15807226    2.60982966   -0.15923272    0.00969305   -0.01151213    0.00346995
H    0.05006449   -2.54527568   -0.41892071   -0.00804043   -0.00457329    0.00084903
H    2.33583856    2.08564926    0.37386094    0.01255707    0.00919366   -0.00468576
H    2.37813570   -2.03090846   -0.44481012    0.00860001   -0.00913023   -0.00123500
C    2.27627390   -0.00441641    0.15398741   -0.00701619   -0.03858947   -0.01570947
H    3.31540632    0.04160612    0.47328461   -0.00269596    0.00824600    0.00837663
   15
   -420.52947123
H   -2.54315663    0.36572543   -0.03684761    0.00310946    0.00004946   -0.00179614
O   -1.98444544    1.17722807   -0.18201684   -0.00217537   -0.01751727    0.00418801
O   -1.93603516   -1.26799638    0.34987520   -0.01875381   -0.01446259    0.00976810
C   -0.73712896    0.71119769   -0.09892699    0.02411821    0.00637172   -0.00406077
C   -0.80729062   -0.74152642    0.08685626    0.00022546    0.00833359   -0.00572598
C    0.35811930    1.55305611   -0.10435229    0.04332296   -0.03089528   -0.00398331
C    0.34892813   -1.49990615   -0.22838870    0.00279148    0.01859303    0.00566053
C    1.63529192    1.23799313    0.24512524   -0.04255318    0.01137644    0.01333806
C    1.69878067   -1.17844535   -0.25928799    0.01647614    0.04640581   -0.00252549
H    0.11556583    2.63487314   -0.16539478   -0.00027434    0.01348404    0.00137352
H    0.03640853   -2.52704401   -0.41519749   -0.00879611    0.00309028    0.00228161
H    2.31883001    2.08376845    0.36981840    0.00391866    0.00269005   -0.00663900
H    2.35340631   -2.04363466   -0.48022201    0.00340989   -0.01132076   -0.00268988
C    2.26195406   -0.00846576    0.15771474   -0.01633202   -0.04521343   -0.01653519
H    3.29278057    0.04669249    0.47839387   -0.00847940    0.00901782    0.00733913
   15
   -420.52495612
H   -2.58049791    0.35568599   -0.03419795   -0.01357002   -0.01231446    0.00063909
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O   -1.94249254   -1.26192942    0.34994933   -0.02561177   -0.01443285    0.01061404
C   -0.73712214    0.70454025   -0.09963223    0.02199041    0.00254988   -0.00457289
C   -0.80026230   -0.74140496    0.09216518    0.00951072    0.00971691   -0.00695577
C    0.36626183    1.55012270   -0.10193348    0.06151660   -0.04334830   -0.00041705
C    0.35492288   -1.50032938   -0.22224476    0.00462744    0.01084254    0.00543333
C    1.64075541    1.24172304    0.24632053   -0.02815518    0.01857402    0.01393513
C    1.70616463   -1.17685606   -0.27104431    0.03011242    0.04705509   -0.00286567
H    0.07318985    2.65085937   -0.17256157   -0.00914866    0.02812794   -0.00046994
H    0.02901073   -2.51105561   -0.41312061   -0.00833111    0.01100120    0.00374225
H    2.29914795    2.08013594    0.37056964   -0.00705565   -0.00675199   -0.00874491
H    2.32637739   -2.04847230   -0.51377312   -0.00432935   -0.00909258   -0.00288334
C    2.24862290   -0.00981338    0.16243361   -0.02583048   -0.04535177   -0.01566055
H    3.27614757    0.04533952    0.47822120   -0.01239723    0.00885364    0.00624069
   15
   -420.52090881
H   -2.60847908    0.35408616   -0.03194538   -0.02360112   -0.01769291    0.00203816
O   -1.98385376    1.17272325   -0.18870128    0.01172024   -0.00009598    0.00086701
O   -1.94779329   -1.25521211    0.34954468   -0.03102267   -0.01318650    0.01071133
C   -0.73843186    0.69773421   -0.10006116    0.01720732   -0.00237719   -0.00503530
C   -0.79380423   -0.74186920    0.09789149    0.01779477    0.01070740   -0.00752119
C    0.37072402    1.54974188   -0.09948110    0.07177522   -0.04202133    0.00152109
C    0.36063929   -1.50143033   -0.21643269    0.00615787    0.00740531    0.00584295
C    1.64791560    1.24435607    0.24667387   -0.01256733    0.02044864    0.01434132
C    1.71173717   -1.17806893   -0.28261342    0.04178645    0.03914154   -0.00593002
H    0.03721407    2.64732508   -0.17942876   -0.01486663    0.03048726   -0.00167112
H    0.02760059   -2.50276471   -0.41369403   -0.00766322    0.01520621    0.00446165
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H    2.30250659   -2.04695258   -0.54532085   -0.01269340   -0.00376871   -0.00189857
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   15
   -420.52075954
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O   -1.95169136   -1.24790097    0.34865688   -0.03509772   -0.01075439    0.01005009
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   15
   -420.52314399
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O   -1.95400299   -1.24010583    0.34731561   -0.03752374   -0.00729055    0.00870169
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C    1.66390324    1.24659078    0.24485488    0.00503917   -0.00570348    0.01090728
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   15
   -420.52373738
H   -2.59648540    0.41329742   -0.03306822   -0.00050119    0.00898914   -0.00201463
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O   -1.95462102   -1.23198305    0.34558169   -0.03754455   -0.00297900    0.00676536
C   -0.74672894    0.67949021   -0.09941526   -0.00668725   -0.01832735   -0.00630395
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C    0.35872001    1.55940366   -0.09252044    0.04663548    0.02978235   -0.00374034
C    0.37502428   -1.50873135   -0.20158468    0.01325389    0.02982954    0.01255474
C    1.67165296    1.24772204    0.24288847    0.00928816   -0.02378580    0.00728346
C    1.71224410   -1.19281206   -0.31396092    0.04019296    0.00538327   -0.01921296
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C    2.21725639    0.00636762    0.18869217   -0.06203901    0.00571660    0.00367732
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   15
   -420.52241748
H   -2.57860098    0.43337578   -0.03287502    0.01646559    0.02531528   -0.00547452
O   -1.98698993    1.16688102   -0.20313727   -0.01945228   -0.04099933    0.00979052
O   -1.95354796   -1.22372785    0.34354261   -0.03427344    0.00208005    0.00434452
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C   -0.78206262   -0.75041766    0.12497165    0.02828320    0.00961342   -0.00168576
C    0.34791566    1.56148991   -0.08998710    0.02829294    0.05042035   -0.00687642
C    0.37842248   -1.51397634   -0.19794290    0.01563916    0.03746181    0.01428623
C    1.67883969    1.25025385    0.24048187    0.01369284   -0.03451613    0.00358620
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C    2.21766390    0.01192522    0.19564127   -0.06126007    0.01920949    0.01141227
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   15
   -420.52414868
H   -2.57174046    0.43614151   -0.02893347    0.02009077    0.02693381   -0.00580143
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C   -0.75126838    0.67227757   -0.09712798   -0.01383437   -0.02546855   -0.00674127
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C    0.33536820    1.56067955   -0.08705242    0.01572407    0.04210870   -0.00728445
C    0.38087644   -1.52146164   -0.19515745    0.01772210    0.04002185    0.01450948
C    1.68519525    1.25481606    0.23785466    0.01871898   -0.03398384    0.00063340
C    1.70041962   -1.20547850   -0.32956937    0.00996415   -0.00811252   -0.02290042
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C    2.22174159    0.01634676    0.20189998   -0.05354230    0.02755396    0.01920070
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   15
   -420.52768645
H   -2.57834839    0.42061789   -0.02109071    0.00786499    0.01110109   -0.00177582
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C    0.32185504    1.55743257   -0.08368942    0.00599275    0.01245218   -0.00533129
C    0.38226192   -1.53133756   -0.19324133    0.01912288    0.03672264    0.01312509
C    1.69041477    1.26137529    0.23518193    0.02454096   -0.02192687   -0.00088551
C    1.69311101   -1.21127562   -0.33534422   -0.00503074   -0.01694747   -0.02500912
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C    2.22902709    0.01913295    0.20700123   -0.03975020    0.02967492    0.02624957
H    3.30338263   -0.07020667    0.37864249   -0.00035971   -0.00607779   -0.00311125
   15
   -420.52729469
H   -2.59045816    0.39727011   -0.01202882   -0.00749164   -0.00791100    0.00333659
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O   -1.94253645   -1.20061417    0.33676890   -0.00307712    0.02065745   -0.00466125
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C   -0.78924745   -0.76266421    0.14640821   -0.00523688   -0.00068540    0.01180694
C    0.30799729    1.55343194   -0.08000343   -0.00689201   -0.01781886   -0.00336559
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C    1.69414652    1.26921654    0.23255360    0.03099351   -0.00121425   -0.00062954
C    1.68608596   -1.21604042   -0.33960234   -0.01595563   -0.02720636   -0.02793112
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C    2.23869921    0.02015337    0.21052242   -0.02251975    0.02603117    0.03179624
H    3.30697345   -0.08217494    0.36150427   -0.00523382   -0.00687880   -0.00511130
   15
   -420.52341499
H   -2.59757848    0.37916184   -0.00526003   -0.01639731   -0.01974984    0.00673535
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O   -1.93783291   -1.19439402    0.33474488    0.01072916    0.02668343   -0.00762488
C   -0.75299509    0.67261838   -0.09067759    0.00240164   -0.01954167   -0.00615918
C   -0.79209852   -0.76698620    0.15251962   -0.01963726   -0.00498058    0.01661045
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C    1.69600964    1.27711811    0.22995836    0.03614510    0.02196682    0.00055622
C    1.67999672   -1.21916018   -0.34216792   -0.02113084   -0.03735266   -0.03148735
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H    2.32187721    2.07975471    0.56645330   -0.00355116   -0.01154104    0.00115759
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C    2.24973617    0.01961962    0.21213120   -0.00582955    0.01833551    0.03520292
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   15
   -420.52066936
H   -2.59340306    0.37474232   -0.00320222   -0.01669421   -0.02272025    0.00777113
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O   -1.93360842   -1.18937990    0.33306503    0.02245951    0.03148206   -0.01010432
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C   -0.79377678   -0.77101088    0.15763038   -0.03108674   -0.00849395    0.02063777
C    0.28255908    1.54971839   -0.07205037   -0.03995713   -0.04579182   -0.00300011
C    0.37960116   -1.57214126   -0.19160921    0.01459335    0.01064794    0.00603378
C    1.69571319    1.28372102    0.22733682    0.03606256    0.03932800    0.00028522
C    1.67515675   -1.22003296   -0.34282979   -0.02068385   -0.04505237   -0.03488574
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H    2.32110393    2.06514262    0.58645383   -0.00610794   -0.01840218    0.00031974
H    2.43258479   -1.90135346   -0.72519353    0.00665991    0.00732813   -0.00179669
C    2.26114693    0.01798682    0.21162359    0.00674815    0.00864165    0.03611137
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   15
   -420.52118421
H   -2.57770128    0.38615204   -0.00659590   -0.00859954   -0.01677587    0.00631013
O   -1.98581052    1.18720458   -0.23192651    0.01696180    0.01432689   -0.00412970
O   -1.93038638   -1.18578682    0.33184062    0.02980295    0.03432202   -0.01177583
C   -0.75407345    0.67899544   -0.08449343    0.00960764   -0.00915848   -0.00525242
C   -0.79360304   -0.77452984    0.16149925   -0.03698248   -0.01044145    0.02342343
C    0.27294761    1.55167993   -0.06780586   -0.05428284   -0.03956311   -0.00458009
C    0.37674596   -1.58774061   -0.19196886    0.01043886    0.00617724    0.00572254
C    1.69327500    1.28800204    0.22471631    0.02841697    0.04576054   -0.00346221
C    1.67155151   -1.21820767   -0.34139007   -0.01710153   -0.04742129   -0.03661481
H    0.02771248    2.64249805   -0.21685733   -0.00120204    0.02396131   -0.00468630
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H    2.43699487   -1.86900436   -0.72597674    0.00222335    0.01556970    0.00185262
C    2.27217652    0.01583313    0.20894399    0.01405611   -0.00143290    0.03464580
H    3.34542274   -0.08822557    0.33410373   -0.00256522   -0.00655181   -0.00512273
   15
   -420.52221916
H   -2.55624813    0.40908574   -0.01437128    0.00668639   -0.00174233    0.00219888
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O   -1.92849505   -1.18374192    0.33114674    0.03149376    0.03474447   -0.01243016
C   -0.75539959    0.68317589   -0.08091079    0.00792257   -0.00521535   -0.00466053
C   -0.79122785   -0.77742737    0.16395869   -0.03593910   -0.01041505    0.02474807
C    0.26659902    1.55595580   -0.06327821   -0.06466440   -0.01802254   -0.00736252
C    0.37326276   -1.60372270   -0.19267912    0.00559200    0.00347767    0.00628303
C    1.68914297    1.28956178    0.22231830    0.01592053    0.04310141   -0.00972974
C    1.66898430   -1.21355402   -0.33775335   -0.01418465   -0.04199987   -0.03492326
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H    0.18088721   -2.63500217   -0.48003256    0.00958495   -0.00030653   -0.00119833
H    2.32915388    2.07254980    0.62331132    0.00501108   -0.00754269    0.00810106
H    2.43963065   -1.84759685   -0.72795888    0.00059590    0.01936535    0.00330067
C    2.28237516    0.01376322    0.20417852    0.01755553   -0.01092852    0.03131049
H    3.36532957   -0.08053934    0.33299649    0.00411371   -0.00580000   -0.00345511
   15
   -420.52072626
H   -2.53971420    0.43301436   -0.02365191    0.02325727    0.01699269   -0.00303913
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O   -1.92801230   -1.18326443    0.33101284    0.02780118    0.03277031   -0.01201401
C   -0.75719397    0.68767865   -0.07704713    0.00410805   -0.00260848   -0.00389779
C   -0.78671180   -0.77970477    0.16492840   -0.02842363   -0.00846867    0.02467721
C    0.26413502    1.56127392   -0.05830281   -0.06968656    0.01208650   -0.01051586
C    0.36944291   -1.61990631   -0.19376775    0.00042839   -0.00091913    0.00653462
C    1.68404540    1.28853377    0.22050641    0.00381777    0.03654989   -0.01559655
C    1.66728962   -1.20640088   -0.33202524   -0.01398391   -0.02863302   -0.02919032
H    0.06467161    2.57870377   -0.19948440    0.01299628   -0.02970477    0.00247567
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C    2.29151869    0.01234769    0.19752507    0.01968016   -0.01910357    0.02684444
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   15
   -420.52031579
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O   -1.99165318    1.19506050   -0.24556502   -0.01817605   -0.02182506    0.00472177
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C   -0.75923737    0.69234254   -0.07294876    0.00037186   -0.00068969   -0.00292512
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C    0.36559687   -1.63601268   -0.19524516   -0.00466645   -0.00953433    0.00552456
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   15
   -420.52454913
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O   -1.93045043   -1.18657892    0.33230879    0.01070961    0.02407640   -0.00858874
C   -0.76130993    0.69704891   -0.06867479   -0.00212031    0.00102450   -0.00169399
C   -0.77330308   -0.78294376    0.16247858   -0.00239358   -0.00108321    0.02145128
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   15
   -420.52798023
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C   -0.76596280   -0.78434376    0.15925145    0.01177707    0.00271185    0.01885000
C    0.28041377    1.57099114   -0.03973389   -0.03351897   -0.00675385   -0.00201877
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C    1.66892915    1.27371206    0.22123161   -0.00666070    0.02102538   -0.01561943
C    1.66745152   -1.17919797   -0.30638715   -0.01120443    0.02731248   -0.00373159
H    0.05648698    2.62558109   -0.18360854    0.00341064    0.00019668   -0.00258287
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C    2.31106722    0.01628049    0.16899053    0.03090369   -0.02891592    0.01318173
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   15
   -420.52676993
H   -2.61817769    0.41829752   -0.04247854   -0.01724528   -0.01638596    0.00599280
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O   -1.93481430   -1.19424528    0.33513875   -0.00808656    0.01405791   -0.00351932
C   -0.76495865    0.70621431   -0.05991191   -0.00662024    0.00255418    0.00140142
C   -0.75932884   -0.78590299    0.15488601    0.02476676    0.00553941    0.01586932
C    0.29131453    1.57338221   -0.03289464   -0.01091137   -0.02415006    0.00273851
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C    1.66465668    1.26589772    0.22353030   -0.00274891    0.01877940   -0.01035340
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H    0.04228095    2.66510515   -0.17823747   -0.00437083    0.02377720   -0.00596682
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H    2.39690888   -1.89120480   -0.73258659    0.00822395   -0.00291766   -0.01018138
C    2.31420722    0.02097269    0.15753603    0.03458830   -0.02577985    0.00960088
H    3.38172536   -0.00107492    0.34075085   -0.00185276    0.00206624    0.00241178
   15
   -420.52393736
H   -2.63548969    0.41953722   -0.05146138   -0.02332477   -0.01950053    0.00643935
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C   -0.76625255    0.71058059   -0.05560879   -0.01055238    0.00241942    0.00297662
C   -0.75418200   -0.78778960    0.14956202    0.03562369    0.00684947    0.01263856
C    0.30287657    1.57716553   -0.02621120    0.01141687   -0.02817862    0.00557429
C    0.35564651   -1.68557642   -0.20250127   -0.01812700   -0.07003580   -0.00900682
C    1.66055190    1.25695748    0.22645530    0.00083916    0.01443121   -0.00513883
C    1.67091223   -1.16709920   -0.28713848    0.00440939    0.04749451    0.00448260
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H    2.22332725    2.10836840    0.54836031   -0.01327826   -0.00911371    0.00084699
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C    2.31527426    0.02720665    0.14549959    0.03453746   -0.01918840    0.00628869
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   15
   -420.52328083
H   -2.63657272    0.43433956   -0.06495382   -0.01985765   -0.01442816    0.00471604
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O   -1.93778593   -1.20450655    0.33861604   -0.02196816    0.00678381    0.00107167
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C   -0.75117533   -0.79008138    0.14347406    0.04360890    0.00635727    0.00934058
C    0.31376139    1.58259288   -0.01985501    0.03102919   -0.02007322    0.00641613
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C    1.65641648    1.24718093    0.22970269    0.00054241    0.00298227   -0.00210745
C    1.67250434   -1.16509730   -0.27781902    0.01339654    0.04869859    0.00489269
H    0.02667093    2.68745663   -0.15392110   -0.01196365    0.03234004   -0.00702498
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C    2.31428105    0.03458475    0.13308295    0.02890965   -0.00934507    0.00297487
H    3.37226282    0.02878376    0.33518258   -0.00666246    0.00352898    0.00363065
   15
   -420.52454241
H   -2.62392987    0.45901086   -0.08171808   -0.00688621   -0.00072265    0.00094667
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O   -1.93792672   -1.21017602    0.34033226   -0.02584323    0.00468164    0.00282856
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C   -0.75078801   -0.79274821    0.13682057    0.04799586    0.00399645    0.00619077
C    0.32279827    1.58917805   -0.01387650    0.04489824   -0.00066709    0.00518073
C    0.35645266   -1.68923107   -0.20396151   -0.01355843   -0.07103201   -0.00986074
C    1.65227268    1.23726814    0.23308952   -0.00443311   -0.01690835   -0.00134508
C    1.67329993   -1.16601904   -0.26879008    0.01965479    0.04564300    0.00422283
H    0.03066102    2.66408121   -0.13419110   -0.01045779    0.01760060   -0.00505318
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H    2.20033667    2.12658715    0.48360872   -0.01684965   -0.00374488   -0.00227025
H    2.31482836   -1.93351351   -0.67153503   -0.01563157    0.00433746   -0.00323768
C    2.31156351    0.04251498    0.12048596    0.01858787    0.00307487   -0.00022433
H    3.37425135    0.04011849    0.32873809   -0.00286928    0.00368126    0.00498116
   15
   -420.52429647
H   -2.60668284    0.48383277   -0.09909354    0.01148528    0.01856616   -0.00386286
O   -1.99956393    1.21436682   -0.27345313   -0.02615825   -0.01407351   -0.00392542
O   -1.93690595   -1.21606187    0.34192169   -0.02677772    0.00363769    0.00417017
C   -0.76520335    0.72276109   -0.04410578   -0.02094679    0.00397873    0.00685183
C   -0.75328145   -0.79564819    0.12979081    0.04798620   -0.00005972    0.00343938
C    0.32916256    1.59575103   -0.00820165    0.05039512    0.02879491    0.00206906
C    0.35817822   -1.68454930   -0.20378941   -0.00816701   -0.06108376   -0.00784216
C    1.64840647    1.22839329    0.23655960   -0.01131415   -0.03979508   -0.00099821
C    1.67293564   -1.16969466   -0.26001926    0.02024609    0.04119324    0.00403528
H    0.04192424    2.62876487   -0.11089441   -0.00477337   -0.00900818   -0.00192642
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H    2.30203090   -1.95047561   -0.64372422   -0.01923247    0.00530716   -0.00191381
C    2.30772840    0.05025288    0.10789964    0.00696609    0.01673255   -0.00284746
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   15
   -420.52275767
H   -2.59725230    0.49575204   -0.11382278    0.02217679    0.02990757   -0.00646890
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O   -1.93468337   -1.22211666    0.34332355   -0.02419567    0.00363065    0.00507216
C   -0.76252724    0.72640845   -0.04100137   -0.01831145    0.00561866    0.00816488
C   -0.75865145   -0.79853816    0.12254992    0.04285995   -0.00541340    0.00131416
C    0.33251695    1.60058050   -0.00264914    0.04867465    0.05774432   -0.00152563
C    0.36039383   -1.67618427   -0.20314413   -0.00196823   -0.04886255   -0.00558006
C    1.64521883    1.22190041    0.24008411   -0.01715399   -0.05786781    0.00048239
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H    0.05650990    2.60008869   -0.08619575    0.00258570   -0.03723905    0.00091144
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H    2.30274773   -1.97100209   -0.61440761   -0.01736442    0.00211912   -0.00266234
C    2.30345851    0.05698228    0.09548076   -0.00203697    0.02968896   -0.00452779
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   15
   -420.52523905
H   -2.60260375    0.48743086   -0.12417892    0.01419721    0.02091385   -0.00463187
O   -1.99859221    1.21840380   -0.27849146   -0.03102445   -0.01746391   -0.00438373
O   -1.93137685   -1.22833990    0.34449701   -0.01794144    0.00462135    0.00550576
C   -0.75876772    0.72971218   -0.03839133   -0.01096336    0.00802121    0.00958376
C   -0.76658700   -0.80109643    0.11522573    0.03246858   -0.01161283   -0.00005801
C    0.33293279    1.60203740    0.00298773    0.04567886    0.06342835   -0.00367738
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C    1.64305805    1.21885536    0.24357196   -0.02092197   -0.06570652    0.00344224
C    1.66901765   -1.18427706   -0.24327977    0.00196403    0.03255283    0.00620236
H    0.06950463    2.59695344   -0.06202493    0.00555382   -0.04472316    0.00171061
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H    2.24154072    2.15090841    0.39729971   -0.00146775    0.01897541   -0.00318057
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C    2.29928488    0.06193023    0.08333111   -0.00575201    0.03984330   -0.00529403
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   15
   -420.53111368
H   -2.61756046    0.46473519   -0.13131131   -0.00397786    0.00060760   -0.00092853
O   -1.99592023    1.22171825   -0.28075191   -0.01419594    0.00214639   -0.00867734
O   -1.92726809   -1.23477586    0.34542255   -0.00857970    0.00643521    0.00543182
C   -0.75436398    0.73252653   -0.03636088    0.00009581    0.01125873    0.01100285
C   -0.77646420   -0.80295050    0.10790108    0.01772369   -0.01814745   -0.00067016
C    0.33057969    1.59982502    0.00884085    0.04348219    0.03759135   -0.00469523
C    0.36480640   -1.65127922   -0.20093624    0.00994818   -0.02749432   -0.00292342
C    1.64215126    1.21972268    0.24684552   -0.02238550   -0.06136149    0.00762902
C    1.66654565   -1.19464517   -0.23543106   -0.01222455    0.02535679    0.00647650
H    0.07889478    2.62418976   -0.03899173    0.00237651   -0.02319941    0.00100713
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H    2.33669817   -2.01210131   -0.54864687   -0.00367015   -0.00913487   -0.00567810
C    2.29542860    0.06449131    0.07149923   -0.00347556    0.04547839   -0.00557270
H    3.37203268    0.06024220    0.25953241    0.00355388    0.00268738    0.00634293
   15
   -420.53434505
H   -2.62993202    0.44132575   -0.13769451   -0.01805408   -0.01571831    0.00157493
O   -1.99259076    1.22495289   -0.28262436   -0.00031664    0.01774572   -0.01158872
O   -1.92277663   -1.24150564    0.34610352    0.00251327    0.00872704    0.00486024
C   -0.74997392    0.73465737   -0.03499494    0.01269710    0.01502038    0.01224343
C   -0.78740128   -0.80370838    0.10061391    0.00060854   -0.02438492   -0.00068592
C    0.32561804    1.59539348    0.01498190    0.03724063    0.00062098   -0.00638737
C    0.36628929   -1.63602343   -0.19953395    0.01434805   -0.01994976   -0.00260129
C    1.64258323    1.22424494    0.24965347   -0.02085622   -0.04590734    0.01264488
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H    0.08659751    2.66760082   -0.01671719   -0.00145360    0.00765198    0.00072435
H    0.09670429   -2.66383064   -0.44549580   -0.00472072   -0.00118628   -0.00253238
H    2.28267325    2.11170005    0.35090732   -0.00099007    0.00628104   -0.00699422
H    2.36039239   -2.02492312   -0.51018441    0.00282259   -0.01146249   -0.00544911
C    2.29176039    0.06432879    0.06000510    0.00317269    0.04578578   -0.00597449
H    3.36305821    0.05987022    0.23013545   -0.00185811    0.00234669    0.00498512
   15
   -420.53400840
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   15
   -420.53343570
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C   -0.80838756   -0.80051245    0.08614669   -0.02989027   -0.03259817   -0.00036744
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C    1.64692580    1.24019300    0.25266456   -0.01139228   -0.00121228    0.02226681
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   15
   -420.53414164
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O   -1.91181623   -1.26442183    0.34698573    0.02645905    0.01217309    0.00280036
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C   -0.81661817   -0.79607022    0.07895209   -0.03816863   -0.03292807   -0.00097513
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C    0.36511696   -1.58486023   -0.19451932    0.01490742    0.00912500    0.00079715
C    1.65029701    1.24898784    0.25229403   -0.00975516    0.01405926    0.02526585
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   15
   -420.53393097
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O   -1.91019754   -1.27313838    0.34699360    0.02640637    0.00990042    0.00348104
C   -0.74574288    0.73223110   -0.03730306    0.03321781    0.02047386    0.01283085
C   -0.82257236   -0.78965314    0.07182140   -0.04014402   -0.02994268   -0.00255835
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C    0.36281705   -1.56796813   -0.19280737    0.01005396    0.02446066    0.00305906
C    1.65427939    1.25697731    0.25040386   -0.01210007    0.02059185    0.02659779
C    1.67601481   -1.25372193   -0.19942295   -0.02206163   -0.04236762   -0.00610820
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   15
   -420.53134521
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O   -1.90976153   -1.28229595    0.34683929    0.02228252    0.00540998    0.00530790
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C   -0.82612647   -0.78144298    0.06485028   -0.03662713   -0.02341736   -0.00509922
C    0.28532800    1.59345392    0.05477545   -0.03938059    0.00470442   -0.01565381
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C    2.26628950    0.03093113    0.00978923   -0.00802533   -0.00314026   -0.01361945
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   15
   -420.52903081
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O   -1.91032622   -1.29169222    0.34644041    0.01542194   -0.00090323    0.00811852
C   -0.75503915    0.72375739   -0.04313991    0.01885157    0.00905397    0.01025875
C   -0.82748341   -0.77183292    0.05819071   -0.02948552   -0.01364591   -0.00827192
C    0.28078268    1.59685096    0.06537200   -0.04773312    0.03493288   -0.01385299
C    0.35682178   -1.53940871   -0.19000715   -0.00391916    0.04676342    0.00430358
C    1.66458102    1.26922247    0.24182773   -0.01361155    0.02091099    0.02515235
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H    2.43650786   -2.04078272   -0.25618634    0.00322332    0.01108330    0.00613024
C    2.26076646    0.02194305    0.00187963   -0.01732923   -0.01459679   -0.01349065
H    3.36590267    0.03285256    0.00619382    0.00958328   -0.00035991   -0.00198260
   15
   -420.52936760
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C   -0.76163847    0.71850683   -0.04703132    0.00949309    0.00137780    0.00839550
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C    0.27908201    1.59827533    0.07680318   -0.04778473    0.03883791   -0.01136815
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C    1.67096385    1.27342780    0.23522563   -0.00728468    0.02085577    0.02307078
C    1.69894254   -1.26788882   -0.17530870    0.00461488   -0.03105576   -0.00397375
H    0.09071972    2.61378580    0.10105403    0.01740739   -0.04070928    0.00041805
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H    2.44146536   -2.06327834   -0.22392920    0.00800423    0.00430516    0.00616819
C    2.25627653    0.01383030   -0.00521759   -0.02370272   -0.02456083   -0.01266759
H    3.35939459    0.02727121   -0.03171557    0.00793746   -0.00094713   -0.00372887
   15
   -420.53020693
H   -2.59579495    0.44151069   -0.19275382   -0.01065974   -0.02028506    0.00093203
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O   -1.91317459   -1.31001988    0.34438452   -0.00107292   -0.01571483    0.01461287
C   -0.76880799    0.71317591   -0.05142872   -0.00067090   -0.00689952    0.00617495
C   -0.82541404   -0.75090283    0.04657260   -0.01089434    0.01183152   -0.01456297
C    0.28022286    1.59748701    0.08891969   -0.03847061    0.01699933   -0.00843155
C    0.35172049   -1.52162208   -0.18811554   -0.01554279    0.04379006   -0.00063057
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C    1.70666056   -1.26814947   -0.16667689    0.01248156   -0.01731054   -0.00210836
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H    0.18297152   -2.59931125   -0.30272306    0.01226076   -0.00501698   -0.00170089
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C    2.25320200    0.00719339   -0.01155033   -0.02651492   -0.03260617   -0.01150917
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   15
   -420.52846366
H   -2.61387344    0.44099513   -0.19609698   -0.01781788   -0.02555718    0.00122380
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C    0.35041376   -1.51680615   -0.18720007   -0.01877207    0.03467290   -0.00428148
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C    2.25171744    0.00251670   -0.01718744   -0.02666528   -0.03828119   -0.01024549
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   15
   -420.52546894
H   -2.61967005    0.45832590   -0.20028296   -0.01576121   -0.02130656    0.00084874
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O   -1.91585582   -1.32554334    0.33971373   -0.01588608   -0.02759266    0.01882088
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C   -0.82067541   -0.73280687    0.03842137    0.00621708    0.03579732   -0.01815650
C    0.28853414    1.59415911    0.11444249   -0.00783937   -0.01666691   -0.00005493
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C    1.71924905   -1.26625839   -0.14914252    0.03208173    0.00383943    0.00155011
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C    2.25184344    0.00014050   -0.02220561   -0.02643782   -0.04100989   -0.00882432
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   15
   -420.52382249
H   -2.61470302    0.49043508   -0.20502657   -0.00406508   -0.00753714   -0.00023885
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O   -1.91628003   -1.33155455    0.33614000   -0.02130339   -0.03115582    0.01948930
C   -0.78739658    0.70169244   -0.06619529   -0.03234588   -0.02889058   -0.00259482
C   -0.81861747   -0.72665135    0.03594503    0.01239725    0.04334569   -0.01838556
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C    1.69356261    1.27613642    0.19644378    0.03778063    0.02823987    0.01133598
C    1.72294456   -1.26536290   -0.14046090    0.04177376    0.00668353    0.00325993
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H    0.08601879   -2.55493696   -0.22522551    0.00344895    0.00969629    0.00248089
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H    2.38918103   -2.13893342   -0.13999548    0.00324226   -0.00830468    0.00626069
C    2.25357886    0.00022701   -0.02669227   -0.02822064   -0.04020544   -0.00698511
H    3.32185970    0.01639165   -0.14789968   -0.01310014   -0.00302542   -0.00728293
   15
   -420.52367568
H   -2.60725094    0.52751118   -0.20955815    0.01448566    0.01329672   -0.00190847
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O   -1.91574578   -1.33615808    0.33168520   -0.02455744   -0.03307190    0.01930146
C   -0.79050559    0.70083436   -0.07105456   -0.03820052   -0.03125842   -0.00565183
C   -0.81729750   -0.72309502    0.03457491    0.01619602    0.04645278   -0.01746869
C    0.29884809    1.59384083    0.13993411    0.01772265   -0.00123078    0.01046154
C    0.35320714   -1.51296171   -0.18209738   -0.01082960    0.01964910   -0.01314994
C    1.69503540    1.27269797    0.18453856    0.03734334    0.01959072    0.00581818
C    1.72412821   -1.26484335   -0.13197585    0.04854639    0.00400181    0.00485011
H   -0.07969410    2.67518082    0.16316101   -0.01893298    0.02888464   -0.00288487
H    0.04510124   -2.55079519   -0.20180663   -0.00248089    0.00656678    0.00329637
H    2.33715464    2.10197980    0.40314115   -0.01082875   -0.00621389    0.00370414
H    2.36239046   -2.14283530   -0.13039317   -0.00457406   -0.00302860    0.00583012
C    2.25703309    0.00272584   -0.03075914   -0.03228941   -0.03555744   -0.00463660
H    3.32894971    0.01841996   -0.16492186   -0.00956102   -0.00297291   -0.00800359
   15
   -420.52370614
H   -2.60989099    0.55535350   -0.21273951    0.02703820    0.02808863   -0.00313099
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O   -1.91410761   -1.33926694    0.32635721   -0.02507796   -0.03337845    0.01841806
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   15
   -420.52380878
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   15
   -420.52399607
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O   -1.90756897   -1.34101614    0.31326969   -0.01691950   -0.02922079    0.01478930
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   15
   -420.52632467
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O   -1.90303692   -1.33984550    0.30567478   -0.00866086   -0.02471347    0.01205555
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C   -0.82116087   -0.73452062    0.03808576    0.00142557    0.01745163   -0.00408979
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C    1.70153221   -1.26229193   -0.10182227    0.00960876   -0.00606355    0.01054226
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C    2.29143607    0.02869640   -0.04551945   -0.02033561    0.00312019    0.00059039
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   15
   -420.53005991
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C    1.67845104    1.25326301    0.12734762   -0.00385869   -0.01267385   -0.01509693
C    1.69200724   -1.26077367   -0.09565943   -0.00948951   -0.00565615    0.01207296
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   15
   -420.53181631
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O   -1.89328154   -1.33441774    0.28899697    0.01312613   -0.01234316    0.00528056
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C    1.67388662    1.25179728    0.11819001   -0.00877044   -0.00100905   -0.01320154
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   15
   -420.53128093
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O   -1.88903910   -1.33071610    0.28021886    0.02458086   -0.00599082    0.00192525
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C    0.35716976   -1.54929577   -0.13920796    0.01379009    0.00149448   -0.01481667
C    1.66984591    1.25039260    0.10982869   -0.01243578    0.01058632   -0.01088252
C    1.67555321   -1.25654784   -0.08560207   -0.03472740   -0.01250710    0.01434154
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C    2.32968831    0.04912350   -0.05643110    0.02816528    0.01893158   -0.00416383
H    3.40273437    0.07245759   -0.12381892   -0.00747675    0.00140565   -0.00162103
   15
   -420.52991706
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O   -1.88590654   -1.32673837    0.27135095    0.03456703   -0.00076298   -0.00077985
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   15
   -420.52983246
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O   -1.88433121   -1.32271882    0.26251445    0.04160489    0.00256263   -0.00242513
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   15
   -420.53073312
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C    1.66349371    1.24165197    0.08841368   -0.02906189    0.00566394   -0.00834219
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C    2.35506853    0.05989371   -0.06511660    0.03374430    0.02066962   -0.00885184
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   15
   -420.52838981
H   -2.64614122    0.54081120   -0.17282524   -0.00252105   -0.00594108    0.00049068
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O   -1.88693121   -1.31504729    0.24517535    0.04311601    0.00230644   -0.00205227
C   -0.77576233    0.73956485   -0.08591574    0.04319732    0.02338176   -0.00583729
C   -0.81357800   -0.77081780    0.04438738   -0.01457970   -0.02135930    0.01272062
C    0.27656369    1.51575224    0.21114713   -0.03501521   -0.00492871    0.01242110
C    0.34313657   -1.58479797   -0.09468912   -0.02953332    0.01654130   -0.00387253
C    1.66440340    1.23754852    0.08232436   -0.03073865   -0.00362003   -0.00729427
C    1.66678148   -1.23584158   -0.07573103   -0.02617106   -0.02500770    0.01246882
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C    2.35929848    0.06098946   -0.06706356    0.02967681    0.02013425   -0.01008649
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   15
   -420.52424277
H   -2.65341232    0.51414795   -0.16325336   -0.01366127   -0.02164882    0.00233532
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C   -0.78475909    0.73794599   -0.08410488    0.03253225    0.01715290   -0.00646060
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C    0.27389546    1.51384770    0.21311908   -0.04073069    0.02036196    0.01809213
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H    2.34070961    2.12215402    0.11604920    0.01488310    0.00777055   -0.00283342
H    2.37651075   -2.03758261   -0.17129476   -0.00124768    0.00963106   -0.00139546
C    2.36172640    0.06086988   -0.06840293    0.02699213    0.01910269   -0.01084295
H    3.46500921    0.09175530   -0.03219928    0.01275749    0.00394587    0.00567109
   15
   -420.52418880
H   -2.65142336    0.50242243   -0.15529772   -0.01528178   -0.02652674    0.00313715
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O   -1.89711556   -1.30770029    0.22816241    0.02913634   -0.00393707    0.00132305
C   -0.79570015    0.73529611   -0.08190072    0.01722632    0.00962813   -0.00760544
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   15
   -420.52649932
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C    0.34827742   -1.61819620   -0.05812521   -0.05050117   -0.02327137    0.00312904
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   15
   -420.52602230
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O   -1.91249250   -1.29966066    0.21091300    0.00889713   -0.00892055    0.00457036
C   -0.81952540    0.72869110   -0.07602235   -0.02198278   -0.00411396   -0.01053772
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C    0.35572268   -1.62795753   -0.04615770   -0.04847049   -0.04346739    0.00446939
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C    1.68460781   -1.19857037   -0.07783117   -0.01304897    0.03210975    0.00693311
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   15
   -420.52330663
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O   -2.02446611    1.32407655   -0.23428394   -0.01987300    0.01225668   -0.00803649
O   -1.92102192   -1.29508528    0.20201257    0.00006648   -0.00947935    0.00572187
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C   -0.78831319   -0.76834511    0.03002621    0.03798739    0.01820198    0.00022871
C    0.28412185    1.50202621    0.21194634   -0.00292662   -0.03848062    0.00371357
C    0.36607239   -1.63512965   -0.03446193   -0.04103464   -0.05587408    0.00607704
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C    2.35526777    0.05046228   -0.06733487    0.02035570    0.00298247   -0.00813945
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   15
   -420.52283523
H   -2.61173195    0.57499353   -0.14113185    0.03119362    0.02219194   -0.00093511
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O   -1.92956318   -1.29008523    0.19285356   -0.00643547   -0.00862544    0.00659219
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C    0.28902753    1.50267118    0.21053253    0.00918953   -0.03543488    0.00451594
C    0.37887555   -1.63898893   -0.02313684   -0.02800832   -0.05543296    0.00832129
C    1.69194541    1.22595410    0.05236277    0.02723410   -0.01271086   -0.00398990
C    1.69912115   -1.18756947   -0.08177633    0.00438346    0.04909257    0.00121947
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   15
   -420.52621013
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O   -1.93782266   -1.28469854    0.18339639   -0.01024400   -0.00647761    0.00719597
C   -0.84297295    0.72084272   -0.06232143   -0.06193089   -0.00810866   -0.01198331
C   -0.79013786   -0.77154982    0.02304338    0.03708383    0.02065154   -0.00432093
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C    0.39334698   -1.63954730   -0.01231600   -0.00996125   -0.04488309    0.01078109
C    1.69436044    1.22675511    0.04814348    0.02772018   -0.01989305   -0.00442011
C    1.70626188   -1.18630312   -0.08395003    0.01193777    0.05021999   -0.00170636
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   15
   -420.52885617
H   -2.67531904    0.57207918   -0.13534228   -0.00116879   -0.00351233    0.00143663
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C   -0.79446642   -0.77501638    0.01987695    0.03040215    0.01696530   -0.00621115
C    0.29670120    1.50941189    0.20664041    0.02149327    0.00225686    0.01373955
C    0.40840569   -1.63740596   -0.00214349    0.01109563   -0.03125620    0.01258951
C    1.69512086    1.22876560    0.04419079    0.02384975   -0.02829473   -0.00470237
C    1.71270363   -1.18805771   -0.08602280    0.01496022    0.04816807   -0.00416511
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H    2.24385828    2.16785204   -0.03490576   -0.00824642    0.00484220   -0.00722047
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C    2.33894638    0.03994936   -0.06129967   -0.01739877   -0.01586360   -0.00161103
H    3.43442889    0.02894238   -0.06560119    0.00561273   -0.00234356    0.00543200
   15
   -420.52791345
H   -2.71343561    0.56820857   -0.13343214   -0.01931558   -0.01536167    0.00211802
O   -2.01888853    1.31794138   -0.20920544    0.01819181    0.02842324   -0.00911600
O   -1.95291119   -1.27320837    0.16349256   -0.01109429    0.00126062    0.00746836
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C   -0.80061974   -0.77949569    0.01708482    0.02092134    0.01062705   -0.00783135
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C    1.71827399   -1.19272139   -0.08784734    0.01144845    0.04521602   -0.00590489
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   15
   -420.52728559
H   -2.73821424    0.57486060   -0.13298901   -0.02802256   -0.01827847    0.00185143
O   -2.01790411    1.31431547   -0.20200430    0.02128815    0.02836044   -0.00904565
O   -1.95969697   -1.26745403    0.15303354   -0.00935357    0.00631834    0.00713817
C   -0.83539354    0.71648398   -0.04246963   -0.04721577    0.00703754   -0.00589686
C   -0.80803040   -0.78460808    0.01476507    0.00983029    0.00237096   -0.00919282
C    0.29959005    1.51528278    0.19939159    0.01702948    0.04559506    0.02255674
C    0.43524245   -1.62808891    0.01589361    0.05046290   -0.01338131    0.01283694
C    1.69268703    1.23811854    0.03716566    0.01181970   -0.03036911   -0.00576219
C    1.72318163   -1.20011842   -0.08931803    0.00214665    0.04188181   -0.00700416
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H    2.41302044   -2.02841684   -0.14985632   -0.00735434    0.00556275    0.00140735
C    2.33156148    0.03701313   -0.05656689   -0.02277372   -0.02157567    0.00439315
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   15
   -420.53075028
H   -2.74349185    0.59413681   -0.13383941   -0.02529693   -0.01202671    0.00087801
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O   -1.96606105   -1.26198705    0.14225138   -0.00688529    0.01152026    0.00660077
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C    1.69020776    1.24556893    0.03415772    0.00625957   -0.02053567   -0.00663143
C    1.72796995   -1.21003859   -0.09036694   -0.00920783    0.03657245   -0.00775300
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H    2.43369607   -2.04104776   -0.14778277   -0.00095598   -0.00026738    0.00107961
C    2.32991340    0.03742976   -0.05450693   -0.01536388   -0.02123899    0.00706368
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   15
   -420.53409001
H   -2.73131460    0.62148568   -0.13529046   -0.01007818    0.00399743   -0.00063290
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O   -1.97211359   -1.25704096    0.13117008   -0.00417317    0.01620405    0.00598816
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C    0.29798849    1.51241150    0.18714670    0.02400053   -0.00293646    0.01320034
C    0.45032948   -1.61509508    0.03088482    0.06792151   -0.01583324    0.01025714
C    1.68734103    1.25423338    0.03155152    0.00246204   -0.00523929   -0.00763518
C    1.73330206   -1.22215184   -0.09094718   -0.01799326    0.02757772   -0.00844857
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C    2.32917686    0.03911989   -0.05287199   -0.00452981   -0.01869690    0.00930585
H    3.40534313    0.01203358   -0.17207684   -0.00333317   -0.00667843   -0.00034599
   15
   -420.53266518
H   -2.71238385    0.64556784   -0.13627988    0.01262021    0.02567386   -0.00213768
O   -2.01847438    1.29788814   -0.17809670   -0.03444677   -0.02027190   -0.00604070
O   -1.97797555   -1.25282610    0.11981695   -0.00176294    0.01979868    0.00544156
C   -0.80352898    0.70843681   -0.01955383   -0.00048103    0.01944176    0.00349847
C   -0.83106833   -0.79858772    0.01138333   -0.02213233   -0.02318915   -0.01164844
C    0.29516810    1.51026575    0.17964886    0.02334285   -0.03286478    0.00900662
C    0.45191738   -1.60725467    0.03740651    0.06593657   -0.01904063    0.00915890
C    1.68431429    1.26320690    0.02940700    0.00077667    0.01150825   -0.00861635
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H    2.30060655    2.15070881   -0.00029456   -0.00357583   -0.00349227   -0.00243224
H    2.47311171   -2.06281276   -0.14567326    0.00826048   -0.00618395    0.00031200
C    2.32872005    0.04193061   -0.05179911    0.00509481   -0.01413353    0.01135438
H    3.39383841    0.01832867   -0.20036660   -0.00894677   -0.00695309   -0.00127163
   15
   -420.53032826
H   -2.70185045    0.65180508   -0.13579275    0.02380338    0.03651681   -0.00260985
O   -2.01709677    1.29295556   -0.16950671   -0.04969732   -0.03102117   -0.00583950
O   -1.98375428   -1.24950375    0.10821650   -0.00022187    0.02189281    0.00503896
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   15
   -420.53189894
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   15
   -420.53407260
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   15
   -420.53302132
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   15
   -420.53005258
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   15
   -420.52930070
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   15
   -420.53110103
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   15
   -420.53056630
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C   -0.83301720   -0.78012504    0.03200608    0.00882749    0.01430730   -0.00461574
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   15
   -420.52806625
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O   -2.02093427   -1.25232308    0.00871453   -0.02969420   -0.00258580   -0.00116945
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C   -0.83039540   -0.77626319    0.03685919    0.01374586    0.02159346   -0.00213610
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   15
   -420.52832635
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   15
   -420.53155001
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   15
   -420.53447591
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C    1.66151492    1.27742942    0.04795833    0.00074312    0.00199259    0.00611687
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H    2.39934541   -2.13571140   -0.10099191   -0.00704177    0.00022845   -0.00067236
C    2.31695587    0.04839667   -0.11060205   -0.00537099   -0.00029478   -0.00669538
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   15
   -420.53478107
H   -2.55256115    0.35145481   -0.08293689   -0.01161394   -0.02317276   -0.00129107
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O   -2.01579294   -1.25727215   -0.04132844   -0.02530660   -0.01190206   -0.00727258
C   -0.77596077    0.68574411    0.03642654   -0.04135769   -0.02047517    0.00417701
C   -0.82753119   -0.77522752    0.05599814    0.00101105    0.01904634    0.00798421
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   15
   -420.53346399
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   15
   -420.53427201
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   15
   -420.53641485
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   15
   -420.53481661
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   15
   -420.53050015
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   15
   -420.52894022
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   15
   -420.53005347
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   15
   -420.53006334
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   15
   -420.52787272
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   15
   -420.52622782
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   15
   -420.52811725
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   15
   -420.53008665
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O   -1.92323748   -1.24608330   -0.15315809    0.02308501    0.00858297   -0.00597602
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C    0.32856412    1.60610316   -0.06367398   -0.01264519    0.02283878   -0.01856173
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   15
   -420.52802623
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   15
   -420.52541208
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O   -1.91240336   -1.24686781   -0.16631241    0.02793672    0.00840738   -0.00397619
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   15
   -420.52626076
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O   -1.90883196   -1.24783610   -0.17259661    0.03036085    0.00779262   -0.00330454
C   -0.75181597    0.68915636    0.04697625   -0.01929323   -0.05764637    0.00066044
C   -0.77792926   -0.76978433    0.02694261    0.02205746    0.01106945    0.00768149
C    0.34652844    1.60098770   -0.06738237    0.01771527   -0.01560248   -0.01495637
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C    1.75151278    1.30448971   -0.04456523    0.03719715    0.00571592    0.00289005
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   15
   -420.52865734
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O   -1.90663542   -1.24915666   -0.17872980    0.03204713    0.00686429   -0.00291270
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C   -0.77723905   -0.76447606    0.01885160    0.01867140    0.01682711    0.00554581
C    0.35104145    1.60064455   -0.06668217    0.02157090   -0.00784708   -0.01298791
C    0.30574909   -1.63345164    0.17150892   -0.04207355   -0.02256261    0.01179426
C    1.75587824    1.31633553   -0.05855522    0.03556141    0.01435275   -0.00151233
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C    2.26795734    0.04021823   -0.07307134   -0.01789724   -0.00902466   -0.00085674
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   15
   -420.52914043
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O   -1.90588644   -1.25078792   -0.18473000    0.03200561    0.00574202   -0.00274315
C   -0.76564931    0.69271768    0.04788684   -0.03075589   -0.05366993    0.00082646
C   -0.77767543   -0.76017210    0.01042521    0.01471437    0.01993216    0.00339535
C    0.35426669    1.60072131   -0.06519586    0.02208473    0.01059755   -0.01114183
C    0.31054238   -1.63388481    0.17217631   -0.02744893   -0.00822933    0.01145917
C    1.75810863    1.32732666   -0.07245312    0.03080251    0.02035594   -0.00603531
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H    2.29199269   -2.03882799    0.06491132   -0.01022952    0.00482375    0.00104499
C    2.26443718    0.03588646   -0.06222931   -0.02442371   -0.01957798    0.00374733
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   15
   -420.52742317
H   -2.58766891    0.29579650    0.04410969   -0.01670259   -0.02414011   -0.00159254
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O   -1.90658029   -1.25267942   -0.19060531    0.02950619    0.00450709   -0.00269727
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C   -0.77900401   -0.75706058    0.00179301    0.01119031    0.02043547    0.00133875
C    0.35616921    1.60012894   -0.06303384    0.02021379    0.03389351   -0.00962926
C    0.31698791   -1.63379352    0.17215425   -0.01130508    0.00107857    0.01042852
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C    1.61330317   -1.21686347    0.04930285   -0.01656920    0.00867100   -0.00531344
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H    2.45890688    2.18969318   -0.01955862    0.00902984    0.00946515    0.00769858
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C    2.26236540    0.03272550   -0.05161158   -0.02528792   -0.02751756    0.00788788
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   15
   -420.52719251
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O   -1.90860348   -1.25477514   -0.19635804    0.02453139    0.00319002   -0.00270211
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C   -0.78101402   -0.75517350   -0.00692118    0.00856680    0.01863077   -0.00052656
C    0.35683907    1.59755752   -0.06029039    0.02037952    0.04319066   -0.00788268
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H    2.28858481   -2.07304158    0.06713733   -0.01232639    0.00265741   -0.00032370
C    2.26179279    0.03121058   -0.04146669   -0.02019052   -0.03183364    0.01119580
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   15
   -420.53046730
H   -2.59040923    0.34630275    0.06096064   -0.00814260   -0.00812150   -0.00007795
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O   -1.91173326   -1.25701504   -0.20198796    0.01784430    0.00173593   -0.00275211
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C    0.35624243    1.59252475   -0.05707738    0.02680490    0.02414798   -0.00479985
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C    1.75474171    1.35137122   -0.11103060    0.02039297    0.04258125   -0.01583884
C    1.62670853   -1.23996057    0.06092078   -0.02363137    0.00442883   -0.00430031
H    0.04863921    2.59255266   -0.11803681    0.00749489   -0.03191408   -0.00065884
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   15
   -420.53239163
H   -2.58073956    0.38393362    0.06980354    0.00634898    0.01196451    0.00213069
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C   -0.78648892   -0.75452933   -0.02416238    0.00524689    0.00988135   -0.00336806
C    0.35401172    1.58610958   -0.05357978    0.03560106   -0.01024759   -0.00063757
C    0.33726510   -1.63359052    0.16858131    0.01815745   -0.01623243    0.00809507
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C    1.63542649   -1.25194866    0.06713587   -0.02569517    0.00245567   -0.00381332
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   15
   -420.53014926
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C    0.34965568    1.58028518   -0.05004249    0.03915646   -0.03970092    0.00334269
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C    1.74591438    1.35532381   -0.13230719    0.02215616    0.05922417   -0.01834547
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C    2.26507807    0.03790851   -0.01560816    0.00328964   -0.02087382    0.01690495
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   15
   -420.52829469
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O   -1.92471254   -1.26389365   -0.21809572   -0.00094809   -0.00376125   -0.00358218
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C   -0.79320370   -0.75623205   -0.04061659    0.00068780   -0.00099184   -0.00486144
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C    0.34642536   -1.62941561    0.16364053    0.01484671   -0.03716405    0.00915648
C    1.73953568    1.35218073   -0.14131435    0.02260160    0.06061899   -0.01865007
C    1.65735025   -1.27602913    0.08023423   -0.01757737   -0.01101182   -0.00306283
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H    2.35838979   -2.12909964    0.07962438    0.00145514   -0.01115037   -0.00391554
C    2.26629897    0.04315488   -0.00890026   -0.00004670   -0.01023336    0.01853048
H    3.33274631   -0.00221509   -0.14232129   -0.01070938    0.00153476   -0.00374683
   15
   -420.52933263
H   -2.60139794    0.41130050    0.08276223   -0.00045061    0.00995157    0.00212602
O   -2.01151469    1.18732781    0.18868642   -0.00793553   -0.03341383    0.00148719
O   -1.92929320   -1.26596267   -0.22316245   -0.00454233   -0.00574542   -0.00408614
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C   -0.79669934   -0.75715932   -0.04842233   -0.00246631   -0.00524869   -0.00524291
C    0.33425585    1.57668127   -0.04374695    0.02209706   -0.06095272    0.00847260
C    0.34957387   -1.62425180    0.16036065    0.01386251   -0.02950625    0.00765750
C    1.73180445    1.34541411   -0.14919895    0.02029960    0.05368129   -0.01788005
C    1.67006599   -1.28730475    0.08707188   -0.00755943   -0.02292681   -0.00274409
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   15
   -420.53043111
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O   -2.00752206    1.19327679    0.19628035    0.00646533   -0.01332452    0.00408450
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C   -0.74854022    0.76193624    0.04854851    0.02448689    0.06096083    0.00038923
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C    1.72285740    1.33543740   -0.15600980    0.01568717    0.03962460   -0.01563242
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   15
   -420.52964008
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O   -1.93773437   -1.26923179   -0.23271890   -0.00895403   -0.00945829   -0.00490363
C   -0.74439252    0.76185917    0.04828076    0.03639717    0.06178323   -0.00040111
C   -0.80307329   -0.75792580   -0.06306742   -0.00744270   -0.00865185   -0.00573110
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H   -0.02911516    2.61029722   -0.11015856   -0.00631226   -0.00965300   -0.00271980
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C    2.27211119    0.05932229    0.00432364   -0.02143843    0.03011895    0.01819373
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   15
   -420.52824315
H   -2.61511473    0.38297769    0.08394720   -0.02222992   -0.02045662   -0.00249027
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O   -1.94139099   -1.27026452   -0.23717219   -0.01074079   -0.01089180   -0.00504026
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C   -0.80565491   -0.75756129   -0.06987700   -0.00839058   -0.00736337   -0.00587301
C    0.30440841    1.59473503   -0.03804140   -0.02971202    0.00698043    0.00775116
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C    1.70240349    1.30932913   -0.16702017    0.00747797    0.00786357   -0.00829969
C    1.70802753   -1.30977821    0.10849448    0.02454207   -0.05333694   -0.00168677
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H    2.43918008   -2.10049163    0.13523864   -0.00179360    0.00597810   -0.00562864
C    2.27616591    0.06216002    0.00645617   -0.01955851    0.04019787    0.01571913
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   15
   -420.52957544
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O   -1.99804240    1.21287091    0.21769296    0.00469825    0.00250702    0.00604270
O   -1.94456081   -1.27080498   -0.24139761   -0.01236688   -0.01178222   -0.00495242
C   -0.74289904    0.75100531    0.04785296    0.03931811    0.04156982   -0.00147673
C   -0.80773426   -0.75676088   -0.07633176   -0.00832757   -0.00418980   -0.00594557
C    0.29665934    1.60242230   -0.03715131   -0.03533644    0.02687876    0.00734179
C    0.35455394   -1.59676220    0.14495408   -0.00336166    0.02554118   -0.00504350
C    1.69138297    1.29507962   -0.17165387    0.00593572   -0.00218252   -0.00501029
C    1.71848415   -1.31146307    0.11586831    0.02775259   -0.05348550   -0.00159841
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H    2.33379759    2.16815872   -0.40947766    0.00476916    0.01257344   -0.00777401
H    2.46243825   -2.09771236    0.15888481    0.00271853    0.00402386   -0.00522047
C    2.28137223    0.06258868    0.00764027   -0.01149164    0.04595030    0.01278120
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   15
   -420.53310925
H   -2.55582839    0.42262089    0.09135201    0.00907823    0.00400258    0.00019603
O   -1.99563064    1.21918978    0.22427679   -0.00885639   -0.00835357    0.00406892
O   -1.94717162   -1.27081337   -0.24539902   -0.01342388   -0.01200751   -0.00467753
C   -0.74573724    0.74143860    0.04775870    0.03173084    0.02296078   -0.00193732
C   -0.80931255   -0.75571477   -0.08242704   -0.00776068    0.00052659   -0.00601359
C    0.29098741    1.60861928   -0.03670936   -0.02948552    0.02148884    0.00766552
C    0.35519810   -1.59236114    0.14149917   -0.01407083    0.02100122   -0.00430808
C    1.67999612    1.28093192   -0.17597814    0.00587805   -0.00629870   -0.00297001
C    1.72728324   -1.30993547    0.12334071    0.02685602   -0.04924515   -0.00187457
H    0.01738983    2.62545445   -0.07310027    0.00440861   -0.02519391   -0.00067221
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H    2.31689059    2.13980721   -0.44409683    0.00164178    0.00784187   -0.00848482
H    2.48364088   -2.09769785    0.18625860    0.00878855   -0.00013534   -0.00429396
C    2.28725301    0.06026245    0.00805070    0.00053205    0.04695039    0.00998427
H    3.36469206   -0.04063732   -0.02629355   -0.00602701   -0.01390450    0.00324034
   15
   -420.53405010
H   -2.52921890    0.44375031    0.09550770    0.02721586    0.02068693    0.00244987
O   -1.99282042    1.22588991    0.23067698   -0.02112385   -0.01922918    0.00192554
O   -1.94917748   -1.27027932   -0.24918861   -0.01338953   -0.01161375   -0.00429876
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C   -0.81042005   -0.75470567   -0.08815825   -0.00749019    0.00626463   -0.00617288
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C    0.35668977   -1.58918996    0.13829473   -0.02405909    0.00862753   -0.00160785
C    1.66824929    1.26714057   -0.18011565    0.00666109   -0.00558415   -0.00231506
C    1.73446756   -1.30543937    0.13092808    0.02404383   -0.04302343   -0.00246168
H    0.02586558    2.67646738   -0.05991814   -0.00085198    0.00554829   -0.00085700
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H    2.29892192    2.10598936   -0.47269178   -0.00345336    0.00015976   -0.00777728
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C    2.29310747    0.05511872    0.00785420    0.01131261    0.04354188    0.00779452
H    3.36200829   -0.01379787   -0.00782081   -0.01342974   -0.01130597    0.00438874
   15
   -420.53270054
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O   -1.98910175    1.23340136    0.23697959   -0.02068884   -0.01465665    0.00236659
O   -1.95058114   -1.26922012   -0.25278315   -0.01196847   -0.01073353   -0.00391288
C   -0.75651498    0.71941553    0.04796331    0.01096662   -0.01790101   -0.00340992
C   -0.81106920   -0.75407661   -0.09351548   -0.00824619    0.01222005   -0.00646835
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C    0.35961892   -1.58652613    0.13518343   -0.03053634   -0.00636365    0.00185115
C    1.65610284    1.25367771   -0.18410937    0.00674518   -0.00307506   -0.00238494
C    1.74019734   -1.29834312    0.13866503    0.02127850   -0.03639312   -0.00318868
H    0.03480803    2.72397656   -0.04617339   -0.00383804    0.02884115   -0.00017426
H    0.10076717   -2.59869490    0.35841107    0.00581433    0.01514228    0.00353954
H    2.28343681    2.07206406   -0.49572998   -0.00844629   -0.00760057   -0.00638389
H    2.50372943   -2.09480103    0.24929880    0.01596093   -0.00563418   -0.00165726
C    2.29831484    0.04736201    0.00718261    0.01493002    0.03598453    0.00633604
H    3.36852447    0.02114192    0.00752899   -0.01317299   -0.00794252    0.00492880
   15
   -420.53223545
H   -2.53500525    0.44386551    0.09918171    0.01947242    0.00470916   -0.00089148
O   -1.98449881    1.24151135    0.24316292   -0.00645154    0.00654598    0.00579012
O   -1.95144620   -1.26767523   -0.25620001   -0.00938819   -0.00947506   -0.00356492
C   -0.76322206    0.70940342    0.04835063    0.00233085   -0.03477131   -0.00430920
C   -0.81121459   -0.75418227   -0.09848098   -0.00996127    0.01729252   -0.00686982
C    0.28220648    1.62285126   -0.03804175   -0.00406660   -0.00146977    0.00465419
C    0.36436415   -1.58351129    0.13196713   -0.03101621   -0.01470354    0.00401401
C    1.64356420    1.24041092   -0.18796197    0.00376311   -0.00250098   -0.00185262
C    1.74463369   -1.28904602    0.14659457    0.01978142   -0.02968515   -0.00387788
H    0.04634630    2.75151746   -0.03233340   -0.00399445    0.03905856    0.00101672
H    0.13927120   -2.59742080    0.33970788    0.01021759    0.02094511    0.00161585
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H    2.49760663   -2.08810831    0.28310433    0.01447787   -0.00447058   -0.00060685
C    2.30266326    0.03745189    0.00612493    0.01007558    0.02384383    0.00548016
H    3.38400959    0.06173413    0.01935066   -0.00458473   -0.00347719    0.00511098
   15
   -420.53246013
H   -2.56242159    0.43343022    0.10095825    0.00277503   -0.01385917   -0.00421826
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O   -1.95188674   -1.26570167   -0.25945498   -0.00643663   -0.00784801   -0.00325049
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C   -0.81075730   -0.75532352   -0.10303087   -0.01172218    0.02033747   -0.00730205
C    0.28034447    1.62760590   -0.03917023   -0.00089511    0.01056160    0.00292640
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C    1.63082156    1.22731553   -0.19171102   -0.00374323   -0.00577214    0.00023840
C    1.74786512   -1.27795680    0.15475819    0.01994937   -0.02228350   -0.00447105
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H    0.17064090   -2.61044338    0.31969384    0.01097525    0.01413433    0.00204353
H    2.27168362    2.02295949   -0.52831077   -0.00845870   -0.01087813   -0.00670282
H    2.48125018   -2.07834842    0.31737972    0.00982797   -0.00080636   -0.00010476
C    2.30642187    0.02612351    0.00473284    0.00133001    0.00699954    0.00523201
H    3.40261012    0.10474923    0.02750361    0.00713246    0.00226167    0.00508350
   15
   -420.53170301
H   -2.59209076    0.43246142    0.10567092   -0.00991720   -0.02430848   -0.00596099
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O   -1.95203255   -1.26337360   -0.26256260   -0.00418461   -0.00579636   -0.00290657
C   -0.77666978    0.69634641    0.04994678   -0.01040962   -0.05340029   -0.00528176
C   -0.80959664   -0.75768108   -0.10713942   -0.01243760    0.02066618   -0.00768860
C    0.27854962    1.63167136   -0.04047793   -0.00032384    0.03266406    0.00164921
C    0.37905383   -1.57523503    0.12483693   -0.01567856    0.00173300    0.00297513
C    1.61832295    1.21458246   -0.19547992   -0.01466114   -0.01157623    0.00335033
C    1.74988469   -1.26552842    0.16319234    0.02113108   -0.01303937   -0.00510388
H    0.07613810    2.72659197   -0.00768166    0.00221580    0.02009081    0.00292592
H    0.19423618   -2.63315720    0.29815289    0.00955975   -0.00064978    0.00339494
H    2.27539249    2.01012864   -0.53759356   -0.00300295   -0.00617737   -0.00888653
H    2.45791740   -2.06807328    0.35176413    0.00352542    0.00391203   -0.00012648
C    2.31009002    0.01438830    0.00302042   -0.00559129   -0.01313510    0.00573397
H    3.41625856    0.14610894    0.03201024    0.01589514    0.00844183    0.00480237
   15
   -420.52911690
H   -2.61502596    0.44846519    0.11457947   -0.01575636   -0.02580296   -0.00608137
O   -1.97185804    1.26064993    0.25959179    0.03070416    0.04181257    0.01082475
O   -1.95198271   -1.26078402   -0.26553861   -0.00344613   -0.00335537   -0.00250071
C   -0.78263157    0.69442121    0.05121175   -0.01605904   -0.05376545   -0.00483105
C   -0.80769217   -0.76127400   -0.11078337   -0.01150564    0.01810897   -0.00799772
C    0.27678429    1.63371756   -0.04188990   -0.00170055    0.06291835    0.00124472
C    0.38809608   -1.57089906    0.12097044   -0.00473155    0.01359646    0.00264864
C    1.60671359    1.20254682   -0.19944904   -0.02614709   -0.01693168    0.00603446
C    1.75062961   -1.25232763    0.17193758    0.02163941   -0.00059953   -0.00621129
H    0.08996337    2.68773279    0.00180759    0.00761767   -0.00764496    0.00275281
H    0.21097332   -2.65547254    0.27421706    0.00764840   -0.01446295    0.00396920
H    2.28123519    2.00172775   -0.54049345    0.00298877   -0.00110293   -0.01081650
H    2.43200104   -2.06053611    0.38624457   -0.00208304    0.00728848   -0.00019748
C    2.31407008    0.00345017    0.00095758   -0.00736928   -0.03378365    0.00695157
H    3.41885241    0.18144540    0.03307521    0.01819377    0.01367970    0.00422290
   15
   -420.52618133
H   -2.62709602    0.48254692    0.12777969   -0.01344021   -0.01873784   -0.00470562
O   -1.96987692    1.26355558    0.26411348    0.03035578    0.03267045    0.00858950
O   -1.95177001   -1.25804298   -0.26840138   -0.00440134   -0.00070736   -0.00205021
C   -0.78762488    0.69571664    0.05276531   -0.02108746   -0.04795122   -0.00367174
C   -0.80510047   -0.76594864   -0.11394402   -0.00888515    0.01287057   -0.00822054
C    0.27512043    1.63197921   -0.04338099   -0.00272540    0.08823070    0.00151331
C    0.39742630   -1.56735543    0.11693766    0.00588125    0.01963634    0.00351863
C    1.59667593    1.19152199   -0.20377525   -0.03576385   -0.01970888    0.00719434
C    1.75007815   -1.23910802    0.18106324    0.01977211    0.01520087   -0.00823838
H    0.09835773    2.65435200    0.00935661    0.01196583   -0.03412236    0.00192688
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   15
   -420.52577644
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   15
   -420.52624950
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   15
   -420.52499009
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C   -0.79508041   -0.78270921   -0.12042351    0.00326866   -0.01274028   -0.00816155
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C    1.58076096    1.16527160   -0.21904562   -0.04346670   -0.01320498    0.00091604
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C    2.32969135   -0.01155045   -0.01237282    0.03217003   -0.06072176    0.00965499
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   15
   -420.52421301
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C    1.58070860    1.15837900   -0.22448435   -0.03936960   -0.01289269   -0.00213330
C    1.73911690   -1.20433912    0.22406666   -0.00182357    0.05136531   -0.01316322
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C    2.33049584   -0.00607349   -0.01718485    0.02948510   -0.05022937    0.00688391
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   15
   -420.52462965
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C    0.42948691   -1.56015513    0.09133443    0.03323787   -0.01374088    0.00939914
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C    2.32958114    0.00241551   -0.02240509    0.01446305   -0.03455932    0.00251085
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   15
   -420.52536663
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O   -1.94284365   -1.24470856   -0.28406703   -0.01303457    0.01155725   -0.00120680
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C    1.73281101   -1.20404511    0.25011981   -0.00489792    0.02776421   -0.00268472
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H    2.33176244   -2.04947143    0.58175815   -0.00881004   -0.00188099    0.00450878
C    2.32781186    0.01296765   -0.02777224   -0.00457139   -0.01374770   -0.00286236
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   15
   -420.52578160
H   -2.74690972    0.61503372    0.22500659   -0.03406486   -0.00969623    0.00096924
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O   -1.93944135   -1.24386668   -0.28647974   -0.01181495    0.01279809   -0.00104810
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C    0.26016416    1.54059434   -0.05406685   -0.01911543   -0.02158592    0.00389316
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C    1.73007620   -1.20683294    0.26357102   -0.00319286    0.01208004    0.00479604
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H    2.33436066   -2.03709559    0.59542145   -0.01084823    0.00287720    0.00269590
C    2.32629763    0.02433602   -0.03296485   -0.01951919    0.01000515   -0.00851094
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   15
   -420.52519229
H   -2.73045419    0.61852510    0.23426022   -0.02410812   -0.00409669    0.00168408
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C   -0.79542715    0.73455184    0.06685026    0.02299140    0.05538400   -0.00031607
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C    0.25909083    1.53011664   -0.05577884   -0.02803432    0.00238798    0.00614406
C    0.42688282   -1.55355358    0.06991577    0.02904951    0.03044439    0.00111209
C    1.60150012    1.14428328   -0.24418805   -0.01997341   -0.06224724   -0.00504045
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H    0.05109835    2.56427060   -0.01434715    0.00104076   -0.02443617    0.00078697
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H    2.34462864   -2.02666060    0.60709276   -0.01055604    0.00547860    0.00170320
C    2.32592222    0.03510437   -0.03764509   -0.02620225    0.03272850   -0.01368005
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   15
   -420.52442576
H   -2.69736500    0.62442635    0.24227831   -0.00239294    0.01027066    0.00275519
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O   -1.93114394   -1.24396501   -0.29117808   -0.00609811    0.01441319   -0.00031893
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C   -0.78505902   -0.78404994   -0.12124191    0.01787360   -0.03866632   -0.00385205
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C    1.61050028    1.14790274   -0.24839058   -0.01368385   -0.06934732   -0.00591063
C    1.72504512   -1.21388733    0.28918552    0.00047620   -0.00806158    0.01755614
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H    2.36229352   -2.01995269    0.61744968   -0.00694133    0.00453029    0.00214460
C    2.32708006    0.04391992   -0.04150368   -0.02265514    0.05018970   -0.01771388
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   15
   -420.52555581
H   -2.66263738    0.62281990    0.24832329    0.02010354    0.02584068    0.00360079
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O   -1.92650876   -1.24497845   -0.29349622   -0.00147002    0.01480861    0.00013316
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C    0.26217947    1.50783140   -0.06036256   -0.02775436    0.01227116    0.00686517
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C    1.72253690   -1.21694503    0.30058276    0.00050316   -0.01066830    0.02173884
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H    2.38480092   -2.01635027    0.62620025   -0.00076305    0.00100810    0.00357478
C    2.32955546    0.04974235   -0.04429876   -0.00879161    0.05928645   -0.02021389
H    3.42069191    0.00958856   -0.06279826    0.00327218   -0.01012203    0.00139516
   15
   -420.52785753
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O   -1.99880238    1.29832194    0.30980858   -0.02438321   -0.01217018    0.00214962
O   -1.92181080   -1.24666250   -0.29582020    0.00416554    0.01487042    0.00050815
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C    0.26631854    1.49549972   -0.06328168   -0.01756726   -0.01530470    0.00604132
C    0.40986267   -1.56026468    0.04817257   -0.00163337    0.01580828   -0.01256446
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C    1.72000083   -1.21936950    0.31066926    0.00002076   -0.01086873    0.02512610
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C    2.33253133    0.05202644   -0.04587932    0.01094672    0.05905673   -0.02111546
H    3.39770824   -0.01236637   -0.07813140   -0.01450643   -0.01117073    0.00134503
   15
   -420.52803183
H   -2.63689622    0.56711163    0.25318101    0.01187257    0.00638648    0.00147063
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O   -1.91730370   -1.24901937   -0.29816651    0.01028494    0.01443701    0.00069279
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C   -0.79248819   -0.75591326   -0.11785220    0.00850959   -0.00860598   -0.00092117
C    0.27151800    1.48407746   -0.06656679   -0.00678033   -0.04056459    0.00529888
C    0.40348214   -1.56530643    0.04207432   -0.01179033   -0.00379617   -0.01630153
C    1.64112777    1.18216534   -0.25842248    0.00123189   -0.03085007   -0.01204341
C    1.71746023   -1.22113783    0.31923693    0.00017345   -0.01079402    0.02832526
H    0.04058402    2.57754899   -0.06675411   -0.00398322    0.01636240   -0.00090818
H    0.15305640   -2.60894560    0.09265683    0.00320697    0.00999409   -0.00362787
H    2.20647364    2.09908012   -0.33200758   -0.00920305   -0.00260119    0.01075011
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C    2.33486910    0.05077766   -0.04619112    0.02589405    0.05109595   -0.02033811
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   15
   -420.52570833
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C   -0.79634466   -0.74448412   -0.11652402    0.00303329    0.00800588    0.00052599
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   15
   -420.52380904
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   15
   -420.52343704
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O   -1.90754573   -1.25980117   -0.30537978    0.02288466    0.00994251    0.00033186
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C    1.67180514    1.23265348   -0.26201390   -0.00015485    0.02168408   -0.01540860
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   15
   -420.52265628
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O   -1.90617850   -1.26440639   -0.30782479    0.02310048    0.00780042    0.00021484
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C    1.68185760    1.24799334   -0.26138126   -0.00389529    0.02955776   -0.01407185
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   15
   -420.52008143
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O   -1.90585304   -1.26936536   -0.31027963    0.02163215    0.00561526    0.00012818
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C    1.69213447    1.26154996   -0.25990122   -0.00545907    0.03648733   -0.01202071
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   15
   -420.51840362
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O   -1.90650598   -1.27457945   -0.31274006    0.01931757    0.00351487   -0.00000879
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C   -0.81434731   -0.71355605   -0.11223261   -0.00497670    0.05935655    0.00533992
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C    1.69655646   -1.21632105    0.32936604    0.00922990   -0.00408190    0.03221668
H    0.05055870    2.47117625   -0.12180335    0.01315050   -0.04537143    0.00041614
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   15
   -420.52143434
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O   -1.90803485   -1.27995378   -0.31519970    0.01683835    0.00160695   -0.00024815
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C    1.71349635    1.28157382   -0.25488142    0.00263666    0.05229841   -0.00847690
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H    0.03767251    2.48418151   -0.12901782    0.00862382   -0.03226888    0.00046465
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C    2.33068047    0.00813207   -0.02863614    0.00687339   -0.05289899    0.00623907
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   15
   -420.52554372
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O   -1.91032806   -1.28540210   -0.31764771    0.01443218   -0.00002445   -0.00058470
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C    1.72409316    1.28709095   -0.25155193    0.01196992    0.05995813   -0.00778751
C    1.68533573   -1.21069064    0.31643214   -0.00363773    0.01114507    0.02236159
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C    2.33027786    0.00853157   -0.02635684    0.02159144   -0.05466329    0.00475758
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   15
   -420.52569730
H   -2.71727099    0.55868145    0.25858936   -0.01472727   -0.00681069    0.00151351
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C    2.32861380    0.01220593   -0.02436353    0.02755309   -0.05021721    0.00288980
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   15
   -420.52477042
H   -2.75223313    0.55701067    0.25451060   -0.03085353   -0.01512608    0.00093249
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O   -1.91676275   -1.29623729   -0.32244765    0.00904105   -0.00255323   -0.00129547
C   -0.80462712    0.71248105    0.10965602   -0.00150243    0.01726756    0.00756019
C   -0.82329401   -0.74328524   -0.11333920   -0.00459388    0.01047551   -0.00241646
C    0.31649152    1.48092463   -0.10589587    0.00875551   -0.06943946   -0.00209606
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C    1.74244894    1.28704721   -0.24349842    0.03226866    0.06165260   -0.00610819
C    1.67485966   -1.20745338    0.29804380   -0.01066346    0.01234635    0.01436564
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C    2.32536773    0.01888731   -0.02254730    0.01734987   -0.03970858    0.00138872
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   15
   -420.52660297
H   -2.76573206    0.56563408    0.24972224   -0.03437781   -0.01340837    0.00103380
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O   -1.92065831   -1.30150830   -0.32476743    0.00570508   -0.00372668   -0.00161903
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C    1.74900816    1.28142015   -0.23889246    0.03790836    0.04868703   -0.00200534
C    1.67050329   -1.20697448    0.28743219   -0.01028212    0.00588759    0.01183413
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C    2.32112914    0.02793885   -0.02081314   -0.00389098   -0.02297212   -0.00049738
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   15
   -420.52957998
H   -2.75529636    0.58332492    0.24413436   -0.02414708   -0.00179184    0.00215184
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O   -1.92481170   -1.30660970   -0.32701373    0.00210630   -0.00503420   -0.00194850
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C   -0.82614100   -0.76549234   -0.11356706    0.00083133   -0.01495761   -0.00584883
C    0.32196096    1.50622985   -0.11254169    0.00624251   -0.04746828   -0.00452055
C    0.37109362   -1.56102519    0.07536177    0.01769365   -0.00123787   -0.00853779
C    1.75329377    1.27289704   -0.23418035    0.03987256    0.02623663    0.00501280
C    1.66676008   -1.20683671    0.27610129   -0.00819216   -0.00347741    0.00999926
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H    0.07602662   -2.59590274    0.20819683   -0.00488846    0.00519483    0.00020151
H    2.36323057    2.06725856   -0.64336151   -0.00083866   -0.00563956   -0.00702124
H    2.28844540   -2.05420373    0.54976062   -0.00798528   -0.00269167    0.00101889
C    2.31712300    0.03835219   -0.01904249   -0.02484497   -0.00086831   -0.00359511
H    3.42549502    0.00296838   -0.09104147    0.01335274    0.00240712   -0.00218408
   15
   -420.52923657
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   15
   -420.52551815
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   15
   -420.52532519
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O   -1.93726881   -1.32026478   -0.33314749   -0.00544795   -0.00991354   -0.00337511
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   15
   -420.52926113
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C    1.74601747    1.23826692   -0.22265238    0.04069406   -0.04910848    0.02220889
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   15
   -420.53024450
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   15
   -420.52830433
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C    0.33533473    1.59760244   -0.12203081    0.01228621    0.00174730   -0.00537514
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   15
   -420.52819865
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C    1.71582398    1.23637278   -0.22626636    0.01699843   -0.02122916    0.00573900
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   15
   -420.53001890
H   -2.56194504    0.42123126    0.12521937   -0.00266020   -0.01717089   -0.00721247
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   15
   -420.52938225
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   15
   -420.52442961
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O   -1.95988562   -1.33142384   -0.34040394   -0.00520198   -0.02581624   -0.00887355
C   -0.74130506    0.71478116    0.09071612   -0.00273571   -0.02626786    0.00935158
C   -0.85260294   -0.78851174   -0.09099915   -0.01670336    0.00314425   -0.00240273
C    0.33525993    1.64049240   -0.12011558    0.01001907    0.05583946   -0.00460771
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   15
   -420.51965762
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O   -1.96244383   -1.32913248   -0.34012509   -0.00684314   -0.02752727   -0.00997696
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C    0.33335213    1.64637022   -0.11905698    0.00590564    0.08231781   -0.00559305
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C    1.66824916    1.25158495   -0.23505533   -0.04555998   -0.00089624   -0.01385809
C    1.65985791   -1.17617732    0.15412996    0.00500162    0.02716549   -0.01706482
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C    2.33315925    0.01126500    0.03031488    0.00196237   -0.05575098    0.02224895
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   15
   -420.52027104
H   -2.46901734    0.40506859    0.11828408    0.02561526    0.00274653   -0.00342452
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C    0.33107130    1.64740534   -0.11767336    0.00472377    0.08280788   -0.00405050
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C    1.66119875    1.25610092   -0.23594442   -0.04969745    0.00432697   -0.01949308
C    1.66124728   -1.17646702    0.14762718    0.00411928    0.03492963   -0.01746288
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H    2.36940327   -1.98139501    0.28893706    0.00195600    0.01250812   -0.00214394
C    2.33317458    0.00663680    0.03306185    0.01556967   -0.06693225    0.02536754
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   15
   -420.52345237
H   -2.49919539    0.38574394    0.11994846    0.00668809   -0.01440100   -0.00694347
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O   -1.96656628   -1.32074312   -0.33814848   -0.00979196   -0.02971073   -0.01265910
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   15
   -420.52388081
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O   -1.96799300   -1.31454909   -0.33633021   -0.01204653   -0.02939410   -0.01391589
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C    1.65588821    1.26393910   -0.23389990   -0.04001333    0.01730934   -0.02799224
C    1.66351409   -1.18370476    0.13777246   -0.00279713    0.04260885   -0.01631205
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   15
   -420.52357084
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O   -1.96886918   -1.30702635   -0.33388172   -0.01533386   -0.02773126   -0.01484839
C   -0.72426161    0.72263815    0.05133341    0.01698905    0.00971739    0.00055313
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C    0.32179144    1.62830991   -0.11307304    0.01171692   -0.00718512    0.00683326
C    0.31954151   -1.57602601    0.20964135   -0.00891863   -0.02679201    0.01935004
C    1.65706099    1.26649879   -0.23045870   -0.02991639    0.02056585   -0.02959808
C    1.66478577   -1.19109860    0.13434894   -0.00414143    0.03884897   -0.01439307
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H    2.37619442   -2.03563009    0.21146513    0.00925451   -0.00375158   -0.00334526
C    2.32279412    0.01700045    0.03186225    0.05430592   -0.05395317    0.02563881
H    3.36865969    0.07627619    0.03661587   -0.02904932    0.00487018    0.00034412
   15
   -420.52663983
H   -2.57824752    0.40973235    0.15586814   -0.02044882   -0.01957737   -0.00437988
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O   -1.96904702   -1.29825007   -0.33076134   -0.01929842   -0.02477238   -0.01531981
C   -0.72278099    0.72511925    0.04296936    0.01752560    0.02203683   -0.00053904
C   -0.83865299   -0.78053703   -0.06772546   -0.01179589    0.01084226    0.00692598
C    0.31743593    1.62045474   -0.11210760    0.01022519   -0.01933135    0.00792576
C    0.32189208   -1.57850626    0.21283744   -0.00828432   -0.02509448    0.01859852
C    1.66004554    1.26785004   -0.22523763   -0.02021300    0.01686042   -0.02918619
C    1.66629289   -1.20081354    0.13179247   -0.00252830    0.02942217   -0.01180087
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H    2.36643644   -2.05317585    0.18990264    0.00654617   -0.00513672   -0.00423176
C    2.31332706    0.02767588    0.02829649    0.03454958   -0.03852427    0.02300146
H    3.37834053    0.08174245    0.03530320   -0.01417299    0.00520573    0.00045482
   15
   -420.53126938
H   -2.57941381    0.44907400    0.17612905   -0.01047095   -0.00384026   -0.00037141
O   -1.91493336    1.18726481    0.30495136    0.03868565   -0.02266691    0.00188020
O   -1.96835038   -1.28835378   -0.32694773   -0.02295210   -0.02074427   -0.01531334
C   -0.72234730    0.72627547    0.03463710    0.01550793    0.03276245   -0.00147471
C   -0.83240119   -0.78222998   -0.06470252   -0.00388067    0.00518986    0.00868928
C    0.31247419    1.61370327   -0.11161522    0.00616337   -0.01825496    0.00771404
C    0.32473519   -1.57953264    0.21491938   -0.00605377   -0.01107429    0.01580864
C    1.66426138    1.26822499   -0.21826004   -0.01214385    0.00468801   -0.02704715
C    1.66793966   -1.21228322    0.12994805    0.00167245    0.01512813   -0.00887040
H    0.01963412    2.71426346   -0.16400854   -0.00816530    0.03015552   -0.00338647
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H    2.35212424   -2.06721158    0.17138641    0.00119350   -0.00344941   -0.00510530
C    2.30181085    0.04065664    0.02334580    0.00660013   -0.01825373    0.01914394
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   15
   -420.53225492
H   -2.57367039    0.49068074    0.19662761    0.00936033    0.01956187    0.00405594
O   -1.91352090    1.18297849    0.29963794    0.02151994   -0.04992630   -0.00342910
O   -1.96661829   -1.27751933   -0.32244086   -0.02502578   -0.01588369   -0.01489019
C   -0.72284585    0.72546468    0.02639470    0.01235993    0.04063602   -0.00254430
C   -0.82591195   -0.78423348   -0.06220316    0.00348112   -0.00112353    0.01007036
C    0.30715612    1.60798722   -0.11158444   -0.00115293   -0.00361157    0.00655060
C    0.32794095   -1.57990981    0.21605038   -0.00313695    0.00710727    0.01199776
C    1.66921400    1.26834576   -0.20965337   -0.00450767   -0.01326841   -0.02355728
C    1.66947923   -1.22465453    0.12864015    0.00700600   -0.00174586   -0.00594960
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H    2.30022941    2.15615911   -0.19319265   -0.00560514    0.00311519    0.00772952
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C    2.28987377    0.05472028    0.01724165   -0.01741218    0.00610920    0.01442872
H    3.41286917    0.08176395    0.03147241    0.02199454    0.00367956    0.00108388
   15
   -420.52887682
H   -2.57441269    0.51858356    0.21432387    0.02434910    0.03612087    0.00654615
O   -1.91309289    1.18092553    0.29446982    0.00709400   -0.06828076   -0.00606390
O   -1.96376068   -1.26596702   -0.31725969   -0.02446737   -0.01025231   -0.01410970
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C   -0.81962217   -0.78617018   -0.06030996    0.00864451   -0.00720026    0.01088139
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C    0.33133886   -1.58069652    0.21645394   -0.00066064    0.02146200    0.00851869
C    1.67443318    1.26927127   -0.19962678    0.00425488   -0.03168862   -0.01911652
C    1.67060170   -1.23692600    0.12769344    0.01101215   -0.01744928   -0.00330182
H   -0.02220074    2.61289656   -0.12468200   -0.00115237   -0.02051452   -0.00025194
H    0.04432049   -2.64637516    0.37806175   -0.00997505   -0.01364042    0.00392180
H    2.30828113    2.16926318   -0.18374039   -0.00106866    0.00922984    0.00703020
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C    2.27894411    0.06840699    0.01026620   -0.03239764    0.03190165    0.00945226
H    3.41264202    0.07741634    0.02851247    0.02700000    0.00183087    0.00141824
   15
   -420.52683574
H   -2.59116983    0.52197857    0.22749917    0.01568429    0.02918636    0.00609004
O   -1.91307366    1.18186875    0.28956204    0.01398223   -0.06120052   -0.00497537
O   -1.95980461   -1.25395276   -0.31143963   -0.02081148   -0.00376903   -0.01298947
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C   -0.81383907   -0.78767727   -0.05907155    0.01060471   -0.01213863    0.01103410
C    0.29739968    1.59565181   -0.11262840   -0.02112684    0.03894201    0.00423120
C    0.33478108   -1.58274209    0.21633579    0.00094319    0.02811467    0.00631771
C    1.67938984    1.27208697   -0.18844609    0.01397071   -0.04488090   -0.01427069
C    1.67107717   -1.24816695    0.12694842    0.01130966   -0.02831940   -0.00105198
H   -0.04003261    2.57349975   -0.10417059    0.00388957   -0.04339453    0.00017719
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H    2.31721604    2.17594417   -0.17932969    0.00161574    0.01169324    0.00598870
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C    2.26991894    0.08017705    0.00271674   -0.03637932    0.05512624    0.00494332
H    3.39361299    0.07174796    0.02453758    0.02122703    0.00002000    0.00164463
   15
   -420.52836795
H   -2.61828304    0.50523561    0.23632278   -0.00813805    0.00783603    0.00498490
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O   -1.95491523   -1.24177045   -0.30503139   -0.01424267    0.00349860   -0.01153602
C   -0.72824435    0.70766288    0.00298495    0.00739929    0.03945478   -0.00838535
C   -0.80868106   -0.78845935   -0.05849708    0.00933549   -0.01524757    0.01050423
C    0.29410532    1.58665050   -0.11356268   -0.02179244    0.03082282    0.00297779
C    0.33817137   -1.58644398    0.21582698    0.00150315    0.02602624    0.00582042
C    1.68350557    1.27756698   -0.17640128    0.02290959   -0.04819064   -0.00962628
C    1.67089071   -1.25772605    0.12626913    0.00731236   -0.03317313    0.00077403
H   -0.06020307    2.56367515   -0.08377390    0.00165002   -0.03965111    0.00042718
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C    2.26303153    0.08864798   -0.00513730   -0.02802177    0.07143836    0.00153793
H    3.35991796    0.06602739    0.01938918    0.00517429   -0.00116845    0.00169082
   15
   -420.52930311
H   -2.63992587    0.48257383    0.24150877   -0.02635969   -0.00969611    0.00460227
O   -1.91591662    1.19089918    0.28030160    0.04688645   -0.01570617   -0.00011397
O   -1.94938783   -1.22974839   -0.29810101   -0.00549970    0.01116723   -0.00974364
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C   -0.80407513   -0.78833131   -0.05855467    0.00558125   -0.01595288    0.00933418
C    0.29208393    1.57589426   -0.11466884   -0.01387899    0.00178297    0.00019085
C    0.34147657   -1.59167980    0.21495778    0.00090585    0.01603457    0.00699176
C    1.68624882    1.28590178   -0.16377115    0.02926813   -0.03975654   -0.00559191
C    1.67027546   -1.26530028    0.12554543    0.00067188   -0.03379678    0.00212440
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C    2.25778732    0.09284889   -0.01309096   -0.00988111    0.07778857   -0.00057889
H    3.32289456    0.06109341    0.01303448   -0.01711355   -0.00145814    0.00156234
   15
   -420.52784939
H   -2.64339191    0.46629894    0.24336350   -0.03136600   -0.01742595    0.00452035
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O   -1.94361488   -1.21823274   -0.29072955    0.00430347    0.01874622   -0.00768315
C   -0.73420061    0.68401630   -0.01028239    0.00565426    0.01249839   -0.01400377
C   -0.79980023   -0.78725253   -0.05917437    0.00053232   -0.01386328    0.00768597
C    0.29089494    1.56502311   -0.11578073   -0.00435548   -0.02663168   -0.00372819
C    0.34473040   -1.59786503    0.21366072   -0.00029123    0.00222766    0.00911615
C    1.68724172    1.29659337   -0.15079957    0.03167727   -0.02196584   -0.00218767
C    1.66962021   -1.27083757    0.12469587   -0.00611146   -0.03295309    0.00295105
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H    0.06558230   -2.61359696    0.40627857   -0.00045000    0.01447765    0.00053722
H    2.33911655    2.15614142   -0.18815021   -0.00350005   -0.00450066    0.00210782
H    2.35187228   -2.13765026    0.14631170   -0.00022326   -0.01364526   -0.00513721
C    2.25314862    0.09239648   -0.02101384    0.00642641    0.07400857   -0.00186652
H    3.29786807    0.05717495    0.00555026   -0.03371814   -0.00119003    0.00151340
   15
   -420.52767790
H   -2.62504811    0.46198470    0.24197596   -0.02329139   -0.01518402    0.00425167
O   -1.92647701    1.20323862    0.27106423    0.03349757    0.00380987    0.00462435
O   -1.93803655   -1.20756518   -0.28300985    0.01393974    0.02567323   -0.00552070
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C   -0.79555802   -0.78534929   -0.06025780   -0.00442475   -0.00899174    0.00581242
C    0.28998274    1.55570154   -0.11666747    0.00264452   -0.04333345   -0.00763219
C    0.34799675   -1.60420560    0.21181556   -0.00046256   -0.00743890    0.01059714
C    1.68634506    1.30859633   -0.13769436    0.02883501   -0.00075050    0.00097061
C    1.66932515   -1.27437991    0.12367050   -0.01104008   -0.03244619    0.00324355
H   -0.10270077    2.62841541   -0.02926449   -0.01796274    0.02714769    0.00588878
H    0.07919201   -2.60946640    0.40885427    0.00306948    0.02253885   -0.00107194
H    2.34870690    2.14894411   -0.19534692   -0.00496039   -0.00991961    0.00096768
H    2.36689177   -2.13441815    0.15644488    0.00271540   -0.01504319   -0.00443443
C    2.24820619    0.08750777   -0.02882419    0.00667474    0.06228749   -0.00304282
H    3.29593984    0.05412360   -0.00304793   -0.03137790   -0.00103145    0.00184391
   15
   -420.52966360
H   -2.59061931    0.46797977    0.23754025   -0.00387304   -0.00265556    0.00378385
O   -1.93426685    1.20932497    0.26618571    0.01065028   -0.00031157    0.00688857
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C   -0.74136771    0.65764468   -0.02018847   -0.00305961   -0.02867387   -0.01842705
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   15
   -420.52980530
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   15
   -420.52686432
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O   -1.92647739   -1.18351150   -0.25868736    0.03228731    0.03851918   -0.00094691
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C    1.67263289   -1.27313313    0.11949241   -0.00800267   -0.03242843    0.00166912
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   15
   -420.52331361
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O   -1.92527095   -1.17878920   -0.25042135    0.03332304    0.03943165   -0.00070915
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C   -0.77449692   -0.77687988   -0.06708479   -0.00578772    0.02015097    0.00012485
C    0.28426429    1.54287240   -0.11417134   -0.01108032    0.00619870   -0.01170127
C    0.35975695   -1.62801327    0.19884757    0.00822305    0.01643732    0.00442775
C    1.67171602    1.34714123   -0.08817089   -0.01415912    0.05226649    0.01739063
C    1.67493764   -1.26877585    0.11783840   -0.00390454   -0.02787921    0.00031623
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   15
   -420.52132778
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C   -0.75129285    0.63367776   -0.02618958   -0.01039164   -0.07544499   -0.02160133
C   -0.76811048   -0.77676149   -0.06898487   -0.00078282    0.02298200   -0.00072903
C    0.28333538    1.54208410   -0.11172213   -0.01796244    0.01874248   -0.01131845
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C    1.66858857    1.35042893   -0.07776097   -0.01781056    0.06025964    0.02080788
C    1.67748731   -1.26275913    0.11616910   -0.00146648   -0.01812776   -0.00180601
H   -0.00844752    2.52630719   -0.01487782    0.01780869   -0.04393550    0.00129251
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   15
   -420.52227202
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C   -0.76168851   -0.77801458   -0.07084081    0.00655442    0.02215801   -0.00156447
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   15
   -420.52348315
H   -2.57970573    0.39520312    0.16637418   -0.01422120   -0.02694188    0.00052524
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O   -1.93020452   -1.17510424   -0.22535420    0.01942281    0.03305878   -0.00197227
C   -0.75249793    0.64686161   -0.02152356    0.00076242   -0.05580928   -0.01987270
C   -0.75567323   -0.78059139   -0.07260172    0.01591105    0.01808427   -0.00245506
C    0.28456254    1.53844666   -0.10464783   -0.01084838   -0.02832801   -0.01494824
C    0.36472746   -1.65176962    0.18531916   -0.00420136   -0.01724700    0.01017287
C    1.66542054    1.34568585   -0.06083096   -0.01187390    0.07130855    0.02400981
C    1.68284584   -1.24833525    0.11334564   -0.00090633    0.01106454   -0.00800353
H   -0.00807899    2.57922971   -0.02648815    0.00627640   -0.00333859    0.00373230
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C    2.24163123    0.01447082   -0.07549013    0.00833768   -0.06163672   -0.00681676
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   15
   -420.52389120
H   -2.58540751    0.40731791    0.15095889   -0.01351727   -0.02281881    0.00028098
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C    1.66504195    1.33700631   -0.05450673   -0.00648267    0.07045013    0.02422510
C    1.68560431   -1.24165920    0.11255937    0.00037728    0.02378364   -0.01073911
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H    3.28914142    0.02295082   -0.12585140   -0.03356241    0.00091847    0.00107836
   15
   -420.52648176
H   -2.58185971    0.43534005    0.13530744   -0.00474808   -0.00988691    0.00058571
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O   -1.93825083   -1.18033560   -0.20824941    0.00005037    0.02582177   -0.00173181
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C    0.28838498    1.54122528   -0.09405931    0.00034358   -0.06406649   -0.01486871
C    0.36877119   -1.66397209    0.17351975   -0.01385230   -0.04137595    0.01325945
C    1.66506564    1.32410941   -0.04964631   -0.00303649    0.06098238    0.02415307
C    1.68833110   -1.23639562    0.11241546    0.00337833    0.03140576   -0.01211238
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   15
   -420.53074501
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O   -1.98113029    1.24158376    0.19943734   -0.02469221    0.00492051    0.00987641
O   -1.94250672   -1.18479178   -0.19957409   -0.00877042    0.02248445   -0.00119840
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C   -0.74586671   -0.79322773   -0.07673019    0.04336974   -0.00370935   -0.00605136
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C    0.37191470   -1.66663290    0.16645118   -0.01307998   -0.03513171    0.01124107
C    1.66528641    1.30757745   -0.04624561   -0.00210282    0.04108742    0.02383859
C    1.69084780   -1.23299839    0.11299441    0.00751200    0.03249451   -0.01158096
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   15
   -420.53338150
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O   -1.94637448   -1.19026986   -0.19084474   -0.01500970    0.01957901   -0.00055836
C   -0.75624750    0.70453031    0.00067562    0.00246664    0.01348872   -0.00665923
C   -0.74717257   -0.79762001   -0.07748021    0.04654972   -0.01087747   -0.00772497
C    0.29225678    1.55831379   -0.07993987    0.00431294   -0.04112835   -0.01149745
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C    1.66563560    1.28860342   -0.04428308   -0.00140339    0.01275882    0.02279095
C    1.69291017   -1.23153406    0.11426376    0.01162886    0.02722151   -0.00909292
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C    2.25020822    0.02622296   -0.09358441   -0.03167629   -0.03015506   -0.00540293
H    3.35790785   -0.00191337   -0.18515928    0.01365808   -0.00427504   -0.00361447
   15
   -420.53388009
H   -2.59208563    0.50548973    0.08160788    0.01796195    0.02640014    0.00337617
O   -1.98380361    1.23682212    0.17830308   -0.02522272   -0.02230102    0.00430829
O   -1.94957397   -1.19663832   -0.18209027   -0.01788634    0.01720216    0.00014265
C   -0.75778693    0.71945818    0.00780127    0.00013148    0.02628892   -0.00291270
C   -0.75126725   -0.80136167   -0.07776177    0.04448491   -0.01662345   -0.00963484
C    0.29384717    1.57105134   -0.07178094    0.00100696   -0.00877655   -0.01003546
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C    1.66605647    1.26887526   -0.04369288    0.00180770   -0.01901694    0.02055059
C    1.69427759   -1.23169561    0.11607626    0.01404127    0.01795194   -0.00528228
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H    2.44462664   -1.97385552    0.34629885   -0.00235639    0.00908235    0.00404152
C    2.25405065    0.03601685   -0.09714835   -0.04473477   -0.00360217   -0.00499191
H    3.38093317   -0.00599078   -0.20172827    0.02487223   -0.00617700   -0.00532260
   15
   -420.53240468
H   -2.62009271    0.49574448    0.05931625   -0.00122535    0.00958779    0.00088107
O   -1.98333163    1.23576076    0.16738779   -0.00283626   -0.01109065    0.00483778
O   -1.95197481   -1.20378929   -0.17334255   -0.01734350    0.01534443    0.00091588
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C   -0.75802603   -0.80410667   -0.07746017    0.03720383   -0.02064633   -0.01162820
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   15
   -420.53099436
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   15
   -420.53134269
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   15
   -420.53095316
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   15
   -420.53013705
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   15
   -420.53111215
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O   -1.95629649   -1.24871891   -0.13096951    0.00688886    0.00746951    0.00423685
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C    1.65495720    1.21432384   -0.05854264    0.00115054   -0.04677045    0.00145038
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C    2.31480451    0.05187712   -0.10869493    0.02933893    0.05467771   -0.01505192
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   15
   -420.53286448
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O   -1.95720685   -1.25904994   -0.12298323    0.00902528    0.00432337    0.00416676
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C    0.30320772    1.63452979   -0.00312103    0.01054418   -0.00709189    0.00491357
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C    1.65059985    1.21817351   -0.06224101   -0.01601943   -0.03411045   -0.00031535
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   15
   -420.53409930
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O   -1.95851856   -1.26957252   -0.11518485    0.00900813   -0.00006092    0.00380247
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C    1.64720730    1.22408976   -0.06592153   -0.03241801   -0.02216718   -0.00184721
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   15
   -420.53324935
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O   -1.96023115   -1.28008712   -0.10755819    0.00690656   -0.00578037    0.00320391
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   15
   -420.53060889
H   -2.55810260    0.39266368   -0.08035435   -0.00175174   -0.01494439   -0.00608521
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C   -0.82964378   -0.77334936   -0.03621521   -0.03634653    0.00304265   -0.00845074
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C    1.64687013    1.23919823   -0.07288047   -0.04655263    0.00284621   -0.00387188
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H    2.37767554   -2.09206618    0.24160570   -0.00815758    0.00787842   -0.00124795
C    2.34269347    0.00355652   -0.10097070    0.00938534   -0.02369181   -0.01035401
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   15
   -420.53052188
H   -2.56531240    0.36706497   -0.08714099   -0.00839032   -0.02473470   -0.00741316
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O   -1.96439222   -1.30002098   -0.09270293   -0.00286755   -0.01917365    0.00145729
C   -0.76521331    0.75310327    0.06516404    0.01671950   -0.00612757    0.01196862
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C    0.30133156    1.65657576    0.03431522   -0.02063590    0.06986320    0.00356954
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C    1.72422154   -1.25501102    0.11834894    0.00696944   -0.00247925    0.01832612
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H    2.37818495   -2.10427607    0.22450404   -0.00646813    0.00622445   -0.00119977
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H    3.44893382    0.11834217   -0.17876255    0.01527022    0.01140092   -0.00313232
   15
   -420.53242773
H   -2.56684604    0.35879817   -0.08869149   -0.00898234   -0.02630099   -0.00702342
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O   -1.96639958   -1.30883885   -0.08539521   -0.00989233   -0.02516517    0.00035788
C   -0.76700937    0.75032302    0.06644023    0.01920553   -0.01004938    0.01151934
C   -0.82640597   -0.76081966   -0.01894484   -0.01763239    0.01271117   -0.00256100
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C    0.36694396   -1.58179201    0.03987497   -0.01038539   -0.00460013   -0.01323403
C    1.65718411    1.25360298   -0.07892226   -0.03177316    0.02802515   -0.00502362
C    1.73055990   -1.25664259    0.11347487    0.01243090    0.00483629    0.01714258
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H    0.17224612   -2.65136442    0.14357747    0.00552023   -0.00387265    0.00257023
H    2.41096112    2.04241727   -0.09137420    0.00868323   -0.00771544    0.00409166
H    2.38319023   -2.12073147    0.20823666   -0.00203604    0.00072059   -0.00067016
C    2.35270002   -0.01699792   -0.09315556    0.04378495   -0.04464737   -0.01141776
H    3.41825831    0.10809385   -0.15822153   -0.00838847    0.00894546   -0.00062256
   15
   -420.53216214
H   -2.56223914    0.36902831   -0.08526400   -0.00401827   -0.02033906   -0.00528707
O   -2.02296044    1.24841155    0.02475462   -0.00193009    0.02927677    0.00010016
O   -1.96795626   -1.31652024   -0.07810335   -0.01739030   -0.02974745   -0.00083612
C   -0.76994839    0.74814223    0.06702117    0.01804528   -0.01230543    0.01078662
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   15
   -420.53123890
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C   -0.77396232    0.74669834    0.06695092    0.01367300   -0.01307816    0.00982521
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   15
   -420.53210778
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   15
   -420.53370550
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O   -1.96676419   -1.33104327   -0.05578814   -0.03154838   -0.03415202   -0.00402746
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C   -0.81393340   -0.74504919    0.01607906    0.03000169    0.00869560    0.00771135
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C    1.69523974    1.26061728   -0.08699913    0.00165759    0.01940056   -0.00635732
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   15
   -420.53443208
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O   -1.96370498   -1.33282048   -0.04804295   -0.03080903   -0.03308260   -0.00468253
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H    2.38476824   -2.15008605    0.12833533   -0.00060306   -0.00079676    0.00016483
C    2.33338201   -0.01895496   -0.06251914   -0.02781229   -0.03624211   -0.00590313
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   15
   -420.53269055
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O   -1.95925873   -1.33310145   -0.04008618   -0.02719387   -0.03072071   -0.00510355
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C   -0.81561584   -0.74094250    0.03137845    0.03022686   -0.00007389    0.01060716
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C    1.71503304    1.25520339   -0.08875181    0.01275749   -0.00836379   -0.00507461
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   15
   -420.52976901
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O   -1.95358760   -1.33199397   -0.03189863   -0.02117436   -0.02690448   -0.00530748
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C    1.72395761    1.25283851   -0.08914845    0.02113831   -0.01555605   -0.00546213
C    1.73521281   -1.28223957    0.05567474    0.03336726   -0.02926076    0.00497643
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   15
   -420.52932028
H   -2.68661127    0.43263452   -0.02632838   -0.02600574   -0.01935357    0.00155067
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O   -1.94696283   -1.32967140   -0.02347100   -0.01324750   -0.02162203   -0.00531910
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C    1.72757177   -1.28396089    0.04525961    0.02020363   -0.03339764    0.00198030
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C    2.32469688    0.00723370   -0.03915647   -0.02592547    0.01059970   -0.00244035
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   15
   -420.52957981
H   -2.69193035    0.44769950   -0.01967957   -0.02415589   -0.01642031    0.00212323
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C    2.32564485    0.01593173   -0.03097165   -0.00282223    0.02114802   -0.00098751
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   15
   -420.52738664
H   -2.68047932    0.47400996   -0.01450534   -0.01191518   -0.00388007    0.00179763
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C   -0.80924132    0.74730514    0.05058147   -0.01779586    0.01788241    0.00099898
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C    1.74100141    1.25088543   -0.08791727    0.04235972   -0.00221778   -0.01176488
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C    2.32677812    0.02337206   -0.02272748    0.01695094    0.02755822    0.00057650
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   15
   -420.52500098
H   -2.66094469    0.50261510   -0.01054177    0.00808098    0.01639183    0.00017326
O   -2.04410748    1.24322114   -0.08480893   -0.01269622   -0.03294222   -0.00768746
O   -1.92526089   -1.31802706    0.00322391    0.01736015   -0.00156859   -0.00457268
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C    1.70163770   -1.27742364    0.01404229   -0.02938080   -0.02724803   -0.00643005
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C    2.32699492    0.02915679   -0.01452166    0.01609642    0.03162150    0.00285469
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   15
   -420.52555726
H   -2.64694492    0.51970803   -0.00668422    0.02302516    0.03130035   -0.00160919
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C   -0.84271271   -0.72336000    0.06063064   -0.03891750   -0.00450542    0.01241476
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C    0.38773835   -1.50619970   -0.00281678    0.04476484    0.01260059    0.00053744
C    1.74059445    1.25122715   -0.08387433    0.03424086   -0.00034374   -0.01256161
C    1.69528559   -1.27173719    0.00420827   -0.03685994   -0.02599335   -0.00806643
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H    2.37691681   -2.14084803   -0.00260059    0.00657340   -0.00884867    0.00243045
C    2.32634181    0.03304039   -0.00649609   -0.00449398    0.03331093    0.00658323
H    3.39062415   -0.05767045   -0.06429263   -0.01481322   -0.00781122    0.00368692
   15
   -420.52859539
H   -2.64828019    0.51564261   -0.00182672    0.01841880    0.02459349   -0.00089674
O   -2.04627926    1.24839101   -0.10234064   -0.02490966   -0.03785443   -0.00712736
O   -1.91388574   -1.30932164    0.02208161    0.03538860    0.00717150   -0.00405244
C   -0.81017899    0.73721504    0.04149890   -0.00790117    0.01144241   -0.00001700
C   -0.84318496   -0.71893618    0.06284710   -0.04471231    0.00214019    0.01196388
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   15
   -420.53020234
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   15
   -420.52854678
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   15
   -420.52716686
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   15
   -420.52863507
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   15
   -420.52910140
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   15
   -420.52615245
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   15
   -420.52474523
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   15
   -420.52827178
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C    0.33826682   -1.57416489   -0.02895920   -0.06080136   -0.02942237    0.00094548
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   15
   -420.53250161
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   15
   -420.53327153
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C   -0.78665074   -0.75887184    0.05734777    0.05134886    0.00477774   -0.00335178
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C    1.69322678   -1.18597317   -0.07621586    0.00623983    0.03057189    0.00340178
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   15
   -420.53225777
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O   -1.94604418   -1.26805442    0.13543216    0.00268421    0.00303828    0.00284039
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C   -0.79049879   -0.77238549    0.05620878    0.04382650   -0.00843703   -0.00419137
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H    3.49998409    0.08092448   -0.12215417    0.03081255    0.00418198   -0.00709310
   15
   -420.53343146
H   -2.66904666    0.48536220   -0.12045880   -0.02193598   -0.02141102    0.00021901
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O   -1.95199445   -1.26372607    0.14573707    0.00431908    0.00781938    0.00330640
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C   -0.79697505   -0.78539657    0.05532077    0.03184935   -0.02013922   -0.00453417
C    0.31348214    1.52016239    0.10647087    0.02518211    0.03660366    0.01432769
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   15
   -420.53656222
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O   -1.95814168   -1.25975232    0.15589294    0.00619938    0.01258637    0.00346946
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   15
   -420.53645876
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C   -0.81478456   -0.80720735    0.05435634    0.00162109   -0.03720042   -0.00403985
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C    2.37927964    0.05272635   -0.00426927    0.05072909    0.02181799    0.00384621
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   15
   -420.53321148
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O   -1.97135550   -1.25369176    0.17573546    0.00901306    0.01929639    0.00340116
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C   -0.82430861   -0.81498016    0.05425128   -0.01287285   -0.04165100   -0.00346757
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C    1.67164970    1.21502166    0.09619877    0.00307293   -0.02706397   -0.00335096
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   15
   -420.53326641
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O   -1.97854507   -1.25190499    0.18542362    0.00870145    0.02011310    0.00363576
C   -0.78270529    0.71124992   -0.01877307   -0.00417003    0.02003239    0.00473571
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   15
   -420.53647174
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C   -0.77432091    0.70894847   -0.02382704    0.00785575    0.02148517    0.00579787
C   -0.84034151   -0.82295471    0.05463631   -0.03299578   -0.04027578   -0.00249064
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C    1.70835833   -1.21944687   -0.13186085   -0.03401525    0.00360929    0.00575088
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   15
   -420.53703585
H   -2.64908480    0.53768708   -0.21469868   -0.01286173   -0.00750455   -0.00512031
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O   -1.99397343   -1.25099314    0.20427094    0.00130315    0.01586099    0.00534381
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C    0.27087715    1.57576262    0.04453405   -0.02904216   -0.00228676   -0.00660200
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C    1.71845123   -1.22633368   -0.14141310   -0.01855544   -0.00286813    0.00272188
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C    2.35667774    0.04899073   -0.03201825    0.00314394    0.00372756   -0.01039997
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   15
   -420.53427531
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O   -2.00187508   -1.25167742    0.21335325   -0.00610413    0.01134760    0.00669129
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C    1.66594823    1.25069802    0.17339626   -0.01179631   -0.01624371    0.01635795
C    1.72964703   -1.23304597   -0.15112805    0.00067092   -0.00948293   -0.00067715
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C    2.34720583    0.04661228   -0.03801662   -0.00872717   -0.00399325   -0.01531083
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   15
   -420.53161646
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O   -1.95575651    1.26858153   -0.17594414    0.03384061    0.02093253    0.00361452
O   -2.00949367   -1.25287355    0.22213156   -0.01514695    0.00602038    0.00813469
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C    0.26018793    1.59441391    0.02406860   -0.06330337    0.03988862   -0.01493739
C    0.41000244   -1.60475748   -0.06785177    0.03247486    0.01664198   -0.00189158
C    1.66569659    1.26263239    0.19097327   -0.01116821   -0.00438900    0.02203816
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C    2.33820842    0.04447494   -0.04309255   -0.00988498   -0.01161267   -0.01952251
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   15
   -420.53136422
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O   -2.01642321   -1.25434229    0.23054116   -0.02466433    0.00056990    0.00946876
C   -0.75080472    0.68811405   -0.04789655    0.02602454    0.00162163    0.00628293
C   -0.84907014   -0.81375845    0.05729650   -0.02137008   -0.00517778   -0.00361008
C    0.26008665    1.60085330    0.01507435   -0.06797057    0.04579295   -0.01818429
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C    1.66609974    1.27481008    0.20721569   -0.00646142    0.01184851    0.02805383
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C    2.32975558    0.04303325   -0.04699521   -0.00043311   -0.01790763   -0.02226081
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   15
   -420.53027534
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O   -2.02223680   -1.25583882    0.23852191   -0.03335494   -0.00438090    0.01058305
C   -0.74880691    0.68150291   -0.05491402    0.01998703   -0.00862127    0.00529328
C   -0.84704646   -0.80911584    0.05843109   -0.01234129    0.00532614   -0.00413924
C    0.26404400    1.60463283    0.00718172   -0.06245485    0.03098847   -0.02167912
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C    1.66687591    1.28626236    0.22176189    0.00164554    0.02974249    0.03396559
C    1.75901999   -1.24923585   -0.17933681    0.03913437   -0.00769532   -0.00819956
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H    2.38443152    2.09089409    0.39154000    0.00867287   -0.00388538   -0.00128841
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C    2.32128480    0.04266217   -0.04956177    0.01743344   -0.02173973   -0.02301778
H    3.39076855    0.05407384    0.07401788   -0.00895307   -0.00230926    0.00313091
   15
   -420.52509568
H   -2.57971330    0.55080972   -0.20862179    0.02665036    0.02669537   -0.00311427
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O   -2.02654445   -1.25713976    0.24602345   -0.04007820   -0.00846801    0.01143978
C   -0.74800836    0.67541227   -0.06225058    0.01202341   -0.01867174    0.00409209
C   -0.84427240   -0.80478824    0.05981518   -0.00410531    0.01442553   -0.00446656
C    0.27174534    1.60657028    0.00059851   -0.05031207    0.00961515   -0.02478203
C    0.39015669   -1.61518447   -0.07327885   -0.01202583   -0.01325667    0.00358245
C    1.66754930    1.29593000    0.23425890    0.01026454    0.04474419    0.03884353
C    1.76483124   -1.25342772   -0.18792238    0.04262275   -0.00371297   -0.01017180
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H    2.38918931    2.06991856    0.42166664    0.00244274   -0.01350657   -0.00280840
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C    2.31176582    0.04358980   -0.05074322    0.03358958   -0.02241146   -0.02246843
H    3.35201164    0.07420678    0.08189370   -0.03093337   -0.00064995    0.00109536
   15
   -420.52090671
H   -2.57301524    0.54104997   -0.19743256    0.02633086    0.02529403   -0.00333302
O   -1.94603696    1.25630294   -0.18370884   -0.01140240   -0.01836742    0.00264884
O   -2.02904385   -1.25806056    0.25300681   -0.04410106   -0.01148110    0.01205490
C   -0.74793625    0.67044285   -0.06983423    0.00387946   -0.02713230    0.00279835
C   -0.84123892   -0.80132116    0.06146757    0.00193886    0.02114912   -0.00443186
C    0.28247261    1.60788924   -0.00449401   -0.03475498   -0.00491144   -0.02633200
C    0.38382760   -1.61811912   -0.07538370   -0.02170190   -0.02322350    0.00468164
C    1.66762411    1.30293352    0.24441955    0.01452857    0.05151568    0.04114468
C    1.76807297   -1.25737617   -0.19589241    0.04441370   -0.00337004   -0.01218243
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   15
   -420.52127761
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O   -2.02955292   -1.25846455    0.25944418   -0.04530047   -0.01338910    0.01241022
C   -0.74810405    0.66710095   -0.07758674   -0.00326409   -0.03291811    0.00140655
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C    1.66685951    1.30687587    0.25211190    0.01123928    0.04772211    0.03954727
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H    3.34100209    0.11442896    0.09513384   -0.01888879    0.00406730    0.00296598
   15
   -420.52254594
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O   -2.02801550   -1.25826508    0.26531971   -0.04413235   -0.01419982    0.01242840
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C    0.30917291    1.61148598   -0.00996810   -0.00002585   -0.00205900   -0.02308396
C    0.37531959   -1.61995638   -0.08047741   -0.02650176   -0.01228394    0.00561499
C    1.66544413    1.30797049    0.25743112    0.00229725    0.03636161    0.03431793
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H    2.47499087   -2.10926885   -0.23485047    0.00580340   -0.01057693    0.00529800
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H    3.36080128    0.13111392    0.09923538    0.00404944    0.00712821    0.00562252
   15
   -420.52257417
H   -2.61222751    0.45837603   -0.14899404   -0.02011475   -0.02096070   -0.00219771
O   -1.93884378    1.25039253   -0.19080550    0.02961071    0.02751651    0.00206212
O   -2.02448148   -1.25742564    0.27063308   -0.04139293   -0.01386461    0.01199558
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C   -0.83343549   -0.79912247    0.06786834    0.00550883    0.02097180   -0.00150407
C    0.32306110    1.61359746   -0.01054404    0.01600710    0.01422256   -0.01863981
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C    1.66389340    1.30687612    0.26068449   -0.00744421    0.02287615    0.02716416
C    1.76129693   -1.26649999   -0.21493315    0.04949079   -0.02830026   -0.01710936
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C    2.26046480    0.05902332   -0.04142804   -0.04011202   -0.00391325   -0.02453031
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   15
   -420.52251662
H   -2.60899768    0.44895791   -0.12883331   -0.02095746   -0.02173678   -0.00083187
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O   -2.01907253   -1.25596155    0.27540409   -0.03777716   -0.01235530    0.01106086
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C   -0.83151094   -0.80111309    0.07028682    0.00347703    0.01462565    0.00026003
C    0.33599558    1.61481704   -0.00999802    0.02929904    0.03638641   -0.01316699
C    0.37292338   -1.61912025   -0.08689036   -0.01651094    0.01333256    0.00460531
C    1.66277724    1.30438770    0.26229490   -0.01417477    0.01138857    0.02000423
C    1.75320345   -1.26697951   -0.21932776    0.04910461   -0.03835747   -0.01781453
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H    2.47382750   -2.06730029   -0.25185648   -0.00299817    0.00393406    0.00598928
C    2.25010384    0.06442302   -0.03540444   -0.05014569    0.00470584   -0.02148641
H    3.38120863    0.14774930    0.09462371    0.02658817    0.01004466    0.00647609
   15
   -420.52409567
H   -2.59120220    0.45472755   -0.10804829   -0.01295637   -0.01457908    0.00007422
O   -1.93940009    1.24174176   -0.19605337    0.02205941    0.01737880    0.00116344
O   -2.01195181   -1.25394090    0.27967508   -0.03354226   -0.00976680    0.00964733
C   -0.74340477    0.67395590   -0.10839047   -0.02365208   -0.02324044   -0.00657664
C   -0.82979140   -0.80397866    0.07268839    0.00037252    0.00635162    0.00224611
C    0.34716425    1.61386334   -0.00865449    0.04149749    0.05280238   -0.00789101
C    0.37339944   -1.61952873   -0.09053413   -0.00843972    0.01830914    0.00328180
C    1.66249496    1.30118941    0.26268818   -0.01630782    0.00406729    0.01424071
C    1.74216619   -1.26516720   -0.22264915    0.04358393   -0.04292600   -0.01767945
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H    2.47470769   -2.04773126   -0.26671284   -0.00420657    0.00749856    0.00593202
C    2.24271841    0.06953720   -0.02808972   -0.04866386    0.01351955   -0.01681910
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   15
   -420.52721519
H   -2.56455087    0.47049905   -0.08723213    0.00276302    0.00068576   -0.00046397
O   -1.94130837    1.23606714   -0.19876544    0.00727351   -0.00047654    0.00260904
O   -2.00331230   -1.25148015    0.28350954   -0.02847491   -0.00637229    0.00788911
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C   -0.82808882   -0.80722312    0.07495359   -0.00384728   -0.00297352    0.00433965
C    0.35580972    1.60981751   -0.00682782    0.05606532    0.04984420   -0.00370602
C    0.37438146   -1.62100817   -0.09437409    0.00050857    0.01610270    0.00150262
C    1.66317575    1.29772013    0.26220896   -0.01383901    0.00168480    0.01066357
C    1.72852707   -1.26079574   -0.22490699    0.03145532   -0.04031669   -0.01641651
H   -0.02502543    2.58573588    0.02607943    0.00282214   -0.03156683   -0.00217126
H    0.14884142   -2.70917801   -0.10339161   -0.00244999   -0.01340273    0.00030223
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H    2.47832152   -2.03323999   -0.28580768   -0.00065272    0.00584973    0.00531976
C    2.23821848    0.07383757   -0.01976274   -0.03573939    0.02156184   -0.01120684
H    3.33539581    0.13668445    0.07276826    0.00617926    0.00798928    0.00154519
   15
   -420.52831523
H   -2.54000423    0.48556362   -0.06597662    0.01988925    0.01886733   -0.00262889
O   -1.94353573    1.23042662   -0.20160239   -0.00988210   -0.02101339    0.00560147
O   -1.99338558   -1.24873136    0.28698667   -0.02214154   -0.00265096    0.00594909
C   -0.73376865    0.68690911   -0.12194253   -0.02324597   -0.00535642   -0.01107004
C   -0.82614718   -0.81028705    0.07695628   -0.00934071   -0.01243851    0.00644051
C    0.36106083    1.60285157   -0.00477152    0.07101377    0.02874817   -0.00061858
C    0.37533262   -1.62343024   -0.09830335    0.00948953    0.00775835   -0.00057632
C    1.66467566    1.29412905    0.26107355   -0.00784859    0.00314365    0.00927470
C    1.71300860   -1.25401171   -0.22617811    0.01482393   -0.03262070   -0.01394431
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H    0.11573209   -2.68785643   -0.10298635   -0.00510588   -0.00256709    0.00140139
H    2.28321110    2.09945996    0.63934252   -0.00663913   -0.00148749    0.00568134
H    2.48222221   -2.02276599   -0.30869387    0.00589789    0.00097091    0.00404300
C    2.23583676    0.07684224   -0.01075819   -0.01464721    0.02791480   -0.00558893
H    3.30099135    0.12202723    0.05914190   -0.01667775    0.00599721   -0.00162322
   15
   -420.52686493
H   -2.52905038    0.48775673   -0.04289097    0.02517549    0.02537496   -0.00367386
O   -1.94535302    1.22569199   -0.20468914   -0.01714860   -0.02929661    0.00738329
O   -1.98245961   -1.24586136    0.29019394   -0.01441488    0.00089691    0.00398860
C   -0.72681185    0.69414940   -0.12778146   -0.01524213    0.00419310   -0.01283675
C   -0.82363483   -0.81260291    0.07857010   -0.01595787   -0.02106558    0.00840772
C    0.36205525    1.59416706   -0.00267287    0.07853084    0.00327106    0.00145498
C    0.37571309   -1.62630732   -0.10219729    0.01787560   -0.00325807   -0.00274012
C    1.66664453    1.29034672    0.25937253   -0.00074225    0.00473734    0.00875860
C    1.69659484   -1.24526227   -0.22661050   -0.00208483   -0.02336448   -0.01056429
H   -0.05113387    2.61793757    0.01065051   -0.01405629    0.00443318   -0.00249430
H    0.08621564   -2.66482998   -0.10359055   -0.00642589    0.01050416    0.00250540
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H    2.48190721   -2.01300655   -0.33446569    0.01196716   -0.00371389    0.00234471
C    2.23435916    0.07817206   -0.00140929    0.00248619    0.03163296   -0.00120378
H    3.27832491    0.10303006    0.04662332   -0.03469360    0.00431531   -0.00382091
   15
   -420.52699802
H   -2.53513571    0.47285410   -0.01743150    0.01329584    0.01329909   -0.00050187
O   -1.94645347    1.22220982   -0.20809357   -0.00911180   -0.01841273    0.00491522
O   -1.97088303   -1.24302971    0.29321985   -0.00583247    0.00384820    0.00212726
C   -0.71896244    0.70113417   -0.13284640   -0.00147266    0.01410570   -0.01412421
C   -0.82015669   -0.81365363    0.07967724   -0.02265639   -0.02792631    0.01001326
C    0.35836571    1.58525672   -0.00065573    0.07324238   -0.01700197    0.00223946
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C    1.66866849    1.28630183    0.25714865    0.00442507    0.00174753    0.00693786
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H   -0.05231559    2.63666169    0.00557533   -0.01822345    0.01774887   -0.00267816
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H    2.23255849    2.09859025    0.65055358   -0.01872605   -0.01063628    0.00167961
H    2.47317068   -2.00073537   -0.36192368    0.01482833   -0.00575037    0.00065233
C    2.23283094    0.07760324    0.00802139    0.00067851    0.03250012    0.00145910
H    3.27940812    0.08090083    0.03677224   -0.03298135    0.00297011   -0.00469139
   15
   -420.52879439
H   -2.55045621    0.44872387    0.00823440   -0.00444137   -0.00483756    0.00518247
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O   -1.95904058   -1.24036910    0.29614833    0.00241430    0.00584639    0.00050747
C   -0.71104368    0.70726436   -0.13706014    0.01618161    0.02428279   -0.01481206
C   -0.81531761   -0.81302818    0.08018191   -0.02748030   -0.03223078    0.01098199
C    0.35031150    1.57733569    0.00123319    0.05510354   -0.02953653    0.00159651
C    0.37276936   -1.63106785   -0.10937431    0.03269902   -0.01119820   -0.00614779
C    1.67044220    1.28218081    0.25451674    0.00624578   -0.00683113    0.00295066
C    1.66489635   -1.22401313   -0.22578556   -0.02340839   -0.00834729   -0.00338889
H   -0.04068065    2.64316212    0.00242036   -0.01727702    0.02178566   -0.00272949
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H    2.45401760   -1.98453965   -0.38988082    0.01335765   -0.00421039   -0.00052686
C    2.23135258    0.07508076    0.01736892   -0.01846373    0.03093164    0.00306725
H    3.30310347    0.05666408    0.03027183   -0.01297425    0.00115437   -0.00507338
   15
   -420.52964907
H   -2.56293106    0.42768390    0.03023385   -0.01671285   -0.01694015    0.00987702
O   -1.94802705    1.21692731   -0.21533037    0.01247033    0.01130732   -0.00411716
O   -1.94730104   -1.23796929    0.29905229    0.00891397    0.00666338   -0.00071525
C   -0.70410679    0.71192817   -0.14038140    0.03445690    0.03396213   -0.01484026
C   -0.80883678   -0.81046928    0.08002722   -0.02831404   -0.03338605    0.01099444
C    0.33897247    1.57115874    0.00303152    0.02745811   -0.03357794   -0.00022767
C    0.36855759   -1.63248943   -0.11245448    0.03725553   -0.00465960   -0.00672367
C    1.67184960    1.27847887    0.25170955    0.00580268   -0.01654968   -0.00164765
C    1.65088707   -1.21241806   -0.22495663   -0.02499035   -0.00335604   -0.00069294
H   -0.01687465    2.63454866    0.00121719   -0.01181980    0.01615268   -0.00255901
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H    2.23019490    2.12188510    0.65390520   -0.00998662    0.00316145    0.00821394
H    2.42549169   -1.96551178   -0.41751114    0.00780755    0.00062422   -0.00081421
C    2.23099536    0.07070098    0.02653384   -0.03891532    0.02664004    0.00406141
H    3.33600716    0.03163116    0.02743211    0.00968514   -0.00122286   -0.00553112
   15
   -420.52926189
H   -2.56390230    0.41832256    0.04527850   -0.02012082   -0.02037428    0.01196172
O   -1.94943560    1.21383403   -0.21877176    0.01421409    0.01518944   -0.00576151
O   -1.93595563   -1.23586731    0.30198682    0.01271390    0.00627098   -0.00143394
C   -0.69923781    0.71454840   -0.14280800    0.04955690    0.04150921   -0.01430076
C   -0.80067025   -0.80590830    0.07921344   -0.02387689   -0.03115711    0.00985365
C    0.32599435    1.56696527    0.00484663   -0.00441762   -0.02832134   -0.00264647
C    0.36211961   -1.63363475   -0.11513365    0.03646537    0.00304411   -0.00618770
C    1.67290853    1.27575436    0.24899389    0.00481471   -0.02174326   -0.00468675
C    1.63836332   -1.20061766   -0.22408081   -0.02147052    0.00118114    0.00110243
H    0.01524393    2.61485894    0.00184175   -0.00308351    0.00137338   -0.00215287
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   15
   -420.52890806
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   15
   -420.52942887
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O   -1.91501949   -1.23244078    0.30805570    0.01327966    0.00274555   -0.00152313
C   -0.69890112    0.71214074   -0.14512390    0.05827772    0.04164173   -0.01244391
C   -0.78066392   -0.79150082    0.07595190   -0.00061943   -0.01792530    0.00440719
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   15
   -420.52966498
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C   -0.77021149   -0.78244811    0.07383003    0.01440703   -0.00822035    0.00078957
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   15
   -420.52787408
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   15
   -420.52546472
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   15
   -420.52379877
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   15
   -420.52206704
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   15
   -420.52001242
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C    0.30300839    1.57877902    0.02957037   -0.00445998   -0.00221642    0.00335343
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C    1.57966539   -1.15529465   -0.23070284   -0.03541501    0.03706738    0.00614463
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   15
   -420.51890736
H   -2.57795023    0.37265314   -0.00144727   -0.01649702   -0.02005463    0.00964647
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   15
   -420.52021084
H   -2.57419035    0.38469059   -0.02873370   -0.00876883   -0.01215362    0.00585907
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   15
   -420.52390134
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C    2.29434590    0.01922642    0.11958231    0.01034385    0.00519943    0.00875646
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   15
   -420.52755943
H   -2.55899643    0.42228502   -0.09184402    0.02030884    0.02216734   -0.00455930
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O   -1.86394950   -1.21788928    0.34361262    0.04745004    0.01691447   -0.00601773
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C   -0.76543959   -0.74245809    0.07037182    0.00669648    0.01340316   -0.00556525
C    0.32193592    1.59341695    0.04149617    0.03135485    0.04128029    0.00873000
C    0.31735859   -1.60434610   -0.15571285   -0.01443072   -0.00138171    0.01519804
C    1.68194688    1.24868417    0.21198830   -0.00923280   -0.01042471    0.00670757
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C    2.29614594    0.01774761    0.12533271    0.02948170    0.00555029    0.01176441
H    3.36754580   -0.04578460    0.24429127   -0.00394657   -0.00010425    0.00295552
   15
   -420.52983765
H   -2.56728088    0.42446235   -0.12050017    0.02194334    0.02698499   -0.00590854
O   -1.99226235    1.17134440   -0.26030769   -0.01187168   -0.04124280    0.00625481
O   -1.86799555   -1.21811933    0.34817251    0.04647625    0.01931844   -0.00553427
C   -0.76407880    0.70306825   -0.10906779   -0.03745468   -0.02108009   -0.00976182
C   -0.77352922   -0.74581465    0.07251025   -0.00558951    0.00153874   -0.00365313
C    0.32313401    1.59068632    0.04326537    0.03582635    0.02007210    0.00814079
C    0.32627695   -1.59669306   -0.16347752   -0.00237069   -0.00384036    0.01291211
C    1.68679425    1.24681251    0.20690119    0.00173347   -0.00524633    0.00716379
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H    2.29452163   -1.99190532   -0.54006937   -0.00042311   -0.00132945   -0.00346397
C    2.29616716    0.01593760    0.13037062    0.04720286    0.00510547    0.01489532
H    3.33811888   -0.03344873    0.25715351   -0.02650408    0.00210894    0.00080794
   15
   -420.53191976
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O   -1.99890722    1.17039107   -0.26347965   -0.00681066   -0.03022800    0.00342604
O   -1.87413972   -1.21921946    0.35297960    0.04264206    0.02002563   -0.00402098
C   -0.75725453    0.71584096   -0.10198977   -0.01585599   -0.00207282   -0.00802022
C   -0.78128985   -0.74926775    0.07487313   -0.01604320   -0.00964927   -0.00243392
C    0.32220200    1.58673998    0.04454592    0.03313944   -0.00111279    0.00682676
C    0.33534726   -1.58881281   -0.17202186    0.00802473   -0.00531132    0.01040422
C    1.69154456    1.24527539    0.20138461    0.01120252   -0.00341869    0.00686512
C    1.61770987   -1.20180215   -0.24727489   -0.05485448    0.00912367   -0.01118188
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H    2.34109150    2.09242946    0.24037914   -0.01008070   -0.01140023   -0.00980641
H    2.32411284   -2.00913564   -0.52583762    0.00583374   -0.00673742   -0.00428247
C    2.29342448    0.01381685    0.13451755    0.04733770    0.00496774    0.01609413
H    3.32683210   -0.02256273    0.26934762   -0.03371860    0.00318403    0.00005414
   15
   -420.53347646
H   -2.61790843    0.38344888   -0.16658453   -0.01263510   -0.00640777   -0.00293241
O   -2.00525584    1.17078991   -0.26680738    0.00191026   -0.01369901    0.00050232
O   -1.88220540   -1.22122075    0.35796524    0.03527466    0.01876790   -0.00147358
C   -0.74949046    0.72873560   -0.09443098    0.00954007    0.01759224   -0.00544739
C   -0.78809919   -0.75214827    0.07738815   -0.02273175   -0.01865064   -0.00218902
C    0.31930659    1.58283426    0.04541589    0.02239847   -0.01707526    0.00505818
C    0.34394410   -1.58063152   -0.18119929    0.01604679   -0.00290921    0.00863433
C    1.69563856    1.24397545    0.19545705    0.01658494   -0.00741208    0.00573788
C    1.63454633   -1.21123973   -0.24804227   -0.04663174    0.00955986   -0.01255413
H   -0.05015943    2.64871062    0.05809752   -0.01931798    0.01782456    0.00121549
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H    2.33763942    2.10250759    0.23431084   -0.00905528   -0.00743555   -0.00946322
H    2.34971912   -2.02173328   -0.50860538    0.00852497   -0.00852156   -0.00372483
C    2.28794068    0.01139546    0.13770740    0.02440019    0.00487793    0.01421463
H    3.33848234   -0.01390623    0.28134052   -0.01955957    0.00319019    0.00184833
   15
   -420.53311265
H   -2.63688101    0.36264538   -0.18587815   -0.02470463   -0.01854763   -0.00307853
O   -2.01166820    1.17183548   -0.27016309    0.00496605   -0.00336684   -0.00112881
O   -1.89185787   -1.22406621    0.36301467    0.02428164    0.01556089    0.00188474
C   -0.74230163    0.74057283   -0.08654528    0.03458999    0.03590986   -0.00240615
C   -0.79355799   -0.75391736    0.08004029   -0.02461796   -0.02435361   -0.00288904
C    0.31508724    1.57992433    0.04598021    0.00559776   -0.02562572    0.00322418
C    0.35158431   -1.57229421   -0.19090426    0.02121077    0.00335884    0.00788683
C    1.69874889    1.24314134    0.18918635    0.01817604   -0.01476865    0.00384898
C    1.65416339   -1.22123954   -0.24804683   -0.03056904    0.00682902   -0.01462019
H   -0.03787700    2.64488876    0.06070083   -0.01709858    0.01487804    0.00170735
H   -0.00937084   -2.56561757   -0.42989821   -0.01027034    0.00828611    0.00040679
H    2.34047732    2.11766300    0.23501705   -0.00424195    0.00105485   -0.00843801
H    2.36943756   -2.02845099   -0.48876599    0.00704876   -0.00604971   -0.00191755
C    2.28102572    0.00868329    0.14004515   -0.00752288    0.00396114    0.01083707
H    3.36370886   -0.00753660    0.29194305    0.00317038    0.00289622    0.00468850
   15
   -420.53127172
H   -2.63868838    0.35461270   -0.20290594   -0.02635936   -0.02089459   -0.00406539
O   -2.01827764    1.17306673   -0.27347089    0.00052227   -0.00178404   -0.00186479
O   -1.90260137   -1.22761181    0.36797705    0.01046510    0.01079194    0.00565058
C   -0.73718191    0.75025717   -0.07851387    0.05511840    0.05042860    0.00057797
C   -0.79755084   -0.75423264    0.08287048   -0.02196235   -0.02625707   -0.00424313
C    0.31054130    1.57851914    0.04634757   -0.01352694   -0.02524414    0.00175694
C    0.35795883   -1.56416579   -0.20108813    0.02289768    0.01076988    0.00755905
C    1.70076824    1.24319111    0.18268579    0.01808512   -0.02033757    0.00137818
C    1.67559965   -1.23163517   -0.24716532   -0.00869059    0.00074391   -0.01701985
H   -0.01348724    2.63083855    0.06207961   -0.01146772    0.00388118    0.00209712
H   -0.03697778   -2.55583780   -0.44111497   -0.01550105    0.00398495   -0.00034716
H    2.34634233    2.13206318    0.24176810    0.00110177    0.00953211   -0.00689665
H    2.38429109   -2.03103085   -0.46759112    0.00210411    0.00000058    0.00063489
C    2.27453127    0.00573763    0.14172380   -0.03312075    0.00185683    0.00810699
H    3.38701308   -0.00325162    0.29922600    0.02035446    0.00255298    0.00664647
   15
   -420.52943102
H   -2.62213852    0.36100921   -0.21700341   -0.01753620   -0.01290339   -0.00520719
O   -2.02488389    1.17441293   -0.27669583   -0.01111126   -0.00928714   -0.00213298
O   -1.91381513   -1.23164370    0.37268317   -0.00456977    0.00513271    0.00937665
C   -0.73535541    0.75692382   -0.07051482    0.06767474    0.05853575    0.00305737
C   -0.80023161   -0.75297811    0.08595821   -0.01608102   -0.02453266   -0.00577793
C    0.30680076    1.57859834    0.04660515   -0.03011220   -0.01673467    0.00097071
C    0.36296780   -1.55667898   -0.21172703    0.02076162    0.01628607    0.00682439
C    1.70169313    1.24444188    0.17610331    0.01807952   -0.02026630   -0.00138181
C    1.69755238   -1.24206667   -0.24525661    0.01491949   -0.00705141   -0.01896612
H    0.01904522    2.61430371    0.06195479   -0.00398128   -0.01203836    0.00237648
H   -0.05352969   -2.54897293   -0.45208904   -0.01893738    0.00040303   -0.00095896
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H    2.39769763   -2.03368069   -0.44686310   -0.00389063    0.00710150    0.00302143
C    2.26997809    0.00268386    0.14290411   -0.04656962   -0.00106587    0.00695633
H    3.39630229   -0.00079817    0.30182060    0.02690677    0.00209426    0.00697758
   15
   -420.52832614
H   -2.59349598    0.37608052   -0.22734617   -0.00002449    0.00502977   -0.00633309
O   -2.03096372    1.17621466   -0.27982458   -0.02846946   -0.02537359   -0.00222041
O   -1.92482420   -1.23590836    0.37696550   -0.01889978   -0.00062903    0.01267982
C   -0.73757212    0.76009170   -0.06269730    0.07039731    0.05845110    0.00487717
C   -0.80194706   -0.75025539    0.08939386   -0.00876392   -0.01973144   -0.00700116
C    0.30484302    1.57968119    0.04680028   -0.03914381   -0.00675929    0.00091960
C    0.36673764   -1.55015874   -0.22277351    0.01539309    0.01816647    0.00506323
C    1.70152040    1.24688398    0.16960415    0.01887281   -0.01344058   -0.00408821
C    1.71862226   -1.25208113   -0.24220823    0.03471291   -0.01295823   -0.01946630
H    0.05449514    2.60624109    0.06012025    0.00265661   -0.02450853    0.00263073
H   -0.05660808   -2.54255315   -0.46240624   -0.01957780   -0.00065279   -0.00099780
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H    2.41374443   -2.04124993   -0.42823972   -0.00715442    0.01102129    0.00421373
C    2.26817700   -0.00030503    0.14365492   -0.04712751   -0.00406467    0.00755880
H    3.38687351    0.00016008    0.29949121    0.02238094    0.00142184    0.00562930
   15
   -420.52806211
H   -2.56489382    0.38741627   -0.23314848    0.01802086    0.02412285   -0.00708190
O   -2.03575671    1.17917012   -0.28285181   -0.04409856   -0.04136070   -0.00254967
O   -1.93498491   -1.24014688    0.38067468   -0.03079828   -0.00581744    0.01538449
C   -0.74399844    0.75976546   -0.05517210    0.06361259    0.05027178    0.00617884
C   -0.80313016   -0.74635128    0.09324936   -0.00190413   -0.01252635   -0.00750369
C    0.30520052    1.58121518    0.04693691   -0.03799590   -0.00474479    0.00146169
C    0.36958598   -1.54471690   -0.23411956    0.00814882    0.01604540    0.00198565
C    1.70020244    1.25011073    0.16335032    0.02038930   -0.00108082   -0.00642173
C    1.73763376   -1.26133665   -0.23799230    0.04654286   -0.01413591   -0.01807679
H    0.08822459    2.61500816    0.05639062    0.00621375   -0.02376877    0.00287927
H   -0.04576530   -2.53584037   -0.47204642   -0.01726588    0.00120747   -0.00034999
H    2.35267923    2.12546077    0.28680703    0.00198499    0.00885580   -0.00225399
H    2.43460459   -2.05637245   -0.41254850   -0.00494928    0.00874450    0.00373661
C    2.26916268   -0.00305207    0.14393995   -0.03509181   -0.00627709    0.00986388
H    3.36197006    0.00011014    0.29319889    0.00715756    0.00048437    0.00275896
   15
   -420.52838576
H   -2.54846267    0.38245691   -0.23391024    0.02327492    0.02600078   -0.00683541
O   -2.03860481    1.18393120   -0.28575939   -0.04550528   -0.03932691   -0.00390463
O   -1.94376159   -1.24412508    0.38368826   -0.03914558   -0.01006067    0.01744090
C   -0.75423545    0.75642965   -0.04801954    0.04954908    0.03597237    0.00727200
C   -0.80418802   -0.74169850    0.09755393    0.00295554   -0.00353942   -0.00705555
C    0.30781352    1.58308432    0.04698263   -0.02846728   -0.01186239    0.00251956
C    0.37194249   -1.54022991   -0.24557971    0.00070208    0.01089558   -0.00227672
C    1.69765224    1.25339093    0.15748224    0.02165369    0.01357755   -0.00826748
C    1.75387045   -1.26975608   -0.23268977    0.05052244   -0.01169372   -0.01538201
H    0.11763852    2.64006416    0.05060152    0.00716576   -0.00965713    0.00290262
H   -0.02263516   -2.53012359   -0.48146149   -0.01262101    0.00511547    0.00074277
H    2.35032169    2.10717061    0.30639523   -0.00250897    0.00081767   -0.00156931
H    2.45876075   -2.07748361   -0.39948361    0.00161551    0.00144471    0.00217249
C    2.27222207   -0.00542714    0.14362246   -0.01380237   -0.00697430    0.01330126
H    3.33237599   -0.00027459    0.28498082   -0.01540379   -0.00068468   -0.00107244
   15
   -420.52778467
H   -2.54789053    0.36007382   -0.22981709    0.01422226    0.00738128   -0.00549261
O   -2.03944719    1.19039337   -0.28848497   -0.03196989   -0.01645216   -0.00648096
O   -1.95077670   -1.24765066    0.38591272   -0.04363290   -0.01326561    0.01889074
C   -0.76744802    0.75093449   -0.04130718    0.03121850    0.01841571    0.00843740
C   -0.80541121   -0.73683690    0.10228024    0.00516505    0.00646271   -0.00561285
C    0.31212625    1.58567533    0.04687371   -0.01450669   -0.02002891    0.00402062
C    0.37424883   -1.53639871   -0.25689925   -0.00523173    0.00517591   -0.00710165
C    1.69380464    1.25586247    0.15211315    0.02045295    0.02574439   -0.00995696
C    1.76707413   -1.27746699   -0.22645812    0.04996056   -0.00945125   -0.01243077
H    0.14193018    2.67187004    0.04274980    0.00737232    0.00802781    0.00248138
H    0.00952288   -2.52808311   -0.49140726   -0.00700425    0.00883943    0.00173978
H    2.34972547    2.08823817    0.32711923   -0.00617317   -0.00632649   -0.00099287
H    2.48171638   -2.09958826   -0.38797983    0.00884692   -0.00669170    0.00053084
C    2.27612678   -0.00738933    0.14250323    0.00505525   -0.00593219    0.01615261
H    3.31364426   -0.00016447    0.27749248   -0.03378778   -0.00188168   -0.00418179
   15
   -420.52589589
H   -2.55741493    0.33251127   -0.22178377    0.00233607   -0.01406509   -0.00383692
O   -2.03884897    1.19759365   -0.29091511   -0.01534220    0.00925735   -0.00940704
O   -1.95582478   -1.25057812    0.38728254   -0.04474732   -0.01543695    0.01968543
C   -0.78254001    0.74432782   -0.03510581    0.01108129    0.00038874    0.00973897
C   -0.80693573   -0.73236597    0.10734170    0.00518568    0.01642050   -0.00330405
C    0.31730933    1.58944617    0.04652072    0.00085512   -0.02219425    0.00571384
C    0.37685737   -1.53289417   -0.26779164   -0.00841555    0.00213409   -0.01151492
C    1.68874510    1.25681145    0.14734943    0.01436821    0.03122733   -0.01226675
C    1.77726181   -1.28458986   -0.21947246    0.04819587   -0.01040933   -0.00991397
H    0.16089265    2.69822681    0.03313547    0.00781025    0.02044960    0.00166872
H    0.04675141   -2.53221899   -0.50256225   -0.00183557    0.00949128    0.00196888
H    2.35335525    2.07357240    0.34851208   -0.00621458   -0.00882913    0.00031862
H    2.49845524   -2.11705232   -0.37689903    0.01357705   -0.01196622   -0.00046739
C    2.27981753   -0.00899879    0.14042128    0.00646624   -0.00371545    0.01629188
H    3.31806735    0.00128036    0.27285188   -0.03331078   -0.00273948   -0.00465601
   15
   -420.52390855
H   -2.56891950    0.31451488   -0.21097514   -0.00491407   -0.02664615   -0.00232620
O   -2.03753855    1.20441180   -0.29292033   -0.00264814    0.02550638   -0.01183492
O   -1.95885131   -1.25280957    0.38776225   -0.04352173   -0.01642250    0.01966231
C   -0.79830015    0.73768804   -0.02949306   -0.00949867   -0.01576753    0.01096451
C   -0.80876808   -0.72888206    0.11259996    0.00402985    0.02515149   -0.00038709
C    0.32244325    1.59451811    0.04582306    0.01568764   -0.01621132    0.00724597
C    0.37996044   -1.52954223   -0.27799330   -0.00879052    0.00365078   -0.01482803
C    1.68284257    1.25590844    0.14333269    0.00324947    0.02958824   -0.01555296
C    1.78453063   -1.29106191   -0.21188376    0.04718767   -0.01556618   -0.00808533
H    0.17421008    2.71038402    0.02232767    0.00857222    0.02411564    0.00072318
H    0.08537421   -2.54291121   -0.51506935    0.00215043    0.00563228    0.00111761
H    2.36119549    2.06494015    0.36959979   -0.00198326   -0.00605313    0.00284068
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C    2.28320841   -0.01038387    0.13736860   -0.00948709   -0.00141313    0.01362304
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   15
   -420.52176880
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   15
   -420.51964595
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   15
   -420.51842799
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   15
   -420.51905157
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   15
   -420.52177360
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   15
   -420.52505700
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H    2.45102536   -2.12718310   -0.31424198    0.00199631   -0.00061748    0.00153987
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   15
   -420.52680274
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C   -0.82134932   -0.75278341    0.13812971   -0.02370345   -0.00252275    0.02447319
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C    2.34336852   -0.01700462    0.10308457    0.04628888   -0.01123682    0.00013196
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   15
   -420.52749313
H   -2.73736558    0.53996904   -0.09579850   -0.02195133   -0.00891197    0.00341610
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C    2.35052804   -0.01635074    0.09769295    0.04353329   -0.01405905   -0.00393349
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   15
   -420.52806954
H   -2.76767108    0.56436469   -0.08088303   -0.03165200   -0.01231020    0.00482694
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O   -1.91950077   -1.25423334    0.36359590    0.00799894    0.01834454   -0.00194613
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   15
   -420.52762154
H   -2.77593102    0.59708150   -0.06928366   -0.02882331   -0.00657250    0.00354688
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O   -1.91275163   -1.25584425    0.35990475    0.01010756    0.01950029   -0.00278986
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C    1.73020645   -1.25915496   -0.12635424   -0.01459941    0.00782603    0.01644041
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   15
   -420.52533633
H   -2.76423549    0.63399155   -0.06003680   -0.01285636    0.00805780   -0.00104527
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O   -1.90644924   -1.25833211    0.35633685    0.00908576    0.01859645   -0.00274469
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C   -0.80621591   -0.77467460    0.12617772   -0.02362687   -0.03566517    0.02329014
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   15
   -420.52184320
H   -2.74372882    0.66483392   -0.04989831    0.00978919    0.02647773   -0.00767855
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C   -0.78681591    0.75616102   -0.01137657    0.06309650    0.05881779    0.00782137
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C    1.66667255    1.17045456    0.17090265    0.00911693   -0.04843118    0.00681732
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H    2.28648474    2.08544057    0.28307699    0.00422963    0.01171856   -0.00023158
H    2.34390871   -2.08961841   -0.29618796   -0.01265434    0.00989837    0.00285201
C    2.36445443   -0.00439912    0.08191185   -0.00722734   -0.01042357   -0.01988472
H    3.48656612    0.04657796    0.23932891    0.02864369    0.00469067    0.00620029
   15
   -420.52108826
H   -2.72952144    0.67728058   -0.03445513    0.02014001    0.03383667   -0.01053740
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O   -1.89491334   -1.26570649    0.34953025    0.00178076    0.01250091   -0.00063546
C   -0.78289758    0.75173527   -0.01317047    0.07182288    0.05973144    0.00880076
C   -0.78954212   -0.77444569    0.11148721    0.00247341   -0.03545074    0.01353062
C    0.24373294    1.55828913    0.00270393   -0.08070715    0.00616499   -0.00916813
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C    1.66603751    1.16811566    0.17519207    0.01274775   -0.04840925    0.01078926
C    1.70820149   -1.23635871   -0.11175182   -0.00172014    0.00725360    0.01792729
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   15
   -420.52446042
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O   -2.03689496    1.27453225   -0.27105276   -0.03459201   -0.01411175   -0.00433863
O   -1.88935968   -1.27032171    0.34619818   -0.00152805    0.00869886    0.00081552
C   -0.78326615    0.74374501   -0.01549845    0.06930242    0.05114375    0.01014549
C   -0.78100225   -0.77108913    0.10275505    0.01793423   -0.03128015    0.00742915
C    0.24462105    1.55018881   -0.00048527   -0.07816409   -0.00269148   -0.00955502
C    0.37884930   -1.53560956   -0.28046917    0.00839001    0.00289013   -0.01245987
C    1.66463344    1.16867428    0.17883124    0.01592910   -0.04244711    0.01432530
C    1.70137019   -1.22958653   -0.10900847   -0.00412163    0.01425313    0.01946395
H    0.00894696    2.58396671   -0.07999842   -0.00320566   -0.01875250    0.00067863
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C    2.37142344    0.00594572    0.08044643    0.02663814    0.00247039   -0.01567813
H    3.44664915    0.01911188    0.21161089   -0.00111150    0.00018588    0.00172749
   15
   -420.52669434
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O   -2.03351421    1.28365761   -0.26718745   -0.01294309    0.01124831   -0.01417691
O   -1.88374368   -1.27533241    0.34282979   -0.00299539    0.00510565    0.00209284
C   -0.78777210    0.73270798   -0.01844152    0.05610479    0.03338622    0.01178113
C   -0.77354159   -0.76585349    0.09357345    0.03232041   -0.02454631    0.00135847
C    0.25017814    1.54226595   -0.00310229   -0.06402402   -0.01446191   -0.00879723
C    0.36847456   -1.53922312   -0.27090292   -0.00698684   -0.00484230   -0.01087427
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C    1.69480243   -1.22368572   -0.10744230   -0.00932694    0.02308896    0.02099620
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H    2.25108078    2.06935639    0.22107036   -0.00970806   -0.00856551   -0.00569489
H    2.33820547   -2.08449098   -0.29963453   -0.00346925   -0.00137742   -0.00046936
C    2.37311875    0.01109804    0.08121860    0.05068356    0.00838394   -0.01229100
H    3.42122578    0.00430584    0.19489635   -0.02272704   -0.00173695   -0.00108657
   15
   -420.52678691
H   -2.72805004    0.61451862    0.03680963   -0.02265703   -0.01335395    0.01136125
O   -2.02951592    1.29229620   -0.26268849    0.00141069    0.03091094   -0.02170473
O   -1.87800082   -1.28057686    0.33936792   -0.00207651    0.00205884    0.00296098
C   -0.79563111    0.71968488   -0.02209750    0.03492545    0.00908645    0.01350458
C   -0.76802130   -0.75914605    0.08430631    0.04385270   -0.01527973   -0.00404656
C    0.25956935    1.53519066   -0.00518986   -0.04233229   -0.02110470   -0.00752706
C    0.35851581   -1.54255606   -0.26068259   -0.02102906   -0.01010030   -0.00857264
C    1.65896054    1.17697054    0.18337392    0.01156342   -0.02792881    0.01808133
C    1.68879636   -1.21916849   -0.10714059   -0.01413981    0.02949427    0.02148156
H    0.02283856    2.61783609   -0.08756288   -0.00702111    0.01393423   -0.00213309
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H    2.24817418    2.06841960    0.20705536   -0.01156378   -0.01223752   -0.00637597
H    2.34704782   -2.08778491   -0.30192213    0.00293327   -0.00840900   -0.00227667
C    2.37182013    0.01574932    0.08274088    0.06084958    0.01315110   -0.01017194
H    3.41135623   -0.00928012    0.17885969   -0.03106328   -0.00319169   -0.00223731
   15
   -420.52795467
H   -2.70828203    0.59695134    0.05178958   -0.02113229   -0.01829590    0.01399538
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O   -1.87217263   -1.28591789    0.33577378    0.00121197   -0.00016329    0.00326255
C   -0.80558091    0.70612425   -0.02656911    0.00945436   -0.01764748    0.01502060
C   -0.76513191   -0.75152604    0.07527799    0.05112277   -0.00375777   -0.00829884
C    0.27150568    1.52935280   -0.00682311   -0.01759245   -0.02009629   -0.00608481
C    0.34981054   -1.54530404   -0.24995134   -0.03147222   -0.01033357   -0.00483063
C    1.65497486    1.18386670    0.18405164    0.00036656   -0.02634564    0.01803030
C    1.68363287   -1.21641010   -0.10812970   -0.01652958    0.03100483    0.02032061
H    0.03669774    2.62579385   -0.08956127   -0.00671331    0.02158813   -0.00285860
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H    2.25331516    2.07588666    0.19760044   -0.00887829   -0.00930718   -0.00652852
H    2.35395250   -2.08528195   -0.30262996    0.00647665   -0.01121532   -0.00308444
C    2.36695699    0.01960944    0.08488600    0.04908071    0.01701337   -0.00947699
H    3.42254406   -0.02055507    0.16432387   -0.01852548   -0.00481468   -0.00163339
   15
   -420.52944055
H   -2.67392959    0.59201618    0.05696522   -0.00895258   -0.01406337    0.01211099
O   -2.02179292    1.30503071   -0.25064996    0.00132069    0.04026233   -0.02304392
O   -1.86640694   -1.29125541    0.33203384    0.00651727   -0.00134690    0.00295618
C   -0.81609963    0.69362223   -0.03194652   -0.01662998   -0.04268414    0.01602625
C   -0.76530842   -0.74368600    0.06674462    0.05321697    0.00916520   -0.01116537
C    0.28450999    1.52469782   -0.00808845    0.00636638   -0.01255140   -0.00462305
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C    1.65099005    1.19236646    0.18364399   -0.01533490   -0.02671421    0.01695063
C    1.67945338   -1.21549878   -0.11033909   -0.01581737    0.02695201    0.01743269
H    0.05526663    2.61875872   -0.08954415   -0.00435670    0.01999872   -0.00285027
H    0.06192028   -2.54029072   -0.56533508   -0.00227001    0.00526807   -0.00516278
H    2.26466301    2.08979326    0.19282741   -0.00312692   -0.00206677   -0.00635167
H    2.35642161   -2.07500825   -0.30118704    0.00622647   -0.00895382   -0.00270736
C    2.35918112    0.02244747    0.08760370    0.02628599    0.01945033   -0.00872725
H    3.44647077   -0.02835511    0.15095532    0.00401913   -0.00653696   -0.00083662
   15
   -420.52852813
H   -2.63359839    0.59670535    0.05365779    0.01081522   -0.00154339    0.00634543
O   -2.01807900    1.30870437   -0.24304905   -0.00909635    0.02962234   -0.01706186
O   -1.86094289   -1.29653611    0.32816166    0.01342509   -0.00139812    0.00212417
C   -0.82562552    0.68367599   -0.03828941   -0.04014522   -0.06261210    0.01627105
C   -0.76867594   -0.73639979    0.05887947    0.04980694    0.02195033   -0.01262142
C    0.29714871    1.52077678   -0.00907354    0.02649337   -0.00000385   -0.00329280
C    0.33840740   -1.54922799   -0.22791075   -0.03934666   -0.00086983    0.00448279
C    1.64793593    1.20246873    0.18221512   -0.03169258   -0.02454756    0.01508575
C    1.67621504   -1.21619218   -0.11359548   -0.01209800    0.01793727    0.01310718
H    0.07685814    2.59785791   -0.08751650   -0.00009899    0.00949456   -0.00212844
H    0.06641135   -2.55935029   -0.54621054   -0.00230394   -0.00267475   -0.00730863
H    2.27825772    2.10520085    0.19261174    0.00274146    0.00505576   -0.00590489
H    2.35462831   -2.05856186   -0.29785946    0.00231264   -0.00215496   -0.00127027
C    2.34979551    0.02412235    0.09084412    0.00694893    0.01930715   -0.00702238
H    3.46779278   -0.03148317    0.13823963    0.02222695   -0.00761325   -0.00084629
   15
   -420.52539049
H   -2.60104156    0.60234448    0.04582770    0.02992759    0.01314757   -0.00009941
O   -2.01395237    1.31105247   -0.23467956   -0.01914926    0.01465649   -0.00982950
O   -1.85609282   -1.30175700    0.32419452    0.02161795   -0.00047433    0.00091586
C   -0.83275089    0.67747793   -0.04561143   -0.05819841   -0.07486639    0.01552827
C   -0.77502886   -0.73043001    0.05177133    0.04103088    0.03253631   -0.01279572
C    0.30821429    1.51684405   -0.00985812    0.04089474    0.01466419   -0.00218657
C    0.33619102   -1.55094242   -0.21715202   -0.03774787    0.00228466    0.00759441
C    1.64678150    1.21402876    0.17987633   -0.04467918   -0.01714702    0.01274482
C    1.67369974   -1.21795679   -0.11764095   -0.00677639    0.00631666    0.00807774
H    0.09845040    2.57049605   -0.08398244    0.00535347   -0.00701974   -0.00095520
H    0.07253725   -2.57661066   -0.52188793   -0.00193349   -0.00857275   -0.00840199
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H    2.35129965   -2.04070714   -0.29364823   -0.00369445    0.00691431    0.00067025
C    2.33994174    0.02464446    0.09450495   -0.00306077    0.01619174   -0.00446995
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   15
   -420.52419129
H   -2.58918357    0.59920488    0.03776670    0.03521290    0.01666298   -0.00171054
O   -2.00900141    1.31270017   -0.22584707   -0.01776078    0.00868993   -0.00684235
O   -1.85222708   -1.30695854    0.32018645    0.03069650    0.00106172   -0.00044965
C   -0.83639631    0.67576048   -0.05386674   -0.06834633   -0.07772387    0.01362745
C   -0.78383964   -0.72640689    0.04543170    0.02757291    0.03894371   -0.01190081
C    0.31683731    1.51204950   -0.01051059    0.04923644    0.02411095   -0.00104129
C    0.33624335   -1.55277601   -0.20684289   -0.03328309    0.00171179    0.00880257
C    1.64829604    1.22659869    0.17676715   -0.05108012   -0.00440136    0.01033187
C    1.67160244   -1.22011251   -0.12217728   -0.00311306   -0.00346621    0.00350368
H    0.11622347    2.54808391   -0.07975178    0.01021359   -0.02156003    0.00006244
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H    2.35055742   -2.02770674   -0.28989096   -0.00841880    0.01388047    0.00214228
C    2.33022411    0.02420041    0.09843395   -0.00328245    0.01049698   -0.00148130
H    3.45871100   -0.02158779    0.11527833    0.02661723   -0.00622631   -0.00266657
   15
   -420.52728538
H   -2.60155700    0.58507397    0.03057321    0.02250855    0.00433182    0.00238511
O   -2.00330204    1.31389760   -0.21668330   -0.00189319    0.01659399   -0.00902018
O   -1.84975450   -1.31220849    0.31619883    0.03984507    0.00272469   -0.00177538
C   -0.83595385    0.67869354   -0.06294053   -0.06944987   -0.07061273    0.01059471
C   -0.79430174   -0.72471184    0.03980777    0.01091801    0.03998082   -0.01019706
C    0.32250931    1.50587208   -0.01110203    0.05215857    0.01895965    0.00045951
C    0.33829754   -1.55469524   -0.19705764   -0.02660733   -0.00236523    0.00832883
C    1.65285690    1.23941602    0.17303139   -0.04900256    0.01202133    0.00826232
C    1.66971966   -1.22209114   -0.12693311   -0.00451467   -0.00697753    0.00040411
H    0.12681146    2.54045036   -0.07551377    0.01230991   -0.02402716    0.00024112
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H    2.35558013   -2.02431260   -0.28759368   -0.00831520    0.01450863    0.00228935
C    2.32065941    0.02313008    0.10245229    0.00554109    0.00309967    0.00156201
H    3.42517174   -0.00954929    0.10629850    0.01221628   -0.00398776   -0.00371062
   15
   -420.53085978
H   -2.62971283    0.56805487    0.02164711    0.00251585   -0.01207014    0.00693625
O   -1.99753223    1.31433358   -0.20711017    0.01824944    0.02703745   -0.01137853
O   -1.84908490   -1.31758099    0.31229053    0.04766745    0.00409814   -0.00278891
C   -0.83135365    0.68585188   -0.07265090   -0.06210627   -0.05449247    0.00674085
C   -0.80541995   -0.72540828    0.03479824   -0.00656470    0.03579801   -0.00804110
C    0.32505485    1.49862938   -0.01172181    0.04940574   -0.00184642    0.00204983
C    0.34195389   -1.55646191   -0.18777113   -0.01851802   -0.00822919    0.00688347
C    1.66033950    1.25150378    0.16879286   -0.03870948    0.02885124    0.00679839
C    1.66813656   -1.22368330   -0.13172144   -0.01102587   -0.00364250   -0.00113012
H    0.12873407    2.54926139   -0.07139734    0.01115692   -0.01269728   -0.00040415
H    0.09573417   -2.59138179   -0.41535808    0.00242176   -0.00106592   -0.00361124
H    2.30045409    2.12171080    0.22897403   -0.00146090   -0.00416815   -0.00310884
H    2.36627070   -2.03096057   -0.28686595   -0.00304322    0.00852423    0.00114943
C    2.31072902    0.02187481    0.10637757    0.02006521   -0.00480748    0.00433500
H    3.38332711    0.00533417    0.09997060   -0.01003683   -0.00131532   -0.00442823
   15
   -420.53177362
H   -2.65992945    0.55931303    0.00791444   -0.01366749   -0.02197589    0.00851404
O   -1.99256832    1.31357246   -0.19703272    0.03285861    0.03006769   -0.01071912
O   -1.85056677   -1.32313637    0.30850659    0.05247950    0.00466359   -0.00323422
C   -0.82303188    0.69627227   -0.08276747   -0.04784778   -0.03167299    0.00258551
C   -0.81615053   -0.72825118    0.03027510   -0.02218042    0.02794720   -0.00590262
C    0.32464661    1.49152954   -0.01246215    0.03988279   -0.02893096    0.00298697
C    0.34672670   -1.55773778   -0.17890096   -0.00970929   -0.01267678    0.00543438
C    1.67013737    1.26186890    0.16414070   -0.02331293    0.04120894    0.00580785
C    1.66722701   -1.22507142   -0.13644543   -0.01888067    0.00294456   -0.00185478
H    0.12272662    2.56692708   -0.06697964    0.00823991    0.00355350   -0.00121500
H    0.10163647   -2.58981301   -0.37242869    0.00368340    0.00538845   -0.00124256
H    2.30175771    2.12291990    0.24482652   -0.00582132   -0.00972975   -0.00268394
H    2.37903988   -2.04358373   -0.28693971    0.00410176   -0.00019472   -0.00043808
C    2.29960822    0.02090569    0.11004266    0.02962680   -0.01183199    0.00673327
H    3.34856026    0.02117547    0.09680934   -0.02944930    0.00120495   -0.00479800
   15
   -420.53210694
H   -2.68081451    0.56584645   -0.01176961   -0.02131671   -0.02273371    0.00709881
O   -1.98906026    1.31148206   -0.18647957    0.03813036    0.02383057   -0.00718945
O   -1.85441308   -1.32889826    0.30486632    0.05288358    0.00386766   -0.00286580
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C    0.32185966    1.48616155   -0.01337823    0.02377943   -0.05270569    0.00291775
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   15
   -420.53338002
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O   -1.86064010   -1.33482882    0.30135242    0.04832415    0.00127330   -0.00152881
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C   -0.83296807   -0.73844367    0.02221086   -0.03935772    0.01044322   -0.00350504
C    0.31765622    1.48394014   -0.01446681    0.00335348   -0.06842480    0.00200898
C    0.35748296   -1.55809876   -0.16211044    0.00815069   -0.00559510    0.00451695
C    1.69301591    1.27507304    0.15385575    0.00579903    0.03758648    0.00284254
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   15
   -420.53285681
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O   -1.86904281   -1.34081018    0.29790431    0.03929284   -0.00315309    0.00075270
C   -0.78574339    0.73254064   -0.11315932    0.01798778    0.04590565   -0.00710336
C   -0.83802467   -0.74475246    0.01852695   -0.03924457    0.00430669   -0.00367639
C    0.31325403    1.48580577   -0.01567486   -0.01787532   -0.07389109    0.00068558
C    0.36239475   -1.55760675   -0.15413093    0.01552052    0.00487195    0.00435030
C    1.70434977    1.27811643    0.14840511    0.01667338    0.02441849    0.00033436
C    1.67212508   -1.23136988   -0.14974498   -0.01818791    0.00755225   -0.00533986
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C    2.25939930    0.02334841    0.11806514   -0.03997298   -0.01941022    0.01281140
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   15
   -420.52899334
H   -2.67189306    0.64802922   -0.09085594    0.01550322    0.02605103   -0.00298311
O   -1.98700184    1.30199448   -0.15380489   -0.01079388   -0.03833918    0.00675016
O   -1.87921672   -1.34664331    0.29441937    0.02717298   -0.00893522    0.00374389
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C   -0.84073260   -0.75133432    0.01506912   -0.03420457    0.00066211   -0.00458391
C    0.30991727    1.49208095   -0.01692508   -0.03596677   -0.06763119   -0.00048184
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C    1.71467957    1.27968895    0.14293446    0.02662856    0.00999695   -0.00221317
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H    0.05820411    2.55925438   -0.03860700    0.00140769    0.00147952   -0.00136571
H    0.10397231   -2.62324483   -0.20029890   -0.00232159   -0.00607754    0.00267339
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H    2.37941149   -2.05921413   -0.27825982    0.00049935   -0.00181316   -0.00094683
C    2.24832150    0.02644832    0.11934050   -0.06353052   -0.01474271    0.01399395
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   15
   -420.52543343
H   -2.67343101    0.65830061   -0.11599340    0.02062367    0.03287106   -0.00278142
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O   -1.89061908   -1.35206904    0.29076350    0.01381760   -0.01523531    0.00703846
C   -0.76372664    0.74586272   -0.13160549    0.05081330    0.07377285   -0.01072099
C   -0.84138773   -0.75796649    0.01189033   -0.02595931   -0.00092296   -0.00584939
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C    0.36915419   -1.55809789   -0.13891410    0.02190015    0.02147395    0.00260343
C    1.72339899    1.28064365    0.13759427    0.03648829   -0.00184057   -0.00410963
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H    0.03812096    2.53963894   -0.02871926    0.00227479   -0.01546922   -0.00127988
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H    2.37006172   -2.05292304   -0.27339441   -0.00759441    0.00623298    0.00009642
C    2.24102202    0.03042150    0.11977137   -0.07443426   -0.00646924    0.01481017
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   15
   -420.52569287
H   -2.68841136    0.64624276   -0.13914782    0.00379640    0.01858627   -0.00223700
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O   -1.90265023   -1.35680506    0.28678881    0.00091375   -0.02116531    0.01021528
C   -0.75687595    0.74619567   -0.13990726    0.05389530    0.07360112   -0.01268141
C   -0.84048005   -0.76454940    0.00906518   -0.01621739   -0.00116977   -0.00709873
C    0.31032537    1.51579620   -0.01933000   -0.04813407   -0.03257254   -0.00001856
C    0.37061869   -1.56006044   -0.13157343    0.02036184    0.02272326    0.00144164
C    1.72991371    1.28168453    0.13249718    0.04588345   -0.00871389   -0.00493715
C    1.68523995   -1.23993407   -0.15993103    0.01266888   -0.01932551   -0.01204130
H    0.01644299    2.53085788   -0.01789458    0.00245084   -0.02727355   -0.00143369
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H    2.36599225   -2.05092820   -0.26856401   -0.01256940    0.01108636    0.00057119
C    2.23815820    0.03477662    0.11930706   -0.07210621    0.00363126    0.01552585
H    3.36088545    0.04983080    0.15705359    0.01724251    0.00639310   -0.00414737
   15
   -420.52780340
H   -2.70587863    0.62111722   -0.16056853   -0.01761052   -0.00140656   -0.00356769
O   -1.98412049    1.30380815   -0.12314534    0.00914992   -0.00716940    0.00819426
O   -1.91472908   -1.36058475    0.28235244   -0.01036314   -0.02607161    0.01292279
C   -0.75324017    0.74212611   -0.14743983    0.04815881    0.06374963   -0.01507729
C   -0.83859265   -0.77106505    0.00666782   -0.00624118   -0.00070897   -0.00806412
C    0.31478059    1.53120522   -0.02051355   -0.03729305   -0.02077558    0.00174241
C    0.37086432   -1.56337188   -0.12432196    0.01631259    0.01897177    0.00066553
C    1.73366275    1.28322250    0.12769300    0.05336981   -0.00973082   -0.00465280
C    1.68889850   -1.24119784   -0.16204399    0.01501701   -0.02041090   -0.01291434
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H    2.34530004    2.15700825    0.35448123   -0.00111155    0.00490929    0.00365890
H    2.37058051   -2.05648335   -0.26408410   -0.01117726    0.00893950    0.00007951
C    2.23959024    0.03891502    0.11790258   -0.05692908    0.01316858    0.01648560
H    3.33444022    0.03720843    0.17968075    0.00174964    0.00445475   -0.00384983
   15
   -420.52892576
H   -2.71132930    0.59655152   -0.17936717   -0.02868389   -0.01429003   -0.00584935
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O   -1.92634611   -1.36318694    0.27733257   -0.01939867   -0.02959039    0.01489413
C   -0.75248689    0.73423931   -0.15405863    0.03639303    0.04628411   -0.01785046
C   -0.83632450   -0.77753943    0.00475614    0.00308167    0.00006999   -0.00862685
C    0.32144397    1.54791003   -0.02180337   -0.01720403   -0.01640777    0.00368820
C    0.37013141   -1.56781468   -0.11711420    0.01068000    0.01207870    0.00054974
C    1.73420583    1.28532702    0.12316742    0.05645194   -0.00650143   -0.00384251
C    1.69167926   -1.24126086   -0.16338048    0.01145674   -0.01498171   -0.01291004
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H    2.38288777   -2.06811759   -0.25962206   -0.00442264    0.00098885   -0.00104528
C    2.24442046    0.04227057    0.11549856   -0.03325347    0.02004132    0.01790357
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   15
   -420.52917482
H   -2.69690367    0.58168616   -0.19399091   -0.02676066   -0.01732573   -0.00756390
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O   -1.93709200   -1.36445258    0.27163967   -0.02599714   -0.03159494    0.01604388
C   -0.75392049    0.72357519   -0.15959726    0.02175396    0.02445010   -0.02073211
C   -0.83423581   -0.78401842    0.00336406    0.01106551    0.00094295   -0.00876780
C    0.32913280    1.56560958   -0.02331453    0.00593310   -0.01266448    0.00531326
C    0.36875334   -1.57299009   -0.10994231    0.00479616    0.00552388    0.00097816
C    1.73137193    1.28782455    0.11887776    0.05216071   -0.00318425   -0.00374578
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H    2.34919610    2.12239903    0.36466661   -0.01008535   -0.01007676    0.00012786
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C    2.25127928    0.04443245    0.11201283   -0.01314580    0.02334547    0.01899821
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   15
   -420.52999615
H   -2.66390881    0.57870392   -0.20326506   -0.01302972   -0.01045991   -0.00767481
O   -1.98291101    1.30960122   -0.09610977    0.00159243    0.01935996    0.01376848
O   -1.94666750   -1.36429060    0.26522182   -0.03013468   -0.03206993    0.01635049
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C   -0.83280706   -0.79055416    0.00250023    0.01715856    0.00174550   -0.00850326
C    0.33647710    1.58405193   -0.02514470    0.02627741   -0.00451992    0.00648946
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C    1.72542826    1.29053247    0.11482388    0.03906792   -0.00317033   -0.00541922
C    1.69550689   -1.23913256   -0.16372790    0.00195800   -0.00189196   -0.01259243
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H    2.41132716   -2.08729836   -0.24772283    0.00911139   -0.01324748   -0.00262324
C    2.25901499    0.04519730    0.10739036   -0.00841466    0.02365432    0.01770385
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   15
   -420.53014066
H   -2.62204165    0.58271121   -0.20713551    0.00891801    0.00502616   -0.00583724
O   -1.98322642    1.30996789   -0.08826490   -0.01819652    0.01023818    0.01277856
O   -1.95488505   -1.36267876    0.25806485   -0.03176497   -0.03114934    0.01591347
C   -0.75984000    0.69919521   -0.16675905   -0.00638775   -0.01968858   -0.02545835
C   -0.83240361   -0.79719390    0.00214862    0.02072096    0.00221768   -0.00783011
C    0.34226430    1.60273994   -0.02736527    0.04023349    0.00913857    0.00726422
C    0.36541056   -1.58423637   -0.09581498   -0.00359142    0.00455445    0.00209741
C    1.71715516    1.29344450    0.11110524    0.01948379   -0.00549721   -0.00851942
C    1.69710250   -1.23770343   -0.16275491    0.00115239   -0.00015224   -0.01290773
H   -0.05271272    2.65628717    0.04678271   -0.01695427    0.01945403    0.00236166
H    0.14447806   -2.63688240    0.00025410    0.00117699    0.00718323    0.00577078
H    2.37722584    2.11094802    0.37284777   -0.00122961   -0.00414494    0.00238299
H    2.41802987   -2.08495656   -0.23918522    0.01056192   -0.01343426   -0.00249607
C    2.26732347    0.04454346    0.10171417   -0.01590975    0.02145119    0.01317981
H    3.32580219   -0.03023813    0.29950668   -0.00819747   -0.00523477    0.00128521
   15
   -420.52777842
H   -2.58645890    0.58310497   -0.20683419    0.02822250    0.01984900   -0.00363147
O   -1.98272757    1.30987255   -0.08099776   -0.03463229    0.00098563    0.01134022
O   -1.96167116   -1.35965799    0.25018799   -0.03074305   -0.02906488    0.01489860
C   -0.76264082    0.68812680   -0.16809861   -0.01650282   -0.03756664   -0.02685292
C   -0.83323689   -0.80396463    0.00226841    0.02097685    0.00206155   -0.00672292
C    0.34565911    1.62084845   -0.03002407    0.04608467    0.02813061    0.00781712
C    0.36395016   -1.59024018   -0.08892575   -0.00549457    0.00857390    0.00246753
C    1.70770975    1.29668118    0.10790119   -0.00133399   -0.00636807   -0.01151018
C    1.69861074   -1.23624326   -0.16099940    0.00384125   -0.00272974   -0.01359650
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H    2.39477038    2.11149251    0.37499382    0.00653642    0.00208818    0.00464247
H    2.41738873   -2.07326606   -0.22888744    0.00759865   -0.00822288   -0.00182101
C    2.27659032    0.04260616    0.09524830   -0.02300675    0.01647595    0.00719332
H    3.35759816   -0.04273540    0.33248488    0.01124801   -0.00793485    0.00696738
   15
   -420.52492458
H   -2.57015253    0.57021991   -0.20373940    0.03084297    0.01860042   -0.00421591
O   -1.98072149    1.30967342   -0.07425464   -0.03485889    0.00650975    0.01235037
O   -1.96707249   -1.35532185    0.24163661   -0.02701015   -0.02609090    0.01349686
C   -0.76446527    0.67930769   -0.16781784   -0.02233607   -0.05093108   -0.02750751
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   15
   -420.52316306
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O   -1.97125743   -1.34980420    0.23247370   -0.02086628   -0.02249150    0.01185355
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C    0.34432861    1.65052595   -0.03679113    0.03644052    0.07317877    0.00864397
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   15
   -420.52241759
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O   -1.97450153   -1.34326768    0.22277362   -0.01317005   -0.01844302    0.01003267
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C    0.34014814    1.65944959   -0.04094326    0.02839915    0.08376733    0.00769011
C    0.36165229   -1.61168477   -0.06929611   -0.00553762    0.00432354    0.00484134
C    1.68344850    1.30752565    0.10263167   -0.03246993    0.01572478   -0.00934162
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   15
   -420.52298571
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C    0.36158820   -1.61968447   -0.06325848   -0.00514856   -0.00486151    0.00611860
C    1.67880345    1.31004260    0.10217685   -0.02969425    0.02827012   -0.00485018
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H    2.40509790   -2.03126692   -0.18067864   -0.00568396    0.01239092    0.00039444
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   15
   -420.52396599
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O   -1.97955382   -1.32788338    0.20209675    0.00147551   -0.00979361    0.00618314
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C   -0.84877553   -0.83724714    0.00675627   -0.02022317   -0.01426911    0.00263276
C    0.32698268    1.66278041   -0.05042320    0.01638239    0.05745458   -0.00004860
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C    1.67593824    1.31086146    0.10201355   -0.02377910    0.03840584   -0.00000430
C    1.69762012   -1.22117340   -0.13908134    0.00231664    0.00415324   -0.01438046
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C    2.33411767    0.02839470    0.06062088    0.05608624   -0.02801276    0.00320991
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   15
   -420.52565855
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O   -1.98201670   -1.31942473    0.19129312    0.00583310   -0.00598601    0.00453981
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C   -0.85057378   -0.84239508    0.00762437   -0.02666357   -0.01917283    0.00358830
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C    1.67451573    1.30939300    0.10185628   -0.01874868    0.04151053    0.00375065
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C    2.34105021    0.02846724    0.05357327    0.06784427   -0.03346093    0.00341533
H    3.33972379    0.00277093    0.37455219   -0.02972276   -0.00083767    0.00188170
   15
   -420.52844828
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O   -1.98473314   -1.31069080    0.18028174    0.00725763   -0.00311616    0.00335891
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C   -0.85077770   -0.84638646    0.00827913   -0.02950720   -0.02347973    0.00382110
C    0.31001231    1.65232983   -0.05989161   -0.00247978    0.02181166   -0.00810659
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C    1.67424288    1.30546172    0.10148103   -0.01664913    0.03528108    0.00580777
C    1.69419141   -1.21393403   -0.12410376   -0.00916299    0.02476639   -0.01246052
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C    2.34398810    0.03054813    0.04634727    0.05885768   -0.03584748   -0.00168641
H    3.35581233    0.02149018    0.36314970   -0.02091815    0.00070843    0.00458279
   15
   -420.53086439
H   -2.61431041    0.57697309   -0.02636025    0.01520076    0.02245950   -0.00210522
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O   -1.98776786   -1.30181105    0.16911602    0.00576086   -0.00141411    0.00270070
C   -0.74521761    0.70908821   -0.12226479    0.00423030   -0.00306278   -0.01528614
C   -0.84921537   -0.84896248    0.00870622   -0.02871637   -0.02683815    0.00338596
C    0.30144335    1.64461495   -0.06400587   -0.01596710    0.01333755   -0.01012609
C    0.36440436   -1.64382820   -0.04335695   -0.00389826   -0.01916039    0.00809658
C    1.67498303    1.29943295    0.10076022   -0.01567173    0.02190155    0.00675296
C    1.69316051   -1.21226914   -0.11545431   -0.00839048    0.02690676   -0.01130125
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C    2.34343251    0.03478025    0.03923552    0.03686316   -0.03483885   -0.00918630
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   15
   -420.53233255
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O   -1.99105480   -1.29286306    0.15782613    0.00183356   -0.00078137    0.00246370
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C   -0.84593191   -0.84992113    0.00893121   -0.02482006   -0.02904980    0.00241883
C    0.29384929    1.63605596   -0.06751530   -0.03121675    0.01229094   -0.01065499
C    0.36578672   -1.64680403   -0.03959251   -0.00269377   -0.01275610    0.00788175
C    1.67665984    1.29209246    0.09963164   -0.01257388    0.00585310    0.00753674
C    1.69261699   -1.21219646   -0.10612191   -0.00366221    0.02213164   -0.01002753
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H    2.39672310   -2.06149969   -0.12416550    0.00409938   -0.00617405    0.00095451
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   15
   -420.53281742
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O   -1.99441861   -1.28387706    0.14642378   -0.00378344   -0.00082124    0.00241360
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C    0.28814372    1.62672106   -0.07038581   -0.04643915    0.01746905   -0.01010715
C    0.36733211   -1.64900090   -0.03630487   -0.00150180   -0.00780962    0.00767240
C    1.67907741    1.28439227    0.09804547   -0.00565895   -0.00916454    0.00864069
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C    2.33691318    0.04918165    0.02697569    0.00025459   -0.01958429   -0.01672770
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   15
   -420.53191262
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O   -1.99760767   -1.27485264    0.13491180   -0.01024692   -0.00113546    0.00237283
C   -0.73463431    0.74112324   -0.08579687    0.02810280    0.05931120   -0.00863044
C   -0.83527230   -0.84652076    0.00902854   -0.01068537   -0.03007557   -0.00049624
C    0.28522893    1.61632886   -0.07264523   -0.05809580    0.02243379   -0.00946987
C    0.36896957   -1.65070657   -0.03348082   -0.00056930   -0.00654571    0.00738157
C    1.68181944    1.27722968    0.09593500    0.00472139   -0.02087537    0.01007689
C    1.69175371   -1.21536995   -0.08572516    0.00914663   -0.00006922   -0.00700694
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C    2.33312145    0.05842872    0.02227799   -0.00555846   -0.00544828   -0.01544375
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   15
   -420.53177239
H   -2.65616641    0.53516325    0.14196196   -0.02901286   -0.00680375    0.00928237
O   -1.94229683    1.24110290   -0.04107158    0.04912422   -0.01183929   -0.00378997
O   -2.00033170   -1.26577699    0.12329266   -0.01673836   -0.00135839    0.00219808
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C   -0.82874273   -0.84209942    0.00907574   -0.00211481   -0.02893801   -0.00214508
C    0.28578546    1.60463425   -0.07432808   -0.06141733    0.01695231   -0.00951907
C    0.37064311   -1.65199513   -0.03110213    0.00004822   -0.00947275    0.00687903
C    1.68426728    1.27130554    0.09321457    0.01677151   -0.02782527    0.01161883
C    1.69069907   -1.21732724   -0.07484451    0.00949767   -0.00709147   -0.00507801
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H    2.27220801    2.18982320    0.24561162   -0.00303637    0.01044967    0.00110485
H    2.36073709   -2.04407352   -0.09712234   -0.01553977    0.01176502    0.00143723
C    2.32961915    0.06799338    0.01850295   -0.00203296    0.01104697   -0.01189727
H    3.42542790    0.08898726    0.20469342    0.01474722    0.00440569    0.00717846
   15
   -420.53334262
H   -2.63888075    0.51730831    0.17466334   -0.02741098   -0.00812631    0.01146850
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O   -2.00229923   -1.25664103    0.11157446   -0.02246509   -0.00122772    0.00184808
C   -0.73500429    0.74701504   -0.05866353    0.02878589    0.07752404   -0.00478549
C   -0.82208354   -0.83593408    0.00925226    0.00612234   -0.02655040   -0.00371169
C    0.28999568    1.59197841   -0.07543363   -0.05306357   -0.00073501   -0.00982470
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   15
   -420.53452975
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O   -2.00325306   -1.24745143    0.09977299   -0.02672303   -0.00053036    0.00133304
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C    0.29736234    1.57937630   -0.07594849   -0.03434361   -0.02039058   -0.00948373
C    0.37395226   -1.65245802   -0.02753938    0.00130492   -0.02182014    0.00495349
C    1.68550182    1.26457096    0.08559888    0.03324432   -0.02980232    0.01316072
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H    3.37724578    0.09522520    0.09398222   -0.02119767    0.00283918   -0.00115811
   15
   -420.53471675
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O   -2.00300262   -1.23823983    0.08791145   -0.02880302    0.00082153    0.00066610
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C   -0.81027193   -0.81904060    0.01035599    0.01781967   -0.01726295   -0.00605267
C    0.30677620    1.56796739   -0.07589317   -0.00969653   -0.03244080   -0.00849801
C    0.37550681   -1.65091807   -0.02624013    0.00289347   -0.02492489    0.00375965
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C    1.68608018   -1.22119294   -0.04093427   -0.01747057    0.00337796    0.00221126
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   15
   -420.53511394
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O   -2.00145571   -1.22906836    0.07602040   -0.02809558    0.00293116   -0.00017973
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C    0.31677301    1.55847102   -0.07532466    0.01564972   -0.03464676   -0.00738739
C    0.37688060   -1.64789740   -0.02516892    0.00559973   -0.02284721    0.00268181
C    1.67941005    1.26518827    0.07490816    0.01647090   -0.03616190    0.00987252
C    1.68583467   -1.22248426   -0.02969604   -0.02327847    0.00489592    0.00442715
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H    2.41055667   -2.07239111   -0.07240019    0.00837539   -0.01482291   -0.00044673
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   15
   -420.53597687
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O   -1.99864585   -1.22003235    0.06413816   -0.02426287    0.00566178   -0.00121476
C   -0.75037236    0.70844931   -0.00258614   -0.01777036    0.01975842    0.00985762
C   -0.80252932   -0.79811081    0.01289120    0.01769338   -0.00111235   -0.00680498
C    0.32584433    1.55102677   -0.07430730    0.03679304   -0.02810074   -0.00670814
C    0.37791174   -1.64351465   -0.02426076    0.00908458   -0.01691089    0.00175329
C    1.67452472    1.26863938    0.06860384   -0.00348015   -0.03903934    0.00754010
C    1.68697024   -1.22405039   -0.01872340   -0.02376237    0.00221992    0.00621716
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H    2.41858471   -2.06306563   -0.06635882    0.00836762   -0.01241923   -0.00066056
C    2.30374460    0.08882139    0.00645407   -0.01318523    0.05422311   -0.00069412
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   15
   -420.53580510
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O   -1.99474613   -1.21125447    0.05231160   -0.01753498    0.00875961   -0.00238343
C   -0.75338636    0.69277684    0.01056910   -0.02288623   -0.00446115    0.01346835
C   -0.80029305   -0.78728600    0.01476824    0.01244523    0.00930793   -0.00658857
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C    0.37839446   -1.63811131   -0.02345837    0.01236213   -0.01050875    0.00076910
C    1.66985346    1.27441710    0.06183989   -0.02420073   -0.03524081    0.00592517
C    1.68951412   -1.22573187   -0.00812434   -0.01853992   -0.00413625    0.00752593
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H    2.42085071   -2.04511536   -0.05986204    0.00399864   -0.00470420   -0.00053526
C    2.29769761    0.08386715    0.00452439   -0.02654569    0.04594861    0.00149711
H    3.41235256    0.08749548   -0.11182213    0.01962221    0.00041666   -0.00946187
   15
   -420.53346921
H   -2.47188149    0.36342546    0.23977133    0.01342822   -0.01216556    0.01527403
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O   -1.99005833   -1.20287508    0.04059287   -0.00884216    0.01215919   -0.00345496
C   -0.75504596    0.67737283    0.02291507   -0.02214452   -0.02839319    0.01603499
C   -0.79879888   -0.77702738    0.01704226    0.00514976    0.02035693   -0.00608169
C    0.33665539    1.54028790   -0.07102467    0.05327180    0.00426060   -0.00840821
C    0.37813730   -1.63206004   -0.02270129    0.01413547   -0.00651686   -0.00048470
C    1.66662182    1.28228416    0.05471277   -0.04023756   -0.02321089    0.00529451
C    1.69315592   -1.22715573    0.00202179   -0.00877600   -0.01183679    0.00840818
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C    2.29320480    0.07616106    0.00250763   -0.02980754    0.03229969    0.00302630
H    3.41418562    0.08404829   -0.15105164    0.02467701    0.00059934   -0.01187424
   15
   -420.53054909
H   -2.48463828    0.32965030    0.22669661    0.00638997   -0.02092294    0.01767889
O   -1.98164741    1.22015411   -0.02261600   -0.00589583    0.03371897   -0.02028625
O   -1.98497098   -1.19504886    0.02902922    0.00027513    0.01596862   -0.00407950
C   -0.75538643    0.66367448    0.03429729   -0.01735449   -0.04997639    0.01740406
C   -0.79761655   -0.76799654    0.01968316   -0.00208706    0.03070271   -0.00538713
C    0.33739286    1.53509888   -0.06865931    0.04970218    0.01729196   -0.01013656
C    0.37703775   -1.62559676   -0.02191284    0.01345262   -0.00606117   -0.00214360
C    1.66578047    1.29152057    0.04726152   -0.04776742   -0.00435467    0.00545396
C    1.69732491   -1.22788029    0.01166034    0.00166497   -0.01613606    0.00912850
H    0.01090908    2.52288582   -0.20875015    0.00490438   -0.03039092   -0.00079365
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H    2.42210688   -2.00709503   -0.04605146   -0.00886587    0.01515816    0.00030404
C    2.29046757    0.06651873    0.00031477   -0.02358669    0.01520747    0.00318910
H    3.39884879    0.08015362   -0.18182376    0.01964071    0.00104681   -0.01270982
   15
   -420.52944790
H   -2.50210387    0.31061254    0.20107484    0.00110739   -0.02421532    0.01705332
O   -1.98728140    1.21704034   -0.01792638   -0.00940399    0.03898955   -0.01988054
O   -1.97989147   -1.18794903    0.01764797    0.00814879    0.02026983   -0.00401220
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C   -0.79631858   -0.76081043    0.02264922   -0.00724648    0.03862106   -0.00456546
C    0.33513691    1.52895294   -0.06569060    0.04332059    0.01319284   -0.00999074
C    0.37513873   -1.61875127   -0.02099307    0.00997226   -0.00863225   -0.00413478
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C    1.70141479   -1.22767167    0.02074579    0.00799011   -0.01213243    0.01004036
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H    2.42982435   -2.00071391   -0.03929742   -0.00872232    0.01738710    0.00030517
C    2.28911701    0.05596262   -0.00206161   -0.00957320   -0.00310590    0.00157855
H    3.36994125    0.07549993   -0.20357229    0.00516615    0.00153836   -0.01140267
   15
   -420.52950287
H   -2.52049327    0.30875711    0.16331999   -0.00202440   -0.02313348    0.01397593
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O   -1.97517204   -1.18177010    0.00644619    0.01347651    0.02487473   -0.00327276
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C   -0.79459921   -0.75593882    0.02589092   -0.00904020    0.04232032   -0.00365069
C    0.33027074    1.52209687   -0.06213214    0.03480055   -0.00779202   -0.00710301
C    0.37264854   -1.61137868   -0.01982264    0.00407886   -0.01209366   -0.00622278
C    1.67246494    1.30936603    0.03133286   -0.03400591    0.04094536    0.00647463
C    1.70504980   -1.22677356    0.02922267    0.00894829    0.00037224    0.01120328
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H    2.44341132   -2.00637550   -0.03272794   -0.00195288    0.01187261   -0.00025819
C    2.28832685    0.04558971   -0.00452616    0.00780528   -0.02054424   -0.00139264
H    3.33765895    0.06975254   -0.21722681   -0.01474411    0.00181899   -0.00826039
   15
   -420.52879259
H   -2.53760025    0.32328132    0.11560005   -0.00220054   -0.01732703    0.00927281
O   -1.99709869    1.20568194   -0.00599116   -0.01738752    0.02733418   -0.01274331
O   -1.97105236   -1.17671890   -0.00460849    0.01574019    0.02928607   -0.00214553
C   -0.75185993    0.64411032    0.06217497    0.00512263   -0.07616653    0.01520167
C   -0.79235184   -0.75359875    0.02935305   -0.00711837    0.04048836   -0.00265961
C    0.32332074    1.51573188   -0.05814972    0.02228376   -0.03304000   -0.00309658
C    0.36991819   -1.60328724   -0.01827728   -0.00312310   -0.01302954   -0.00803243
C    1.67919010    1.31528579    0.02279738   -0.01901605    0.05734783    0.00663880
C    1.70815381   -1.22591413    0.03702244    0.00788233    0.01606630    0.01227181
H    0.04714990    2.56424611   -0.25564080    0.00443070    0.00742188   -0.00740692
H    0.12617118   -2.64922600   -0.09062856    0.00005715    0.00785286   -0.00058758
H    2.37038191    2.12800750   -0.00237448   -0.00274143   -0.01557806    0.00342795
H    2.45825593   -2.02037377   -0.02595719    0.00729627    0.00280002   -0.00107569
C    2.28709743    0.03644645   -0.00690918    0.01855652   -0.03542819   -0.00376787
H    3.31572098    0.06270673   -0.22492492   -0.02993076    0.00192148   -0.00531250
   15
   -420.52858443
H   -2.55333195    0.34995137    0.06122229    0.00108027   -0.00609291    0.00428594
O   -2.00091445    1.19796767    0.00093826   -0.02310425    0.01023528   -0.00810187
O   -1.96763669   -1.17299348   -0.01556573    0.01531306    0.03294134   -0.00101400
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C   -0.78968976   -0.75367835    0.03297567   -0.00207897    0.03290375   -0.00159631
C    0.31504202    1.51133223   -0.05397608    0.00608902   -0.05207828    0.00017831
C    0.36737507   -1.59443747   -0.01624910   -0.01004151   -0.00820869   -0.00925588
C    1.68707815    1.31779481    0.01386054   -0.00637471    0.06247219    0.00679469
C    1.71077243   -1.22601030    0.04408249    0.00840321    0.02865331    0.01286414
H    0.05085283    2.58578454   -0.26387420    0.00316760    0.02083089   -0.00995099
H    0.11533311   -2.63635164   -0.08517044   -0.00043243    0.00994694   -0.00022260
H    2.37745635    2.12953594   -0.04052093   -0.00248173   -0.01515517    0.00278656
H    2.46799033   -2.03647994   -0.01842149    0.01427204   -0.00488360   -0.00174376
C    2.28483429    0.02942600   -0.00908038    0.01236449   -0.04630333   -0.00309451
H    3.31434738    0.05427622   -0.22861741   -0.02927429    0.00203805   -0.00515596
   15
   -420.52957297
H   -2.56994794    0.38082439    0.00367388    0.00600251    0.00782526    0.00069543
O   -2.00368031    1.18980474    0.00824094   -0.02896342   -0.01073612   -0.00489198
O   -1.96490930   -1.17075849   -0.02647595    0.01317274    0.03546285   -0.00014304
C   -0.75026490    0.65295125    0.07607223    0.02022230   -0.05126765    0.01121802
C   -0.78691119   -0.75572452    0.03669437    0.00478212    0.02070605   -0.00043312
C    0.30640137    1.51003056   -0.04980529   -0.01140839   -0.06085975    0.00188379
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C    1.69537617    1.31658578    0.00450990    0.00162470    0.05582297    0.00750719
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   15
   -420.53076660
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O   -1.96277681   -1.17012817   -0.03737839    0.01030668    0.03680626    0.00039401
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C   -0.78442355   -0.75901089    0.04043847    0.01196944    0.00612245    0.00089535
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   15
   -420.53117580
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O   -1.96111179   -1.17116413   -0.04829749    0.00736644    0.03716946    0.00062962
C   -0.75341428    0.67387530    0.08722780    0.02752036   -0.01083672    0.00849148
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C    0.29215529    1.51810486   -0.04176392   -0.04122519   -0.04246657   -0.00051368
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C    1.71134489    1.30497456   -0.01563998    0.01418725    0.02541459    0.01017756
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   15
   -420.53034507
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O   -1.95978171   -1.17388290   -0.05924461    0.00459688    0.03661551    0.00066176
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C   -0.78197327   -0.76583977    0.04766411    0.02235032   -0.02016359    0.00438140
C    0.28833463    1.52638523   -0.03775200   -0.04973750   -0.01914620   -0.00378174
C    0.36578649   -1.56158458   -0.00236241   -0.01819061    0.03819989   -0.00945351
C    1.71823232    1.29636826   -0.02659438    0.02330963    0.01025101    0.01090099
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   15
   -420.52964823
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O   -1.95866078   -1.17825955   -0.07022094    0.00200314    0.03509676    0.00045779
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C    0.28748302    1.53584711   -0.03351818   -0.05041816   -0.00057001   -0.00571625
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C    1.72370086    1.28712416   -0.03820240    0.03421133   -0.00135522    0.01049282
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   15
   -420.53082676
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O   -1.95763132   -1.18422461   -0.08121716   -0.00042555    0.03248232    0.00002400
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C    2.29482726    0.04049852   -0.02315077   -0.02903810    0.01609377   -0.00403508
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   15
   -420.53179767
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O   -1.95658341   -1.19165929   -0.09221364   -0.00261399    0.02874654   -0.00063355
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C    1.72778660    1.26920231   -0.06319505    0.05301405   -0.01008243    0.00593826
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   15
   -420.53064932
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O   -1.95541842   -1.20039453   -0.10318062   -0.00436501    0.02401067   -0.00146895
C   -0.78146998    0.72426155    0.10634946   -0.02663355    0.02701705    0.00684880
C   -0.79281866   -0.76321018    0.05778082    0.01362434   -0.02401144    0.01357914
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C    1.72530111    1.26107647   -0.07631265    0.05414381   -0.01195125    0.00345637
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C    2.31493258    0.04768087   -0.02755635    0.01094086    0.04006647   -0.01014388
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   15
   -420.52955297
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O   -1.95405810   -1.21021626   -0.11408076   -0.00537523    0.01847184   -0.00234550
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C   -0.79826000   -0.75843725    0.05860585    0.00654775   -0.01538441    0.01548590
C    0.30651385    1.57557408   -0.01422000    0.01190747   -0.01402439    0.00096307
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C    1.71958895    1.25369339   -0.08964772    0.04592479   -0.01749903    0.00257026
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   15
   -420.53053301
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O   -1.95245763   -1.22087360   -0.12487490   -0.00540158    0.01227228   -0.00310787
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C    0.31211565    1.58710195   -0.00932522    0.02254198   -0.00605058    0.00066620
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C    1.71114021    1.24738240   -0.10314556    0.02968738   -0.02556795    0.00306395
C    1.68910877   -1.26147172    0.07810610   -0.04070738   -0.01485021    0.00264386
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C    2.33348527    0.04558634   -0.02962157    0.00662865    0.04313191   -0.01123340
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   15
   -420.53259221
H   -2.50196624    0.41173189   -0.30045087    0.01605202    0.01118190   -0.00886392
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C   -0.78709415    0.73750251    0.11278692   -0.03871591    0.00595603    0.00440192
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C    0.38205629   -1.57134646    0.04313334    0.03436645    0.00996106   -0.00550451
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C    1.68924439   -1.26033939    0.07921448   -0.03939952   -0.01653655    0.00112704
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H    2.34091278   -2.15522501    0.12197061    0.00082740   -0.01395906    0.00146978
C    2.34195542    0.04063301   -0.02964635   -0.00072358    0.03603396   -0.01107552
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   15
   -420.53322172
H   -2.49407824    0.37805898   -0.29180755    0.01018535   -0.00326738   -0.01516553
O   -2.02442515    1.18647533    0.08604560    0.00956166   -0.01458008    0.01102830
O   -1.94857426   -1.24354581   -0.14601532   -0.00288510   -0.00169440   -0.00422283
C   -0.78425754    0.74056432    0.11433973   -0.02898543   -0.00140304    0.00420367
C   -0.81496145   -0.74113197    0.05516380   -0.01815819    0.01655907    0.01810284
C    0.31912711    1.61020470    0.00040349    0.02258088    0.03152347   -0.00114366
C    0.37953054   -1.57696060    0.05137531    0.03255988    0.00595138   -0.00447671
C    1.69008205    1.23966624   -0.13070057   -0.00883961   -0.02989852    0.00188530
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H    2.32217096    2.12150796   -0.37749696    0.00402279    0.01148152   -0.00874435
H    2.33021362   -2.13858162    0.13405822   -0.00636852   -0.00389210    0.00125762
C    2.35043083    0.03352507   -0.02900600   -0.00070839    0.02403001   -0.00998626
H    3.47376520    0.01194539    0.03320044    0.02380436   -0.00358573    0.00805540
   15
   -420.53188852
H   -2.49360213    0.34654355   -0.27241004    0.00542019   -0.01477512   -0.01891683
O   -2.02988240    1.19590278    0.09186779    0.00554463    0.00414144    0.01489945
O   -1.94640181   -1.25492874   -0.15630933   -0.00134749   -0.00895299   -0.00498499
C   -0.77968845    0.74370278    0.11563640   -0.01514539   -0.00712007    0.00438359
C   -0.81900306   -0.73650312    0.05186802   -0.02459415    0.02534617    0.01798754
C    0.32051776    1.61954422    0.00533963    0.01536006    0.05315739   -0.00123252
C    0.37506244   -1.58291787    0.05988809    0.02542977   -0.00135271   -0.00345886
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   15
   -420.53096298
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   15
   -420.53140517
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   15
   -420.53047722
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   15
   -420.52788352
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O   -1.93710468   -1.29370064   -0.19458012   -0.00556625   -0.02733525   -0.01118256
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   15
   -420.52647489
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C   -0.81624943   -0.74093797    0.01967053   -0.00840858    0.02460246    0.01424726
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   15
   -420.52739014
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   15
   -420.52927834
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   15
   -420.52997860
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C    0.34554045   -1.58879614    0.13023848   -0.04529645   -0.00217121    0.00305369
C    1.66372752    1.21680840   -0.22548316   -0.02381724   -0.01119643   -0.02983600
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   15
   -420.52951850
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O   -1.91937136   -1.31623567   -0.23141513   -0.00853397   -0.01912530   -0.01067828
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   15
   -420.53047608
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C   -0.80117716   -0.77522954   -0.03266269    0.01477887   -0.02658448    0.00058906
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C    1.72578954   -1.25000301    0.11314123    0.03529835   -0.00727817   -0.00707182
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C    2.32469451    0.01996757   -0.02839951   -0.00933176    0.00490903    0.01455747
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   15
   -420.53218302
H   -2.69760678    0.53416193    0.35246555   -0.01747755   -0.00677877    0.01222412
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O   -1.90945280   -1.31827255   -0.24255818   -0.00346502   -0.00916694   -0.00690543
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C    0.36945483   -1.57590370    0.15448871   -0.02104124    0.00740552    0.00470317
C    1.68307740    1.20421463   -0.22896386    0.02044159   -0.04026260   -0.02630976
C    1.72059963   -1.25665079    0.11955923    0.02112756   -0.01336589   -0.00611820
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C    2.31539038    0.02937424   -0.03294259   -0.00304743    0.02793030    0.01174511
H    3.39287763    0.03953501   -0.09808439   -0.00601892    0.00019851    0.00137005
   15
   -420.53097031
H   -2.69015182    0.57675663    0.38737568   -0.00544566    0.00584497    0.00879857
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O   -1.90419559   -1.31855002   -0.24761414    0.00016358   -0.00398436   -0.00468695
C   -0.80570846    0.77533473    0.09790111   -0.02460598    0.02788342    0.01171752
C   -0.80025578   -0.78213136   -0.05518700    0.00727532   -0.03804835   -0.00726958
C    0.32523500    1.60573558    0.03819622    0.02104048    0.01341058    0.00903757
C    0.38084284   -1.57242572    0.16206196   -0.00391594    0.00715384    0.00566071
C    1.68840185    1.20432362   -0.22682048    0.03511120   -0.04176137   -0.02427564
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   15
   -420.52744817
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   15
   -420.52597557
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   15
   -420.52793084
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O   -1.88919912   -1.31909472   -0.26186989    0.01135340    0.00686296    0.00055437
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   15
   -420.53030237
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   15
   -420.53072733
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O   -1.88143084   -1.32068779   -0.27135478    0.01341904    0.00643628    0.00185813
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   15
   -420.53037521
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   15
   -420.53113519
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   15
   -420.53039877
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O   -1.87403108   -1.32481565   -0.28620081    0.00775954   -0.00292234    0.00195893
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   15
   -420.52596210
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   15
   -420.52169829
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O   -1.87106296   -1.32719613   -0.29654170    0.00576566   -0.00768300    0.00163869
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   15
   -420.52086888
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O   -1.86998778   -1.32791232   -0.30182770    0.00689427   -0.00802516    0.00150498
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C    1.73057912   -1.24949150    0.20572781    0.02524082    0.03055256    0.00009687
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H    2.41733673   -2.11623729    0.39541056    0.00886921   -0.01863843    0.00374940
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   15
   -420.52244555
H   -2.66217317    0.63720998    0.38819207   -0.00617720   -0.01290326    0.00790710
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O   -1.86923051   -1.32827032   -0.30718241    0.00937231   -0.00680642    0.00149188
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C    0.36389409   -1.57383507    0.22500997   -0.03686673   -0.01371021   -0.00042026
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C    1.73186262   -1.24741160    0.21242795    0.03016012    0.02411563    0.00307022
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   15
   -420.52446593
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   15
   -420.52597253
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   15
   -420.52762857
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   15
   -420.52958657
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   15
   -420.52917970
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   15
   -420.52597783
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   15
   -420.52266629
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   15
   -420.52134114
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   15
   -420.52233923
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   15
   -420.52410338
H   -2.70963955    0.79488694   -0.02805177   -0.01648193   -0.00255266   -0.01032285
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   15
   -420.52467438
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   15
   -420.52472858
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C    2.30390213    0.02559646   -0.20488829    0.00062086    0.00468420   -0.01655160
H    3.39801757    0.05603310   -0.32100593    0.00948705    0.00275172   -0.00263996
   15
   -420.52519916
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   15
   -420.52424517
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   15
   -420.52093489
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   15
   -420.51843628
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   15
   -420.51950309
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C   -0.84761701   -0.79085957   -0.08480921   -0.00509194    0.02431009    0.00442506
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   15
   -420.52290861
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C    1.67227279    1.25676233   -0.20286399   -0.02332185    0.01687439   -0.00292520
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   15
   -420.52538572
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   15
   -420.52642620
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C    1.69615721    1.26035248   -0.21699676   -0.01366177   -0.00993283   -0.00447811
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   15
   -420.52840290
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   15
   -420.53027663
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   15
   -420.52901450
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   15
   -420.52629397
H   -2.63135666    0.52844633   -0.03196555   -0.01285556   -0.01682766   -0.01373356
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C   -0.85832987   -0.80243691   -0.08605813   -0.03050044   -0.02148660   -0.00569969
C    0.35316537    1.57761776   -0.03912859    0.04317060    0.01257792   -0.00834540
C    0.34089286   -1.52534878    0.31057089    0.01644709    0.02691798    0.00187769
C    1.74688210    1.27693094   -0.24180508    0.03892440   -0.01907039   -0.00698939
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H    0.11732316   -2.53631734    0.66657063    0.00013923   -0.00074951    0.00478776
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H    2.42982638   -1.99594168    0.39540788    0.01944910   -0.00728397   -0.00078659
C    2.30903228    0.05286910   -0.13988700    0.01414520    0.04110968   -0.00874939
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   15
   -420.52556454
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O   -1.99540541    1.23150896    0.31773601   -0.00395005    0.02088856    0.01704931
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   15
   -420.52705071
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   15
   -420.52802378
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O   -1.93266419   -1.29856815   -0.40647070   -0.00654943   -0.00095657   -0.00889166
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C    1.64849870   -1.22479490    0.19527785   -0.02865408   -0.03514560    0.00240222
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   15
   -420.52677259
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C   -0.75401925    0.69883404    0.10401575    0.00140918    0.01128381    0.01039931
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C    0.34470764    1.54772716   -0.03161075    0.00112046    0.01161659    0.00067685
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C    1.65060829   -1.22480466    0.19373146   -0.01050190   -0.03961019    0.00148626
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C    2.30913611    0.05921411   -0.10871443   -0.01776495    0.02575078    0.00435890
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   15
   -420.52534036
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O   -1.93114362   -1.28709759   -0.40454180   -0.01687816   -0.00534693   -0.01216689
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C   -0.82355904   -0.78771638   -0.08035767    0.01231877   -0.03029953    0.00089949
C    0.34011848    1.53915971   -0.02935532   -0.01308872    0.00789075    0.00378005
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C    1.76378901    1.31933515   -0.26425569    0.03691521    0.02254264   -0.00626189
C    1.65337066   -1.22245346    0.19210203    0.00428728   -0.03724138   -0.00077296
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   15
   -420.52512590
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C   -0.81648229   -0.77880646   -0.07904002    0.01931913   -0.02224202    0.00139070
C    0.33629195    1.53019892   -0.02732583   -0.02174142   -0.01170082    0.00637134
C    0.31306494   -1.54218524    0.31289397   -0.00626223    0.00236336    0.01358028
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H    0.08099938    2.56154767   -0.01023740    0.00875217   -0.02003683   -0.00046112
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C    2.31372261    0.05124248   -0.09371353   -0.00165030   -0.00032315    0.01111611
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   15
   -420.52386080
H   -2.59972631    0.38492782    0.31173355   -0.00900892   -0.01104407    0.00804461
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C   -0.75650279    0.70685093    0.11041840    0.00919145    0.02456858    0.00865745
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C    0.33375737    1.52198647   -0.02568073   -0.02572547   -0.03913291    0.00873393
C    0.30649504   -1.54846259    0.31134916   -0.01597440   -0.00470931    0.01521874
C    1.75354498    1.33170286   -0.27052380    0.03217583    0.05911634   -0.01249830
C    1.65784311   -1.21193574    0.18923572    0.01114789   -0.00408328   -0.00912509
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H    2.35136216    2.16582246   -0.64597461    0.00241009    0.00281188   -0.00910036
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C    2.31646858    0.04688378   -0.08712606    0.01093300   -0.01145013    0.01303979
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   15
   -420.52100160
H   -2.59718508    0.36475972    0.34964563   -0.01378287   -0.01788302    0.01078169
O   -1.99572979    1.18257758    0.28079525    0.01120393   -0.00118560   -0.00862580
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C   -0.75825982    0.70676923    0.11143190    0.00773908    0.02213780    0.00750819
C   -0.80605023   -0.75766371   -0.07663546    0.02502030    0.00212388    0.00042634
C    0.33275928    1.51611064   -0.02456129   -0.02574740   -0.06087962    0.01061325
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C    1.74544402    1.33308993   -0.27263227    0.02915439    0.07271222   -0.01587584
C    1.65910015   -1.20571218    0.18849175    0.01030345    0.01490452   -0.01292044
H    0.13331486    2.61498883   -0.03945536    0.01001536    0.01585124   -0.00245593
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H    2.29917688   -2.10259057    0.32566657   -0.00039062   -0.01603685    0.00042691
C    2.31857475    0.04320179   -0.08132548    0.01930320   -0.01935308    0.01462560
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   15
   -420.51940438
H   -2.58513971    0.35701790    0.37985643   -0.01157417   -0.01725648    0.01247485
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O   -1.91870439   -1.26064203   -0.39387032   -0.01490327   -0.00944385   -0.01232384
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C   -0.80303964   -0.74689352   -0.07549164    0.02371195    0.01626838   -0.00076717
C    0.33329493    1.51385149   -0.02407835   -0.02112668   -0.06985018    0.01144161
C    0.29670823   -1.55997294    0.30546834   -0.03032328   -0.01016683    0.01605017
C    1.73559618    1.33011945   -0.27379048    0.02289545    0.07839441   -0.01730492
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H    0.14885803    2.63128384   -0.05181100    0.01098970    0.02433263   -0.00339373
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C    2.31955834    0.04066979   -0.07641177    0.01902796   -0.02318413    0.01665739
H    3.37008312   -0.01426651   -0.27000393   -0.01392104    0.00412730   -0.00085819
   15
   -420.52071782
H   -2.56515301    0.36124783    0.40120584   -0.00284156   -0.00908077    0.01213896
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O   -1.91363603   -1.25298529   -0.38973037   -0.00959123   -0.00780505   -0.01034619
C   -0.76280048    0.70302461    0.11215464   -0.00607542    0.00648572    0.00572613
C   -0.80144995   -0.73710384   -0.07429983    0.01976465    0.02973342   -0.00227745
C    0.33508452    1.51574698   -0.02428024   -0.01184285   -0.06489408    0.01085944
C    0.29436223   -1.56486208    0.30107805   -0.03551485   -0.01118187    0.01600278
C    1.72438675    1.32245726   -0.27391754    0.01216457    0.07434934   -0.01573676
C    1.65968473   -1.19660261    0.18945735    0.01326599    0.03066181   -0.01548386
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C    2.31942761    0.03951823   -0.07250743    0.01165916   -0.02268540    0.01902709
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   15
   -420.52325234
H   -2.54335944    0.37168474    0.41393521    0.00969546    0.00435763    0.00984032
O   -1.99440904    1.16764796    0.26835254    0.00082149   -0.02841223   -0.00962026
O   -1.90813919   -1.24497942   -0.38512335   -0.00249569   -0.00482102   -0.00774891
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C   -0.80104292   -0.72910090   -0.07296910    0.01328455    0.04089830   -0.00402586
C    0.33757554    1.52150173   -0.02513185    0.00034429   -0.04689951    0.00887811
C    0.29415773   -1.56907049    0.29571961   -0.03939783   -0.01304244    0.01600383
C    1.71245690    1.31034189   -0.27310523   -0.00150529    0.06171579   -0.01174933
C    1.65883400   -1.19465663    0.19132026    0.01697143    0.02477376   -0.01390498
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H    0.05273150   -2.63603178    0.44944120   -0.00258520   -0.01228398    0.00143452
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C    2.31859753    0.03971795   -0.06974981    0.00306752   -0.01807487    0.02060920
H    3.39437122   -0.02478125   -0.28592276    0.00624622    0.00083392   -0.00522606
   15
   -420.52463914
H   -2.52838953    0.37910990    0.41958866    0.01946813    0.01537542    0.00745605
O   -1.99446677    1.16444984    0.26513282   -0.00620790   -0.04004056   -0.00772664
O   -1.90253527   -1.23675944   -0.38016575    0.00621647   -0.00057517   -0.00488216
C   -0.76578598    0.69783140    0.11148182   -0.02364566   -0.01480085    0.00436718
C   -0.80142732   -0.72355245   -0.07139418    0.00444754    0.04829871   -0.00592810
C    0.34004591    1.53004272   -0.02651518    0.01259536   -0.01919462    0.00587439
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C    1.70061449    1.29452137   -0.27158596   -0.01446044    0.04357675   -0.00702686
C    1.65695649   -1.19417145    0.19401618    0.02064728    0.01158424   -0.01075586
H    0.14533778    2.58969855   -0.07368205    0.01353060   -0.00722078   -0.00258527
H    0.09758192   -2.64764326    0.42694196    0.00280971   -0.01188472    0.00084732
H    2.31951828    2.12240911   -0.64075212    0.00472584    0.00339226   -0.00838426
H    2.28592195   -2.06606100    0.32468179   -0.01052006   -0.00116979   -0.00100385
C    2.31756223    0.04099357   -0.06822895   -0.00177570   -0.01000845    0.02031875
H    3.40386957   -0.03160068   -0.28910600    0.01347022   -0.00117887   -0.00658510
   15
   -420.52532880
H   -2.52681984    0.37620947    0.41971512    0.01928600    0.01446697    0.00759133
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O   -1.89721753   -1.22851732   -0.37498612    0.01598481    0.00470540   -0.00213083
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   15
   -420.52707025
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   15
   -420.52907967
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O   -1.88919035   -1.21294244   -0.36443684    0.03359998    0.01620517    0.00187389
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   15
   -420.52900295
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O   -1.88726695   -1.20612551   -0.35924729    0.03798289    0.02084998    0.00269144
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C    0.33632727    1.56400089   -0.03398883    0.04682331    0.00565508   -0.00052049
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C    1.66511348    1.21720060   -0.26308273   -0.01372323   -0.03240648   -0.00062714
C    1.64011031   -1.19305276    0.20933310   -0.03232527   -0.00030378   -0.00160406
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   15
   -420.52754074
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O   -1.88704872   -1.20024813   -0.35417591    0.03755082    0.02379593    0.00247725
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C    0.32940666    1.57062603   -0.03586073    0.04574113   -0.00339231    0.00014507
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C    1.65914445    1.20011447   -0.26083195   -0.00367175   -0.04664297   -0.00159029
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   15
   -420.52727119
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O   -1.88851536   -1.19544292   -0.34921286    0.03214289    0.02477174    0.00118323
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C    0.31975835    1.57742286   -0.03774309    0.03697717   -0.00588090    0.00114573
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C    1.65340723    1.18584393   -0.25848691    0.00449699   -0.05971162   -0.00221509
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   15
   -420.52864957
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O   -1.89142591   -1.19175513   -0.34430000    0.02288324    0.02402061   -0.00104838
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C   -0.78142746   -0.75536087   -0.04648266   -0.01530864   -0.00759201   -0.00126052
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C    2.29800928    0.03171365   -0.07822923    0.00113583    0.03704088   -0.00288864
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   15
   -420.53002554
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   15
   -420.53024563
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   15
   -420.52969485
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C   -0.73303740    0.73109014    0.10276382    0.04927406    0.02887488   -0.00478009
C   -0.75624013   -0.77685426   -0.03205991    0.02194009   -0.03266497    0.01317359
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C    2.28289098    0.00053692   -0.08305432   -0.02122200   -0.01309334    0.00185890
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   15
   -420.52997553
H   -2.59637057    0.41594061    0.04034776   -0.01218825   -0.00664047   -0.00458734
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O   -1.90851269   -1.18692658   -0.32291087   -0.01498330    0.01486311   -0.01072140
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   15
   -420.53030648
H   -2.59405007    0.41672623   -0.01476696   -0.01647304   -0.01270201   -0.01008105
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O   -1.91199252   -1.18768017   -0.31657800   -0.01910101    0.01271118   -0.01139576
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C   -0.74465122   -0.78224422   -0.02588351    0.03601174   -0.03674650    0.01916215
C    0.25448215    1.60814665   -0.05256726   -0.05351506    0.00624434    0.00540212
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C    1.70874458   -1.20387222    0.24140291    0.00982823    0.04687146    0.00162217
H    0.03482360    2.66139273   -0.08305204    0.00146476   -0.00606014    0.00052968
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H    2.31583568    2.01165091   -0.39887426    0.00562760   -0.00066209    0.00362818
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C    2.27831188   -0.01830161   -0.08661837   -0.00574377   -0.04867963    0.00256097
H    3.35516022    0.03998587   -0.15200519   -0.00461125    0.00180120    0.00083474
   15
   -420.52916100
H   -2.58029529    0.42629675   -0.06272805   -0.01367297   -0.01274000   -0.01378672
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   15
   -420.52752067
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C   -0.76380517    0.72894028    0.10437808    0.01080578    0.01008646   -0.00233553
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   15
   -420.52692365
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C   -0.77559047    0.72556938    0.10529696   -0.01276746   -0.00193964   -0.00074897
C   -0.74333590   -0.77455564   -0.02528720    0.03349239   -0.02231977    0.01969447
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   15
   -420.52686570
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O   -1.91686520   -1.19581503   -0.28634967   -0.01582870    0.00929555   -0.00702409
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   15
   -420.52604594
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O   -1.91600597   -1.19893519   -0.27781695   -0.01076113    0.00972694   -0.00501848
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C    0.26182997    1.62241541   -0.07090723    0.00072013    0.02066178   -0.00797426
C    0.41043044   -1.61233516    0.10829786   -0.00106397   -0.00020649   -0.01834188
C    1.59251516    1.23837319   -0.21556995   -0.03831422    0.02739158   -0.00042732
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   15
   -420.52417892
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O   -1.91466221   -1.20249708   -0.26905668   -0.00472626    0.01028163   -0.00296629
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C   -0.75914130   -0.75517291   -0.03504820    0.00727564    0.00211629    0.01233161
C    0.26623520    1.62520216   -0.07394495    0.00989683    0.04307969   -0.01084169
C    0.41219458   -1.61863235    0.10080740   -0.00381489   -0.00377861   -0.01925700
C    1.59336498    1.24496629   -0.20986317   -0.04393726    0.02477060    0.00250544
C    1.77646139   -1.29846516    0.25824776    0.05317549   -0.02942196    0.02647619
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   15
   -420.52308997
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C    0.41418611   -1.62469634    0.09447694   -0.00591606   -0.00819934   -0.01924865
C    1.59684566    1.25006456   -0.20430394   -0.04436506    0.02146054    0.00464416
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C    2.26749237    0.00477626   -0.09421366   -0.01258550    0.00209710   -0.02357952
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   15
   -420.52407493
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O   -1.91159785   -1.21104373   -0.25121498    0.00605512    0.01110199    0.00040743
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C   -0.77285042   -0.74198963   -0.04554113   -0.01335791    0.01447328    0.00541420
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C    1.60298054    1.25386188   -0.19902001   -0.03906603    0.01871384    0.00568216
C    1.77984118   -1.33372001    0.25611964    0.04772811   -0.06149150    0.03118165
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H    2.45579176   -2.10423052    0.55257474   -0.01073995    0.00878811    0.00154821
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   15
   -420.52520897
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O   -1.91035860   -1.21606358   -0.24228537    0.00874039    0.01087325    0.00140679
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C    0.41925151   -1.63513395    0.08525165   -0.00483650   -0.01310536   -0.01724135
C    1.61145267    1.25652251   -0.19407413   -0.02874199    0.01689662    0.00562048
C    1.77701665   -1.34611937    0.25224691    0.03106400   -0.05997305    0.02651073
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   15
   -420.52496749
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O   -1.90950661   -1.22157384   -0.23341777    0.00896634    0.00987719    0.00193026
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C    0.27398336    1.61086117   -0.07885875    0.02649834   -0.00114758   -0.01116372
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C    1.62164671    1.25815977   -0.18946432   -0.01521610    0.01533907    0.00480509
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C    2.26927033    0.02939563   -0.08190263    0.00889966    0.02712420   -0.02379750
H    3.33527594    0.11025444   -0.08717835   -0.01481314    0.00048680    0.00359554
   15
   -420.52462963
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O   -1.90905326   -1.22752889   -0.22463649    0.00702330    0.00799387    0.00211985
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C   -0.78671463   -0.72910457   -0.06322227   -0.02690145    0.02250771   -0.00467249
C    0.27216789    1.60440668   -0.07825654    0.01941494   -0.01513876   -0.00910238
C    0.42529303   -1.64264412    0.08017350    0.00535844   -0.00730301   -0.01389849
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C    1.76677441   -1.36025720    0.24002543    0.00025703   -0.05510655    0.01672290
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C    2.26935878    0.03485018   -0.07485743    0.00662621    0.03002141   -0.02150978
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   15
   -420.52504735
H   -2.67294977    0.58121900   -0.02150638    0.00185013    0.01382501   -0.00108589
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O   -1.90891312   -1.23384397   -0.21595080    0.00363703    0.00540261    0.00214429
C   -0.77340182    0.74598949    0.10145023    0.01817642    0.00906515    0.01299697
C   -0.78829997   -0.72737961   -0.06881577   -0.02619736    0.02316505   -0.00778558
C    0.26920707    1.59882680   -0.07710527    0.00661752   -0.02091450   -0.00675508
C    0.42800184   -1.64562225    0.07894731    0.01241994   -0.00360027   -0.01162720
C    1.64395217    1.25884373   -0.18106119    0.01081658    0.00743392    0.00338902
C    1.76118408   -1.36226483    0.23225504   -0.00660592   -0.05703495    0.01436595
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H    2.22985892    2.13448631   -0.41403565   -0.01294441    0.00029232   -0.00083206
H    2.54631002   -2.11618885    0.53521167    0.02204256   -0.01396621    0.01190516
C    2.26908640    0.03850003   -0.06651699   -0.00335177    0.03068139   -0.01810092
H    3.34527420    0.11730668   -0.10549936   -0.00747453    0.00347595    0.00191739
   15
   -420.52588690
H   -2.68742834    0.59367522    0.02806673    0.00703664    0.02232462    0.00211829
O   -2.03063089    1.26826318    0.20321648   -0.02800347   -0.02409197   -0.00460247
O   -1.90893594   -1.24040294   -0.20736224   -0.00029948    0.00248420    0.00212515
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C   -0.78830983   -0.72705259   -0.07393908   -0.02372218    0.02320128   -0.01076191
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   15
   -420.52628319
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O   -2.03599724    1.27348131    0.19707659   -0.02852687   -0.01945681   -0.00306881
O   -1.90894596   -1.24707516   -0.19887022   -0.00402814   -0.00028643    0.00212880
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C    0.26314873    1.59115262   -0.07371026   -0.02805412   -0.00732186   -0.00272504
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C    1.66390991    1.25786916   -0.17352078    0.02456808   -0.00598891    0.00366908
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H    2.51600214   -2.07288193    0.48022115    0.00231615    0.00703617    0.00344924
C    2.26988735    0.04033353   -0.04683428   -0.02402787    0.02652128   -0.00859748
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   15
   -420.52591821
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O   -1.90877622   -1.25373621   -0.19047487   -0.00697041   -0.00256073    0.00215965
C   -0.75882529    0.76069251    0.08843390    0.06202150    0.04437952    0.00919825
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C    0.26210787    1.58827675   -0.07170812   -0.04184284    0.00366007   -0.00143631
C    0.43009482   -1.65325970    0.07877295    0.02787039   -0.01033452   -0.00232147
C    1.67183895    1.25771270   -0.17007519    0.02688916   -0.00938317    0.00340284
C    1.74605813   -1.34619658    0.20368241    0.01017169   -0.07243811    0.01556780
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H    2.49395473   -2.05434696    0.44719660   -0.01044477    0.01903321   -0.00104086
C    2.27216641    0.03876888   -0.03606181   -0.02588694    0.02171158   -0.00345754
H    3.37949686    0.10665798   -0.13928882    0.01380653    0.00657707   -0.00351362
   15
   -420.52742374
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O   -2.04331151    1.28585231    0.18512984   -0.01201433    0.00895641   -0.00091637
O   -1.90829459   -1.26028361   -0.18217758   -0.00875964   -0.00415718    0.00220821
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C    0.42774958   -1.65492150    0.07925982    0.02884391   -0.01826571    0.00077360
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C    1.74048581   -1.33249113    0.19234039    0.01174215   -0.06422890    0.01277610
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H    2.28124220    2.14842934   -0.39800496   -0.00243800    0.01095348   -0.00385128
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C    2.27597519    0.03590075   -0.02507816   -0.02064735    0.01500993    0.00127048
H    3.37544674    0.09421300   -0.14728461    0.01008125    0.00605297   -0.00467460
   15
   -420.53188228
H   -2.72610524    0.54131606    0.21408767   -0.02582323   -0.01177696    0.00467556
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O   -1.90742053   -1.26664534   -0.17398056   -0.00920111   -0.00497755    0.00227036
C   -0.76601309    0.75860895    0.07680779    0.05429795    0.04048098    0.00743616
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C    0.26770112    1.58202886   -0.06752782   -0.03860384   -0.00845163    0.00163907
C    0.42367105   -1.65547925    0.07970266    0.02756130   -0.02606304    0.00329437
C    1.68284246    1.25896766   -0.16372120    0.02543499   -0.00293137    0.00032526
C    1.73425407   -1.31497665    0.18024270    0.00375913   -0.04152134    0.00674996
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C    2.28100406    0.03213305   -0.01416765   -0.00981205    0.00668522    0.00525531
H    3.36445395    0.07745736   -0.15197054    0.00115804    0.00477200   -0.00494374
   15
   -420.53579104
H   -2.70031927    0.53434099    0.25521466   -0.01824794   -0.00965280    0.00649524
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O   -1.90613443   -1.27278438   -0.16588651   -0.00819898   -0.00495874    0.00234566
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C   -0.77244449   -0.74535067   -0.08677694    0.00479543    0.01486866   -0.02048039
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C    0.41793651   -1.65447369    0.07995004    0.02412634   -0.03132920    0.00501178
C    1.68600043    1.25999949   -0.16062831    0.02255030    0.00484234   -0.00215794
C    1.72780556   -1.29498947    0.16773873   -0.00640295   -0.01119406    0.00028191
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H    0.07675941   -2.67727820    0.14436875   -0.00399889    0.00593410   -0.00121777
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C    2.28661728    0.02796609   -0.00357100    0.00268912   -0.00264579    0.00848123
H    3.35274265    0.05728823   -0.15313860   -0.00955144    0.00307559   -0.00454338
   15
   -420.53663027
H   -2.66182331    0.53392257    0.29177296   -0.00369442   -0.00103844    0.00654844
O   -2.04946122    1.30108434    0.16772489   -0.02590691    0.01761269   -0.00231773
O   -1.90448208   -1.27870160   -0.15789877   -0.00566954   -0.00409643    0.00241057
C   -0.78570728    0.74719709    0.06334037    0.01642910    0.01447859    0.00764144
C   -0.76850956   -0.75229621   -0.08595994    0.01229799    0.01079038   -0.02073790
C    0.28207736    1.57798905   -0.06373647   -0.00856788   -0.02966304    0.00431189
C    0.41075286   -1.65159319    0.07989827    0.01869938   -0.03273377    0.00594540
C    1.68780172    1.26073962   -0.15740522    0.01822458    0.01238768   -0.00458549
C    1.72171612   -1.27431732    0.15520841   -0.01125962    0.01777050   -0.00440396
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H    2.46892198   -2.09534610    0.31963484    0.01341117   -0.01383597    0.00423272
C    2.29209003    0.02395973    0.00651387    0.01077907   -0.01205993    0.01147258
H    3.34767109    0.03492342   -0.15103228   -0.01632024    0.00113065   -0.00421180
   15
   -420.53534818
H   -2.62074202    0.53414029    0.32371897    0.01193071    0.00917817    0.00499249
O   -2.04967297    1.30448611    0.16213166   -0.03503062    0.01254557   -0.00085801
O   -1.90257836   -1.28443588   -0.15002013   -0.00157920   -0.00246524    0.00239662
C   -0.79767640    0.73974451    0.05592061   -0.00743151   -0.00077817    0.00803098
C   -0.76531665   -0.75988809   -0.08389178    0.01945819    0.00548636   -0.02038602
C    0.29052835    1.57838205   -0.06219562    0.00535279   -0.02702593    0.00469989
C    0.40244710   -1.64675062    0.07948981    0.01151300   -0.03064111    0.00630328
C    1.68851006    1.26074451   -0.15390788    0.01207106    0.01718876   -0.00641385
C    1.71627091   -1.25468604    0.14293300   -0.00890537    0.04005606   -0.00682785
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C    2.29695759    0.02067680    0.01590316    0.00988474   -0.02026667    0.01475870
H    3.35383359    0.01175514   -0.14583944   -0.01469400   -0.00099962   -0.00474265
   15
   -420.53394900
H   -2.58782448    0.52818716    0.35202405    0.02063647    0.01228816    0.00419506
O   -2.04832475    1.30729402    0.15658131   -0.03658063    0.01379038   -0.00047216
O   -1.90060853   -1.29006042   -0.14224968    0.00397917   -0.00028997    0.00221116
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C   -0.76329580   -0.76780543   -0.08059350    0.02566520   -0.00108238   -0.01946770
C    0.29867649    1.58036493   -0.06093640    0.01517576   -0.01543375    0.00456481
C    0.39345258   -1.64006544    0.07870190    0.00285581   -0.02643895    0.00631342
C    1.68849748    1.25973007   -0.15002687    0.00416353    0.01802522   -0.00741529
C    1.71133493   -1.23742933    0.13106065   -0.00069252    0.05276852   -0.00729836
H    0.01211960    2.66528708   -0.13768708   -0.00869784    0.01962906   -0.00378197
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H    2.39637427    2.05922782   -0.33148233    0.00418598   -0.00778816   -0.00036657
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C    2.30126615    0.01860614    0.02439969    0.00145754   -0.02579792    0.01805475
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   15
   -420.53249876
H   -2.56915028    0.51407764    0.37710898    0.01940411    0.00444791    0.00648898
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O   -1.89882343   -1.29567250   -0.13457855    0.01063448    0.00206590    0.00176066
C   -0.81895109    0.72576401    0.03961885   -0.04768599   -0.02468570    0.00780296
C   -0.76281966   -0.77565183   -0.07612055    0.03038729   -0.00873196   -0.01801515
C    0.30593237    1.58324164   -0.05995088    0.02002386    0.00398944    0.00401489
C    0.38429006   -1.63178419    0.07753301   -0.00677166   -0.02158619    0.00614339
C    1.68823662    1.25764319   -0.14570065   -0.00440228    0.01539056   -0.00778239
C    1.70642152   -1.22330585    0.11962264    0.01132572    0.05394299   -0.00637434
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C    2.30549294    0.01807705    0.03180942   -0.00836334   -0.02762023    0.02038885
H    3.39050892   -0.03066073   -0.12420875    0.00477404   -0.00589425   -0.00712028
   15
   -420.52951858
H   -2.56412050    0.49704317    0.39738762    0.01263759   -0.00800770    0.01091199
O   -2.04108252    1.31045122    0.14569491   -0.01738758    0.03853642   -0.00748711
O   -1.89752225   -1.30137768   -0.12698638    0.01764868    0.00426028    0.00107228
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C   -0.76417283   -0.78296696   -0.07056055    0.03343195   -0.01699037   -0.01607306
C    0.31199794    1.58585546   -0.05920763    0.02089755    0.02733300    0.00339182
C    0.37553784   -1.62219598    0.07599328   -0.01658588   -0.01693903    0.00585567
C    1.68823634    1.25463501   -0.14090512   -0.01185395    0.01085230   -0.00787832
C    1.70081860   -1.21238909    0.10856731    0.02401658    0.04433701   -0.00491363
H    0.08425948    2.63037092   -0.12247897    0.00452816   -0.01192213   -0.00123934
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H    2.42887636    2.04415603   -0.29981951    0.01142966   -0.00596359   -0.00092949
H    2.36520282   -2.05614122    0.16475753   -0.01060081    0.00634329   -0.00230707
C    2.31020481    0.01919845    0.03799427   -0.01413101   -0.02551778    0.02110534
H    3.40765686   -0.04642249   -0.10616604    0.01198310   -0.00805505   -0.00728452
   15
   -420.52621521
H   -2.56819696    0.48556617    0.40984767    0.00577597   -0.01721803    0.01472738
O   -2.03601681    1.30973652    0.14066109   -0.00739977    0.04726334   -0.01087746
O   -1.89701962   -1.30727462   -0.11944262    0.02406023    0.00603311    0.00029006
C   -0.82916946    0.71746535    0.02149595   -0.06523234   -0.03446782    0.00444405
C   -0.76753945   -0.78925500   -0.06403063    0.03480457   -0.02510910   -0.01369974
C    0.31680573    1.58684873   -0.05867254    0.02061128    0.04406833    0.00333204
C    0.36778385   -1.61158126    0.07410020   -0.02541358   -0.01264475    0.00548674
C    1.68893963    1.25097223   -0.13563310   -0.01667429    0.00592061   -0.00796553
C    1.69379110   -1.20413373    0.09781160    0.03102333    0.03103779   -0.00391191
H    0.11809960    2.61900203   -0.11300751    0.00990282   -0.02543884   -0.00028710
H    0.11753569   -2.67558194    0.08868872   -0.00375237   -0.00445443   -0.00071673
H    2.43413751    2.04354002   -0.28310605    0.01319765   -0.00502570   -0.00106255
H    2.33881065   -2.03670515    0.12621529   -0.02105206    0.01969244   -0.00355330
C    2.31573798    0.02184695    0.04291114   -0.01330449   -0.02021918    0.02015981
H    3.41652723   -0.05643298   -0.08294352    0.01339535   -0.00940848   -0.00636979
   15
   -420.52641074
H   -2.57659329    0.48609121    0.41184880    0.00153106   -0.01988735    0.01614345
O   -2.03060052    1.30691011    0.13611093   -0.00131211    0.04738924   -0.01165870
O   -1.89760282   -1.31344307   -0.11191240    0.02893657    0.00719493   -0.00042784
C   -0.82857670    0.71632322    0.01197328   -0.06527609   -0.03366401    0.00154811
C   -0.77300279   -0.79403016   -0.05667382    0.03448804   -0.03209856   -0.01098448
C    0.32036037    1.58526937   -0.05834388    0.02142814    0.04303621    0.00418316
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   15
   -420.52992467
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   15
   -420.53265218
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   15
   -420.53329177
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C    1.70155517    1.23536233   -0.10970780   -0.00516958   -0.01253233   -0.00716039
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   15
   -420.53375303
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   15
   -420.53486841
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   15
   -420.53452006
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   15
   -420.53150628
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C    1.64896753   -1.19793682    0.01728331   -0.04674286   -0.02068473   -0.00328335
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   15
   -420.52888956
H   -2.71646617    0.57438872    0.16147136   -0.02768534   -0.00341861    0.00496959
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O   -1.94859939   -1.36855325   -0.04844838    0.00440024   -0.02230123   -0.00642035
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C   -0.86267795   -0.76114724    0.01064790   -0.02592123    0.00764544    0.01346406
C    0.31970966    1.54800649   -0.06786989   -0.03408703    0.01519760    0.00451918
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C    1.72141604    1.23810794   -0.06850481    0.01668208   -0.03757498   -0.00318890
C    1.65589571   -1.19968083    0.00767625   -0.03037687   -0.03130029   -0.00497710
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   15
   -420.53003052
H   -2.70162820    0.57168495    0.11093534   -0.02171774    0.00030448    0.00251730
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O   -1.95854914   -1.37357455   -0.03958726   -0.00216241   -0.02830076   -0.00684484
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C   -0.87222124   -0.75288373    0.01732706   -0.02961234    0.01989348    0.01581134
C    0.32301176    1.54307715   -0.07055196   -0.03080948    0.00481645    0.00288157
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H    2.30764258   -2.03031456   -0.06949118   -0.01728333    0.02275523   -0.00208637
C    2.35722255    0.05208462    0.04772799   -0.00029616    0.00485373    0.00057349
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   15
   -420.53238341
H   -2.67160041    0.56849529    0.05855775   -0.00844955    0.00826794    0.00051471
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C   -0.87998504   -0.74581963    0.02305328   -0.03101569    0.03140880    0.01749719
C    0.32813138    1.53789830   -0.07340322   -0.01870094   -0.01368514    0.00029519
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C    1.72375238    1.25368142   -0.05043741    0.01495240   -0.02048845   -0.00355071
C    1.67476390   -1.19804581   -0.01060480   -0.01678152   -0.00735823   -0.00572976
H    0.04239188    2.58376679   -0.00611057   -0.00283354   -0.00319738    0.00385815
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C    2.36042217    0.05151033    0.04652857    0.01055227   -0.00194374    0.00138669
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   15
   -420.53221346
H   -2.63551359    0.55941022    0.00575053    0.00517962    0.01496803   -0.00062846
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C   -0.88588157   -0.74064741    0.02772523   -0.03071058    0.04137950    0.01840895
C    0.33435960    1.53352227   -0.07627191   -0.00209660   -0.02772077   -0.00240927
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C    1.72352390    1.26362645   -0.04108823    0.01107286   -0.00918897   -0.00371136
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H    2.27918936    2.19228107   -0.01782882   -0.01114016    0.00162027   -0.00152324
H    2.34118120   -2.08715230   -0.07275449    0.00463086   -0.00980107   -0.00295483
C    2.36299076    0.05104844    0.04524482    0.01981832   -0.00778035    0.00229293
H    3.41382793    0.10031521    0.23354390   -0.01437414    0.00713357    0.00484284
   15
   -420.53070368
H   -2.60266379    0.54008471   -0.04656713    0.01103017    0.01294777   -0.00242812
O   -1.95926138    1.25015451    0.08713647    0.00426554   -0.03392922    0.00844292
O   -1.98682981   -1.38010617   -0.01114074   -0.01564644   -0.03918196   -0.00619032
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C   -0.88992560   -0.73796563    0.03128779   -0.02941713    0.04891749    0.01853766
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C    0.34493534   -1.51275475    0.02346720   -0.00263131    0.00344533    0.00511287
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   15
   -420.52995874
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O   -1.99505587   -1.37889247   -0.00107056   -0.01712099   -0.03970965   -0.00526110
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C   -0.89219324   -0.73822580    0.03373267   -0.02756185    0.05315228    0.01797048
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   15
   -420.52941875
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O   -2.00250967   -1.37588280    0.00923717   -0.01738294   -0.03869538   -0.00400732
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C   -0.89279691   -0.74168003    0.03509357   -0.02509850    0.05329317    0.01683570
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C    0.33782388   -1.50904713    0.01157544   -0.01551367    0.00652189    0.00575727
C    1.72040827    1.29474259   -0.01165116   -0.01020481    0.01119167   -0.00444129
C    1.72157621   -1.19728260   -0.04272825    0.02138753    0.02417166   -0.00917821
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   15
   -420.52743123
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O   -2.00917694   -1.37112322    0.01972615   -0.01706420   -0.03612610   -0.00258762
C   -0.77231963    0.67331445   -0.04854188   -0.02343650   -0.02530595   -0.01328624
C   -0.89188778   -0.74833417    0.03543836   -0.02161585    0.04882168    0.01528277
C    0.35214462    1.53196212   -0.08519334    0.03166753    0.00902384   -0.00727071
C    0.33548664   -1.50772719    0.00511599   -0.02138485    0.00908142    0.00574738
C    1.71997732    1.30416840   -0.00132695   -0.01628910    0.01505206   -0.00466147
C    1.73200911   -1.20084557   -0.04955661    0.03872118    0.00739199   -0.01044873
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H    2.35884842   -2.09443548   -0.05801103   -0.00160137   -0.00421220    0.00014553
C    2.36274061    0.05560366    0.03922082   -0.00416008   -0.01043712   -0.00286257
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   15
   -420.52437152
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O   -2.01506962   -1.36473012    0.03033271   -0.01681223   -0.03205336   -0.00121221
C   -0.77857005    0.66392033   -0.04462041   -0.03457116   -0.03322625   -0.01168884
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C    0.35223745    1.53279356   -0.08641772    0.02614216    0.02918248   -0.00777400
C    0.33444196   -1.50695871   -0.00168981   -0.02708491    0.01205452    0.00548963
C    1.72051549    1.31267853    0.00927706   -0.01916882    0.01994711   -0.00445089
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H   -0.01911386    2.51916393   -0.04523759    0.00036772   -0.02778383    0.00253684
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   15
   -420.52351200
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C   -0.78275151    0.65651675   -0.03999407   -0.04132607   -0.03736785   -0.00967472
C   -0.88646466   -0.76988794    0.03347142   -0.01049520    0.02689030    0.01132713
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C    0.33503206   -1.50692250   -0.00882646   -0.03212115    0.01567377    0.00500144
C    1.72219341    1.31997439    0.02014685   -0.01816080    0.02636558   -0.00357391
C    1.74489292   -1.20800046   -0.06127258    0.06373408   -0.02841571   -0.01168948
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H    2.35828543   -2.05836616   -0.04812933   -0.01878884    0.02239617    0.00136465
C    2.36153769    0.06186926    0.03675143   -0.00485543   -0.00202199   -0.00213099
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   15
   -420.52652031
H   -2.52094036    0.48534208   -0.21902125    0.01763984   -0.00832717   -0.01320364
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O   -2.02455265   -1.34783752    0.05165998   -0.01762967   -0.02046576    0.00091827
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C    0.34791268    1.52905004   -0.08737857    0.02076781    0.02145333   -0.01022397
C    0.33755578   -1.50783928   -0.01626449   -0.03537323    0.02030283    0.00429561
C    1.72495097    1.32567141    0.03122909   -0.01341771    0.03359041   -0.00197714
C    1.74590116   -1.20953504   -0.06608352    0.05822369   -0.02703966   -0.01195601
H    0.00180954    2.53451157   -0.08132891    0.00226414   -0.01935007    0.00169431
H    0.05760205   -2.55855186   -0.00802514   -0.00992400    0.00625427    0.00038464
H    2.41720565    2.15766630    0.18125809    0.00997152   -0.00392228    0.00468397
H    2.37533940   -2.05990667   -0.04449224   -0.01316390    0.01650390    0.00196597
C    2.36141760    0.06531873    0.03573200    0.00276421    0.00144064   -0.00044947
H    3.44745403    0.03614685    0.17947933    0.00442877   -0.00363019    0.00379238
   15
   -420.52981847
H   -2.53331605    0.51267759   -0.21038956    0.02297616    0.00352290   -0.00871339
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O   -2.02810710   -1.33785984    0.06228371   -0.01839275   -0.01400767    0.00177660
C   -0.78359687    0.64846257   -0.02914716   -0.03888098   -0.03491253   -0.00406671
C   -0.87854406   -0.79775377    0.02878453    0.00223838   -0.00430153    0.00635480
C    0.34382865    1.52491594   -0.08697403    0.01943010   -0.00147293   -0.01084675
C    0.34220340   -1.50999005   -0.02396131   -0.03554650    0.02610513    0.00338590
C    1.72850578    1.32934189    0.04242810   -0.00584838    0.03980110    0.00015733
C    1.74344163   -1.20948767   -0.07017106    0.04225783   -0.01527497   -0.01225603
H    0.00940283    2.56688807   -0.10128667   -0.00189392    0.00262667    0.00078275
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H    2.40140355   -2.07273394   -0.04228940    0.00011453    0.00083914    0.00284771
C    2.36112061    0.06868685    0.03473962    0.01219281    0.00380624    0.00126974
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   15
   -420.53110433
H   -2.56183721    0.53779258   -0.19535914    0.02161978    0.01022910   -0.00619896
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O   -2.03082765   -1.32724583    0.07282680   -0.01897003   -0.00777014    0.00264292
C   -0.78041079    0.64766819   -0.02326520   -0.02931232   -0.02926710   -0.00059031
C   -0.87459381   -0.81178183    0.02578730    0.00606950   -0.01891243    0.00348710
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C    0.34898079   -1.51372286   -0.03186200   -0.03170081    0.03254700    0.00229433
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C    1.73843665   -1.20851090   -0.07351874    0.02400446   -0.00425216   -0.01228568
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H    0.09785603   -2.57170830   -0.01543660   -0.00779798    0.00601457    0.00119318
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H    2.42743603   -2.08626714   -0.04213378    0.01276455   -0.01348701    0.00367222
C    2.36010353    0.07182831    0.03367382    0.01818171    0.00545152    0.00233755
H    3.42537899    0.02054726    0.12810543   -0.01282905   -0.00492191   -0.00057366
   15
   -420.53231620
H   -2.60528038    0.55612934   -0.17568334    0.00992302    0.00747875   -0.00652613
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O   -2.03268876   -1.31627750    0.08324988   -0.01921560   -0.00198207    0.00353321
C   -0.77547051    0.64863397   -0.01734786   -0.01602855   -0.02167459    0.00295206
C   -0.87099677   -0.82467983    0.02258005    0.00714407   -0.03081767    0.00044751
C    0.33251440    1.51799901   -0.08421061    0.00489327   -0.03109292   -0.01041801
C    0.35765407   -1.51942175   -0.03990089   -0.02362566    0.03840669    0.00108595
C    1.73615252    1.32935381    0.06466057    0.01037962    0.04008329    0.00438220
C    1.73196594   -1.20724408   -0.07612629    0.00837026    0.00038537   -0.01175688
H    0.02999172    2.61436979   -0.14173699   -0.00381792    0.02840217   -0.00227056
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H    2.44461002   -2.09052567   -0.04460046    0.01994254   -0.02070636    0.00411863
C    2.35802795    0.07464057    0.03247142    0.01620637    0.00690757    0.00250373
H    3.42505520    0.01789612    0.10229121   -0.01269130   -0.00494458   -0.00160986
   15
   -420.53426826
H   -2.65550668    0.56938642   -0.15127375   -0.00767225   -0.00031654   -0.00741656
O   -1.96184053    1.26645471   -0.00455970    0.00724661    0.00289863    0.00706064
O   -2.03367914   -1.30521719    0.09351272   -0.01918872    0.00326626    0.00440030
C   -0.76956609    0.65090624   -0.01160743   -0.00166096   -0.01322309    0.00617466
C   -0.86781941   -0.83573156    0.01934596    0.00574051   -0.03923728   -0.00264582
C    0.32615481    1.51697585   -0.08187298   -0.00679568   -0.03097084   -0.01028942
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C    1.73927745    1.32568859    0.07544156    0.01620951    0.03214160    0.00588281
C    1.72496735   -1.20596463   -0.07802593   -0.00289107   -0.00216167   -0.01060586
H    0.04434791    2.61126144   -0.16009383   -0.00100068    0.02587761   -0.00335604
H    0.16023161   -2.60095456   -0.02630594   -0.00422460    0.00102900    0.00207214
H    2.39364096    2.17572157    0.23895487    0.00467220   -0.00516028    0.00481278
H    2.44782837   -2.08035925   -0.05000708    0.02029417   -0.01977189    0.00411091
C    2.35501155    0.07703496    0.03112016    0.00663259    0.00833620    0.00216865
H    3.43342641    0.01879606    0.07761026   -0.00534384   -0.00479034   -0.00222132
   15
   -420.53561479
H   -2.70038127    0.58272226   -0.12162262   -0.02258953   -0.00595176   -0.00673360
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O   -2.03379924   -1.29430251    0.10357617   -0.01905329    0.00786633    0.00520285
C   -0.76355418    0.65397990   -0.00623758    0.01132957   -0.00509879    0.00883262
C   -0.86498097   -0.84442873    0.01627152    0.00268766   -0.04396071   -0.00567066
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C    0.37854113   -1.53797431   -0.05609947    0.00159395    0.04240743   -0.00138134
C    1.74142853    1.32009733    0.08586798    0.02072950    0.02067962    0.00715268
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H    0.19666811   -2.61767440   -0.03382265   -0.00158997   -0.00065318    0.00242774
H    2.37890762    2.19417187    0.24518159    0.00568227    0.00130431    0.00531278
H    2.43685567   -2.05643210   -0.05835203    0.01346600   -0.01088953    0.00373603
C    2.35160698    0.07892692    0.02963776   -0.00548770    0.00942501    0.00180826
H    3.44550223    0.02313390    0.05452929    0.00444334   -0.00431694   -0.00287657
   15
   -420.53476981
H   -2.72950063    0.59999718   -0.08722023   -0.02908582   -0.00596140   -0.00446988
O   -1.96940971    1.26798291   -0.02976716    0.01188692    0.00718677    0.00272888
O   -2.03305486   -1.28374179    0.11340387   -0.01889556    0.01167838    0.00590379
C   -0.75821209    0.65736891   -0.00139881    0.02130232    0.00164818    0.01087394
C   -0.86230177   -0.85048488    0.01353912   -0.00103253   -0.04514995   -0.00850959
C    0.31540672    1.51972770   -0.07528228   -0.02981337   -0.00007627   -0.01248115
C    0.38924640   -1.55106038   -0.06411074    0.01540894    0.03868982   -0.00250379
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C    1.71174718   -1.20236185   -0.08000851   -0.00800590   -0.02554279   -0.00699120
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   15
   -420.53218087
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   15
   -420.53089107
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   15
   -420.53150494
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O   -2.02573851   -1.25570771    0.14118229   -0.01716277    0.01781266    0.00715966
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   15
   -420.53141430
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C   -0.75223590    0.66794573    0.01058256    0.02504861    0.00607267    0.01553434
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C    1.72862654    1.28565337    0.12950388    0.03468913   -0.01175449    0.01639916
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   15
   -420.52969054
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   15
   -420.52769753
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O   -2.01160439   -1.23476030    0.16611767   -0.01033284    0.01829249    0.00616186
C   -0.75860319    0.67095773    0.01117702    0.00966531   -0.00288141    0.01786162
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   15
   -420.52685369
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O   -2.00579284   -1.22944509    0.17383899   -0.00736244    0.01758083    0.00531252
C   -0.76291358    0.67257828    0.00989033   -0.00001008   -0.00760911    0.01893432
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   15
   -420.52673432
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O   -1.99964554   -1.22492641    0.18131968   -0.00483428    0.01655740    0.00436751
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   15
   -420.52534182
H   -2.58159986    0.53649652    0.21590903   -0.00116118   -0.01102785    0.01644125
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O   -1.99327553   -1.22115871    0.18860225   -0.00317174    0.01544824    0.00344878
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C   -0.82126177   -0.82039573    0.02345278   -0.00417904    0.01356622   -0.01109145
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C    1.67486643    1.26791993    0.14992819   -0.02465982   -0.02359448    0.01668080
C    1.69891524   -1.15658454   -0.08484765    0.00930801    0.04677900    0.01204137
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   15
   -420.52291841
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C    0.32164686    1.53437090   -0.00763018    0.03139612    0.02899486   -0.00494211
C    0.39611137   -1.70520880   -0.12640899   -0.00072715   -0.06506133   -0.01027628
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C    1.70248671   -1.16208166   -0.08792110    0.02517882    0.03274854    0.01034398
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C    2.33929118    0.08192416    0.01745797    0.00204601   -0.00239636   -0.00952062
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   15
   -420.52299588
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O   -1.98012868   -1.21568378    0.20273266   -0.00223419    0.01374733    0.00197758
C   -0.77430680    0.68526657   -0.00696079   -0.03101141   -0.01057034    0.01797517
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C    0.31671363    1.53547016    0.00056548    0.02970274    0.02117615   -0.00367303
C    0.39008474   -1.70836290   -0.12977233   -0.00698656   -0.06750909   -0.01001393
C    1.65717190    1.26943768    0.15084179   -0.04382472   -0.01287300    0.01502382
C    1.70459634   -1.16959793   -0.09162570    0.02924420    0.02600755    0.00971685
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C    2.33805002    0.08312545    0.01857027    0.01265618    0.00186504   -0.00970173
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   15
   -420.52631000
H   -2.49683499    0.52224768    0.19033619    0.03089112    0.01165584    0.00475256
O   -1.98092970    1.26786074   -0.16392576   -0.01801019    0.00921455   -0.01280221
O   -1.97339765   -1.21389971    0.20964739   -0.00212390    0.01322634    0.00139186
C   -0.77333602    0.69021581   -0.01402840   -0.02876481   -0.00542403    0.01553257
C   -0.80093680   -0.80864595    0.04064591    0.00441042    0.01415267   -0.00429617
C    0.30999120    1.53538062    0.00897961    0.02641606   -0.00431527   -0.00169488
C    0.38447218   -1.70745581   -0.13253239   -0.01155260   -0.06564802   -0.00929556
C    1.65204537    1.27156348    0.14990995   -0.04416721   -0.00365927    0.01410488
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   15
   -420.52948696
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O   -1.97793608    1.26347399   -0.17074743   -0.00933690    0.01351031   -0.01447989
O   -1.96657115   -1.21271656    0.21649869   -0.00178579    0.01292179    0.00089540
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C   -0.79446764   -0.80656286    0.04708711    0.00646755    0.00912337   -0.00186186
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C    1.70429510   -1.18965983   -0.10090278    0.00326514    0.03433668    0.01289257
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   15
   -420.53117257
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O   -1.95966457   -1.21212087    0.22330885   -0.00120911    0.01292748    0.00053672
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C   -0.78838768   -0.80502151    0.05364112    0.00812734    0.00210249    0.00053244
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C    1.64938008    1.27599123    0.14555185   -0.02911665    0.00968380    0.01173406
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   15
   -420.53299410
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O   -1.97130159    1.25249396   -0.18230725    0.01601009    0.02578681   -0.01717555
O   -1.95270321   -1.21211324    0.23009410   -0.00061216    0.01333966    0.00032760
C   -0.76231802    0.70509419   -0.04000288    0.00327189    0.01952343    0.00421213
C   -0.78279933   -0.80360147    0.06016338    0.00978612   -0.00609024    0.00283270
C    0.28291974    1.54274604    0.03479652   -0.01481655   -0.05787231   -0.00314721
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C    1.65095969    1.27751020    0.14227154   -0.01926664    0.00914237    0.00979579
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   15
   -420.53603240
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C   -0.75806742    0.70840232   -0.04949379    0.01189667    0.02590514    0.00018404
C   -0.77780372   -0.80181220    0.06651488    0.01159363   -0.01446143    0.00501657
C    0.27434539    1.55128461    0.04368600   -0.03100820   -0.05046962   -0.00405614
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C    1.65371092    1.27850035    0.13840271   -0.01059013    0.00389851    0.00709104
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C    2.30940268    0.08057032    0.03187888    0.01553306    0.02883912   -0.00341849
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   15
   -420.53877731
H   -2.61260654    0.47188814    0.02301433   -0.01654859   -0.01347027    0.00820471
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C   -0.75451028    0.71016411   -0.05899612    0.01541250    0.02826638   -0.00378445
C   -0.77350898   -0.79915298    0.07256366    0.01332366   -0.02191221    0.00706168
C    0.26762624    1.56280148    0.05281291   -0.04320172   -0.02857703   -0.00342652
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C    1.65710786    1.27926390    0.13410841   -0.00293591   -0.00316437    0.00371425
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C    2.29887285    0.07602808    0.03554238    0.00172404    0.03106554   -0.00185422
H    3.39991925    0.08795704    0.08693161    0.00986292    0.00085733    0.00148557
   15
   -420.53862891
H   -2.62063593    0.48715944   -0.03341114   -0.01067581   -0.00310553    0.00279974
O   -1.96704908    1.22834400   -0.19453436    0.02095889    0.00052497   -0.00242981
O   -1.93171105   -1.21586576    0.25038348    0.00015881    0.01553111   -0.00015996
C   -0.75186091    0.71024051   -0.06826976    0.01419695    0.02584007   -0.00769256
C   -0.77001754   -0.79517764    0.07818619    0.01452905   -0.02750328    0.00894138
C    0.26349109    1.57600100    0.06213678   -0.04965539    0.00182195   -0.00077391
C    0.36825272   -1.63771859   -0.14064700   -0.01298415   -0.00296633    0.00111573
C    1.66068344    1.28021089    0.12959081    0.00445388   -0.00869597    0.00003535
C    1.70668874   -1.26781447   -0.13630396    0.00922732   -0.03432465   -0.00226774
H    0.04313237    2.60643030    0.14000230    0.01084643   -0.02140797    0.00192731
H    0.03779490   -2.65426627   -0.36112517   -0.00929882    0.00184715   -0.00464309
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H    2.46404007   -2.00802000   -0.29985462   -0.00298266    0.01354978    0.00168307
C    2.28821779    0.06961864    0.03931743   -0.00801468    0.03097844   -0.00018333
H    3.39501796    0.08770680    0.09952091    0.01298666    0.00169982    0.00204071
   15
   -420.53630281
H   -2.62135460    0.50436239   -0.09188691    0.00118041    0.01193096   -0.00196579
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O   -1.92471770   -1.21848376    0.25714924    0.00067312    0.01568768   -0.00044402
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C   -0.76740009   -0.78955235    0.08326911    0.01475240   -0.03039155    0.01059408
C    0.26232075    1.58912938    0.07150262   -0.04853953    0.02447754    0.00279009
C    0.36852545   -1.62146755   -0.14159852   -0.01116843    0.00598868    0.00240592
C    1.66398959    1.28166363    0.12507056    0.01182351   -0.01028090   -0.00355376
C    1.70786742   -1.28230411   -0.14419845    0.02101866   -0.05444462   -0.00749550
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H    2.31172617    2.16820266    0.24632198    0.00428120    0.00991316    0.00071488
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C    2.27801832    0.06134860    0.04310264   -0.01201808    0.02831465    0.00167197
H    3.38110755    0.08623839    0.11066426    0.01044019    0.00245829    0.00221738
   15
   -420.53537318
H   -2.62276125    0.51320232   -0.14910512    0.01015868    0.02295916   -0.00422091
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O   -1.91775690   -1.22181155    0.26393484    0.00170158    0.01529699   -0.00066372
C   -0.74887609    0.70616984   -0.08520069    0.00605280    0.00941134   -0.01471725
C   -0.76566814   -0.78210572    0.08771283    0.01362766   -0.02994998    0.01194620
C    0.26404275    1.60088772    0.08070715   -0.03897086    0.02634505    0.00498828
C    0.36946445   -1.60557247   -0.14269382   -0.00754867    0.01369875    0.00334827
C    1.66658246    1.28371358    0.12076284    0.01880871   -0.00703011   -0.00667889
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H    0.02317811    2.61838329    0.20349374    0.01001011   -0.02427357    0.00220129
H    0.01270058   -2.60751976   -0.36290039   -0.00886388    0.00723879   -0.00376723
H    2.29827744    2.17401724    0.26053372   -0.00008455    0.00995970    0.00130975
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C    2.26851837    0.05137919    0.04678579   -0.01065800    0.02307972    0.00369875
H    3.35997568    0.08301241    0.12023650    0.00296419    0.00300396    0.00196042
   15
   -420.53535519
H   -2.63068226    0.50635471   -0.20338314    0.00648028    0.02054084   -0.00486236
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O   -1.91087484   -1.22583133    0.27074993    0.00313666    0.01433709   -0.00070682
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C   -0.76475331   -0.77286581    0.09143625    0.01110579   -0.02588704    0.01291014
C    0.26809311    1.61112263    0.08961902   -0.02379594    0.01458582    0.00548917
C    0.37085024   -1.59050142   -0.14399012   -0.00199297    0.02048114    0.00397479
C    1.66804348    1.28616789    0.11685576    0.02459346    0.00028838   -0.00917608
C    1.70671425   -1.30132726   -0.15855182    0.00535551   -0.04938315   -0.00853136
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C    2.25964845    0.04002531    0.05024510   -0.00650404    0.01563153    0.00572632
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   15
   -420.53254142
H   -2.64266248    0.48537055   -0.25408789   -0.00693785    0.00753607   -0.00651586
O   -1.97113956    1.19960053   -0.20964389    0.01342772   -0.02115671    0.00783140
O   -1.90413541   -1.23049899    0.27759601    0.00465098    0.01269211   -0.00047207
C   -0.74741696    0.69996015   -0.09861771    0.00023798   -0.01406425   -0.01951870
C   -0.76450502   -0.76207747    0.09438119    0.00756817   -0.01838535    0.01342660
C    0.27357879    1.62046566    0.09819903   -0.00774816    0.00419934    0.00591774
C    0.37235126   -1.57666440   -0.14552541    0.00459454    0.02633366    0.00431667
C    1.66802960    1.28859613    0.11350119    0.02783808    0.00928415   -0.01120084
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H    2.27591178    2.16674461    0.28623001   -0.01140571    0.00280123    0.00092696
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C    2.25118082    0.02773393    0.05335966   -0.00414463    0.00660132    0.00741986
H    3.31837168    0.06999129    0.13559364   -0.01383160    0.00313901    0.00085947
   15
   -420.52758090
H   -2.64975880    0.45893483   -0.30001708   -0.01882349   -0.00539497   -0.00947066
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O   -1.89760567   -1.23573955    0.28446246    0.00580885    0.01024884    0.00004090
C   -0.74678736    0.69776604   -0.10362308   -0.00115745   -0.02576403   -0.02094844
C   -0.76471290   -0.75019128    0.09651640    0.00371438   -0.00808391    0.01347866
C    0.27954475    1.62951255    0.10641558    0.00603850    0.00194729    0.00741685
C    0.37357690   -1.56441322   -0.14732025    0.01067026    0.03084452    0.00436925
C    1.66635339    1.29047094    0.11082406    0.02686113    0.01671858   -0.01322830
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H    2.27490990    2.15852489    0.29794190   -0.01442692    0.00028630    0.00073884
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C    2.24299465    0.01504832    0.05602916   -0.00773391   -0.00343201    0.00839336
H    3.30945077    0.06008591    0.14212585   -0.01430834    0.00287506    0.00074583
   15
   -420.52433336
H   -2.64379932    0.43599288   -0.33914609   -0.02260611   -0.01199963   -0.01212089
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O   -1.89133678   -1.24144191    0.29132625    0.00625511    0.00695788    0.00076334
C   -0.74609065    0.69712254   -0.10736431   -0.00197731   -0.03594046   -0.02182727
C   -0.76514736   -0.73782490    0.09783867    0.00024138    0.00395291    0.01308935
C    0.28516415    1.63839848    0.11417712    0.01607257    0.00833608    0.01020874
C    0.37416749   -1.55401775   -0.14937752    0.01473662    0.03343095    0.00407376
C    1.66307911    1.29135408    0.10894934    0.02067574    0.02040302   -0.01571667
C    1.70462742   -1.31024072   -0.17658083   -0.01894927   -0.01475133   -0.00496519
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   15
   -420.52397385
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O   -1.88534846   -1.24745715    0.29815494    0.00584752    0.00292529    0.00160793
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C   -0.76560078   -0.72569971    0.09837119   -0.00235826    0.01638374    0.01232132
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C    2.22867296   -0.00906927    0.05984631   -0.02855692   -0.02382196    0.00820320
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   15
   -420.52354408
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O   -1.87962289   -1.25360321    0.30491047    0.00475939   -0.00160907    0.00250979
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C   -0.76591671   -0.71455961    0.09816001   -0.00393068    0.02766502    0.01126446
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C    0.37264345   -1.53927599   -0.15418834    0.01438904    0.03191144    0.00255865
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C    1.70787709   -1.31024583   -0.18693372    0.00595085   -0.02276876   -0.00781838
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H    2.33855825   -2.19182644   -0.33871416   -0.00444084   -0.01061228   -0.00137447
C    2.22374992   -0.01927619    0.06100169   -0.03680587   -0.03256034    0.00775763
H    3.32313648    0.01951761    0.15707088    0.00770882    0.00057192    0.00224276
   15
   -420.52044087
H   -2.55148428    0.40747078   -0.40399436    0.01035968    0.01071605   -0.00849286
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O   -1.87411226   -1.25967591    0.31155176    0.00342140   -0.00627815    0.00349611
C   -0.74321519    0.70972151   -0.11060216   -0.00121413   -0.04641562   -0.02183043
C   -0.76599922   -0.70507963    0.09726848   -0.00467305    0.03636023    0.01002645
C    0.29542586    1.65789948    0.13270462    0.01706174    0.06420463    0.02339667
C    0.37054510   -1.53484258   -0.15685132    0.01086212    0.02874459    0.00154751
C    1.64850705    1.28662809    0.10971260   -0.01401718    0.02082044   -0.02295696
C    1.70941522   -1.30837399   -0.19145524    0.02510467   -0.03477828   -0.01032166
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H    2.31056986   -2.17095894   -0.33739067   -0.01918416    0.00803058    0.00171372
C    2.22102367   -0.02752338    0.06168679   -0.03931788   -0.03938943    0.00751159
H    3.32398805    0.00422779    0.15933689    0.00979126   -0.00089754    0.00231282
   15
   -420.51808255
H   -2.52165906    0.39381263   -0.41087849    0.01921477    0.01755962   -0.00659692
O   -1.99474340    1.17986839   -0.24459810   -0.01548428   -0.03100713    0.00627579
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C   -0.74205195    0.71946020   -0.10901985    0.00205766   -0.04049344   -0.02073360
C   -0.76580106   -0.69778042    0.09577127   -0.00503410    0.04143013    0.00865465
C    0.29655725    1.65834785    0.13642402    0.01494449    0.06698642    0.02435124
C    0.36779289   -1.53214626   -0.15960788    0.00668955    0.02531333    0.00052404
C    1.64437464    1.28254872    0.11257704   -0.02272529    0.02375981   -0.02320456
C    1.70946646   -1.30443190   -0.19535909    0.03797580   -0.04012893   -0.01149042
H   -0.04773947    2.63047708    0.28726075    0.00325349   -0.03560976   -0.00055742
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H    2.29604663   -2.15550034   -0.33722996   -0.02805510    0.02032898    0.00365302
C    2.22064322   -0.03339974    0.06191618   -0.03551325   -0.04394100    0.00755138
H    3.31811682   -0.01040719    0.15996656    0.00645563   -0.00249051    0.00192357
   15
   -420.52037371
H   -2.50497855    0.36837284   -0.41281272    0.01705304    0.01073062   -0.00784577
O   -1.99894686    1.17945938   -0.25196451   -0.01350341   -0.02414207    0.00666864
O   -1.86351429   -1.27076818    0.32430536    0.00202411   -0.01470892    0.00593879
C   -0.74102674    0.73162237   -0.10618789    0.00799973   -0.02952215   -0.01879108
C   -0.76529834   -0.69296658    0.09375103   -0.00537157    0.04247324    0.00718090
C    0.29676351    1.65487190    0.13869232    0.01659125    0.04562460    0.02118119
C    0.36463370   -1.53098468   -0.16239655    0.00295133    0.02262220   -0.00042784
C    1.64159505    1.27702332    0.11683725   -0.02713892    0.02845658   -0.02195041
C    1.70729563   -1.29815167   -0.19858344    0.03656797   -0.02869473   -0.00973615
H   -0.04436841    2.64737031    0.28271743   -0.00137308   -0.02227980    0.00121045
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C    2.22238453   -0.03663105    0.06168780   -0.02663038   -0.04599034    0.00781303
H    3.30785554   -0.02325807    0.15923213   -0.00111171   -0.00392582    0.00119873
   15
   -420.52338950
H   -2.50019476    0.33572594   -0.40899947    0.00854333   -0.00459093   -0.01067481
O   -2.00255884    1.18011428   -0.25963769   -0.00592214   -0.00912979    0.00815852
O   -1.85836532   -1.27540682    0.33030700    0.00242165   -0.01802976    0.00733659
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C   -0.76447127   -0.69070252    0.09129703   -0.00557812    0.03975387    0.00560149
C    0.29597181    1.64869396    0.13968842    0.01720752    0.01282657    0.01621370
C    0.36129215   -1.53119764   -0.16516008   -0.00004204    0.02119572   -0.00125384
C    1.64043249    1.26977692    0.12241909   -0.02676350    0.03310967   -0.01953764
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H   -0.03987986    2.67971584    0.27724299   -0.00823137    0.00097543    0.00400809
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H    2.40881869    2.01443109    0.32898520    0.00661460   -0.00547505    0.00182873
H    2.32242694   -2.16232342   -0.34371120   -0.01009688   -0.00093908    0.00000694
C    2.22572729   -0.03709527    0.06098682   -0.01600885   -0.04514331    0.00809692
H    3.29845876   -0.03330347    0.15763775   -0.00966026   -0.00497328    0.00043438
   15
   -420.52345087
H   -2.50162432    0.30623905   -0.39757014    0.00082735   -0.01784954   -0.01239168
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O   -1.85332821   -1.27923047    0.33597637    0.00334931   -0.02054238    0.00857448
C   -0.74095204    0.76034712   -0.09729628    0.02510308    0.00256321   -0.01255335
C   -0.76330984   -0.69082766    0.08850484   -0.00517608    0.03403912    0.00390825
C    0.29416703    1.64171616    0.13970067    0.01252993   -0.01567983    0.01180427
C    0.35795087   -1.53269801   -0.16784871   -0.00258675    0.02085642   -0.00189267
C    1.64086969    1.26054225    0.12918024   -0.02269339    0.03492222   -0.01667187
C    1.69722247   -1.28186793   -0.20350234    0.00856963    0.01461410   -0.00290470
H   -0.02964268    2.71165813    0.26895188   -0.01243530    0.01972573    0.00575223
H    0.09575395   -2.58502211   -0.23102998    0.00671675    0.00014072    0.00260389
H    2.41660894    1.98436720    0.32342017    0.00348618   -0.01338924   -0.00026147
H    2.35117573   -2.17043839   -0.34793315    0.00447466   -0.01665027   -0.00249517
C    2.23005404   -0.03484651    0.05979748   -0.00850164   -0.04086457    0.00811646
H    3.29579135   -0.03980037    0.15570607   -0.01445898   -0.00548079    0.00007208
   15
   -420.52311699
H   -2.50389637    0.28916079   -0.37734768   -0.00279490   -0.02387409   -0.01196197
O   -2.00925832    1.18213962   -0.27608372    0.00412987    0.00881691    0.00651004
O   -1.84844372   -1.28212559    0.34125854    0.00448087   -0.02210976    0.00934570
C   -0.74291652    0.77498935   -0.09161039    0.03225070    0.01969342   -0.00893069
C   -0.76184103   -0.69300187    0.08547700   -0.00367984    0.02638538    0.00207776
C    0.29162938    1.63562918    0.13899209    0.00297084   -0.03288229    0.00876657
C    0.35476593   -1.53546218   -0.17042367   -0.00507525    0.02095927   -0.00231759
C    1.64267419    1.24922555    0.13695163   -0.01757197    0.03078311   -0.01417458
C    1.69093705   -1.27437545   -0.20559202   -0.00326804    0.02557731   -0.00134112
H   -0.01068173    2.73001103    0.25661086   -0.01284979    0.02826694    0.00596992
H    0.08776540   -2.58864894   -0.21879573    0.00521973   -0.00065269    0.00337572
H    2.42179707    1.96376216    0.31800529    0.00186111   -0.01827665   -0.00173459
H    2.37700482   -2.16705852   -0.35043894    0.01419454   -0.02431991   -0.00366520
C    2.23492883   -0.03014494    0.05811976   -0.00756403   -0.03288009    0.00766603
H    3.30310822   -0.04237902    0.15368046   -0.01232001   -0.00551406    0.00039228
   15
   -420.52551653
H   -2.50443135    0.28879172   -0.34862191   -0.00175420   -0.02188695   -0.00976215
O   -2.01279385    1.18271603   -0.28478202    0.00417692    0.00598123    0.00334413
O   -1.84376270   -1.28402143    0.34611905    0.00568228   -0.02261249    0.00950135
C   -0.74681129    0.78845159   -0.08538281    0.03540413    0.03463378   -0.00559833
C   -0.76015561   -0.69676731    0.08232429   -0.00103054    0.01780004    0.00011129
C    0.28892226    1.63146388    0.13774564   -0.00865448   -0.03666164    0.00725560
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C    1.64554786    1.23608672    0.14558447   -0.01360638    0.01884898   -0.01249509
C    1.68482326   -1.26837773   -0.20759207   -0.00991483    0.02614856   -0.00149083
H    0.01734155    2.72866822    0.24004539   -0.01006549    0.02570773    0.00491933
H    0.07604126   -2.59183681   -0.20898705    0.00326583   -0.00099393    0.00410638
H    2.42543706    1.95601267    0.31377691    0.00358034   -0.01815737   -0.00220541
H    2.39299990   -2.14671416   -0.35039313    0.01744481   -0.02282659   -0.00332630
C    2.24029054   -0.02347242    0.05598001   -0.01232978   -0.02140242    0.00690921
H    3.31895173   -0.04100724    0.15134051   -0.00455335   -0.00519643    0.00124058
   15
   -420.52945403
H   -2.50396202    0.30373732   -0.31291314    0.00356370   -0.01252564   -0.00686977
O   -2.01650748    1.18304898   -0.29363141    0.00120680   -0.00413077   -0.00002907
O   -1.83934023   -1.28489532    0.35055068    0.00708493   -0.02202091    0.00907516
C   -0.75282021    0.79983943   -0.07881332    0.03322730    0.04556618   -0.00290990
C   -0.75841166   -0.70160872    0.07916541    0.00234989    0.00909337   -0.00194590
C    0.28673465    1.62944257    0.13605303   -0.01953737   -0.02586626    0.00718752
C    0.34947777   -1.54476363   -0.17514430   -0.01032444    0.01927710   -0.00250236
C    1.64924975    1.22184301    0.15497615   -0.01059418    0.00002861   -0.01144191
C    1.67927901   -1.26391398   -0.20949419   -0.01050867    0.01724090   -0.00317827
H    0.05246785    2.70947891    0.21998720   -0.00484277    0.01198074    0.00300749
H    0.06196407   -2.59435170   -0.20212983    0.00125898   -0.00064503    0.00475414
H    2.42634031    1.96105942    0.31109381    0.00786240   -0.01344438   -0.00197436
H    2.39685535   -2.11044507   -0.34803493    0.01359410   -0.01268587   -0.00158938
C    2.24640556   -0.01551882    0.05342192   -0.01865008   -0.00729413    0.00624017
H    3.33801137   -0.03591429    0.14810264    0.00429214   -0.00454448    0.00217283
   15
   -420.53095939
H   -2.50620513    0.32743433   -0.27220992    0.01115634    0.00103420   -0.00475087
O   -2.02026893    1.18358484   -0.30248345   -0.00345367   -0.01805634   -0.00239531
O   -1.83524143   -1.28477355    0.35457223    0.00905511   -0.02044943    0.00824102
C   -0.76081239    0.80849671   -0.07206429    0.02587212    0.05150466   -0.00091574
C   -0.75680945   -0.70700257    0.07612423    0.00564119    0.00089503   -0.00400239
C    0.28571318    1.62892073    0.13392144   -0.02729847   -0.00253140    0.00797720
C    0.34768918   -1.55119469   -0.17727840   -0.01246152    0.01662062   -0.00236529
C    1.65358740    1.20761469    0.16506009   -0.00661581   -0.02216037   -0.01044155
C    1.67433840   -1.26045437   -0.21119834   -0.00491060    0.00084511   -0.00599254
H    0.09101602    2.68220397    0.19777248    0.00149812   -0.01045659    0.00091518
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H    2.39134574   -2.06547988   -0.34460698    0.00285101    0.00464561    0.00135118
C    2.25363606   -0.00712960    0.05048456   -0.02259784    0.00787288    0.00593611
H    3.35417049   -0.02756981    0.14331884    0.01002699   -0.00354543    0.00280612
   15
   -420.52894879
H   -2.51631877    0.35061994   -0.22801709    0.01598756    0.01063610   -0.00379018
O   -2.02388236    1.18492363   -0.31123206   -0.00571990   -0.02755612   -0.00351665
O   -1.83155689   -1.28372708    0.35822050    0.01191257   -0.01803229    0.00723021
C   -0.77035125    0.81406347   -0.06525777    0.01493621    0.05260477    0.00065006
C   -0.75554343   -0.71245595    0.07332459    0.00796532   -0.00622646   -0.00595266
C    0.28631546    1.62854469    0.13130911   -0.02956896    0.02180879    0.00846090
C    0.34664800   -1.55862509   -0.17926915   -0.01336169    0.01279095   -0.00224246
C    1.65831360    1.19472010    0.17577338   -0.00039701   -0.04306366   -0.00900268
C    1.66968227   -1.25703833   -0.21253950    0.00280578   -0.01669389   -0.00885582
H    0.12857024    2.66234795    0.17485044    0.00652379   -0.03059785   -0.00038316
H    0.03253933   -2.59879281   -0.19902948   -0.00261204    0.00157821    0.00558971
H    2.40837755    1.99498529    0.30977098    0.01345036   -0.00012033   -0.00170214
H    2.38396578   -2.02395758   -0.34217090   -0.01055075    0.02327711    0.00455578
C    2.26220944    0.00078938    0.04718654   -0.02188754    0.02184617    0.00596374
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   15
   -420.52781798
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C   -0.78078663    0.81646801   -0.05849034    0.00259622    0.04986558    0.00216373
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   15
   -420.52894859
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O   -1.82599053   -1.27932294    0.36458325    0.02003615   -0.01159321    0.00497496
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C   -0.75449059   -0.72192508    0.06890699    0.00854493   -0.01527593   -0.00914394
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   15
   -420.52823394
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C   -0.75474286   -0.72539654    0.06748156    0.00760290   -0.01660359   -0.01030736
C    0.29735328    1.61933710    0.12054612   -0.00528438    0.00006261    0.00707496
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C    1.65585635   -1.24034788   -0.21339106   -0.03127715    0.00372655   -0.00331798
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   15
   -420.52507409
H   -2.62603613    0.41000378   -0.04344657   -0.01428197   -0.01721585    0.01166338
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O   -1.82405110   -1.27282438    0.37004765    0.02750154   -0.00449992    0.00247562
C   -0.81019986    0.80710778   -0.03942505   -0.03002183    0.02812446    0.00843193
C   -0.75545490   -0.72787484    0.06667829    0.00665633   -0.01574262   -0.01122546
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C    1.67278681    1.17533402    0.22247169    0.02352176   -0.05128912    0.00433480
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   15
   -420.52302772
H   -2.64274090    0.44260744   -0.00952548   -0.01431528   -0.01529366    0.01388991
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O   -1.82487163   -1.26918786    0.37258240    0.02940569   -0.00125955    0.00135736
C   -0.81718735    0.79991589   -0.03390369   -0.03758955    0.01901188    0.01114414
C   -0.75657151   -0.72941105    0.06655277    0.00610385   -0.01289321   -0.01192561
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C    1.67347564    1.17915512    0.23409899    0.02045153   -0.03768561    0.00865620
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   15
   -420.52387766
H   -2.64955218    0.48582792    0.01463340   -0.00745733   -0.00673697    0.01210348
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O   -1.82702062   -1.26549236    0.37505453    0.02978825    0.00148982    0.00051999
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C   -0.75806007   -0.73017542    0.06714742    0.00609429   -0.00845935   -0.01242077
C    0.31112293    1.60806581    0.10581435    0.02463677   -0.00239593    0.00679930
C    0.35289489   -1.60844635   -0.18835155   -0.00282277   -0.02216609   -0.00198364
C    1.67295423    1.18526243    0.24520576    0.01214764   -0.02535265    0.01239900
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C    2.32339449    0.01191414    0.02128484    0.01414797    0.00216045   -0.00603990
H    3.40915189    0.04261475    0.06122683    0.00093826    0.00516498    0.00104496
   15
   -420.52536533
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O   -1.83051607   -1.26186204    0.37750181    0.02881116    0.00359005    0.00003290
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C    1.67171542    1.19291863    0.25556702    0.00044342   -0.01600875    0.01528819
C    1.66368715   -1.22480105   -0.21279741   -0.03167183    0.03370174    0.00619838
H    0.23461883    2.69840953    0.03229651    0.01116391    0.00798978   -0.00298180
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H    2.37989310   -2.05704839   -0.39130231    0.00867855   -0.00765482   -0.00104481
C    2.33139931    0.00972320    0.01707842    0.01174801   -0.01000430   -0.00966419
H    3.43057548    0.04307175    0.04517225    0.00967784    0.00508443    0.00051572
   15
   -420.52447638
H   -2.65652828    0.57652768    0.04186962    0.01598477    0.01879628   -0.00127909
O   -2.06272832    1.21551065   -0.36199254   -0.02981757   -0.01971476   -0.01291633
O   -1.83531481   -1.25839193    0.37994624    0.02676752    0.00499204   -0.00008285
C   -0.82365342    0.77345830   -0.02208102   -0.04051421   -0.00325463    0.01954712
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C    0.35714380   -1.61849058   -0.19034789   -0.00691534   -0.03433667   -0.00176545
C    1.67045154    1.20155277    0.26500757   -0.01162748   -0.00858566    0.01741516
C    1.67177928   -1.22587231   -0.21342558   -0.01160371    0.02174374    0.00438429
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H    2.34516231   -2.05115119   -0.39726086   -0.00681644    0.00514315    0.00190564
C    2.33867709    0.00812270    0.01345228    0.01254700   -0.01929806   -0.01246746
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   15
   -420.52268697
H   -2.67255635    0.60660131    0.05395161    0.01619437    0.02010522   -0.00272522
O   -2.06729546    1.22061256   -0.36463878   -0.03799532   -0.01869687   -0.01245383
O   -1.84132507   -1.25514619    0.38239331    0.02391839    0.00582903    0.00010872
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C   -0.76485864   -0.73076109    0.07348252    0.00770365    0.00842198   -0.01249450
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C    1.66987849    1.21070627    0.27339716   -0.02126833   -0.00121791    0.01908649
C    1.68057619   -1.22824347   -0.21431480    0.00765365    0.00713360    0.00186605
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H    2.31529419   -2.04899110   -0.40461481   -0.02137788    0.01812930    0.00513945
C    2.34517461    0.00767000    0.01057522    0.01756768   -0.02478825   -0.01429572
H    3.45013047    0.03364383    0.01265215    0.01304591    0.00299508   -0.00149195
   15
   -420.52357698
H   -2.69946161    0.62286782    0.06752049    0.00390199    0.01067671    0.00337916
O   -2.07018707    1.22652150   -0.36669152   -0.03390889   -0.00724846   -0.01908803
O   -1.84841809   -1.25216365    0.38483465    0.02041625    0.00630984    0.00051591
C   -0.81594387    0.75595020   -0.01979281   -0.02176996   -0.00805200    0.02309683
C   -0.76800909   -0.73151522    0.07711602    0.00818783    0.01306331   -0.01198990
C    0.30973009    1.58575344    0.08147393    0.02425579    0.03949759   -0.00139238
C    0.36304472   -1.62039139   -0.19191324   -0.01016525   -0.03858907   -0.00165161
C    1.67057010    1.21992765    0.28063298   -0.02663574    0.00725918    0.02063989
C    1.68896103   -1.23108831   -0.21532666    0.01704047    0.00063988    0.00124948
H    0.17157085    2.62358698   -0.00510796    0.01065689   -0.02747281   -0.00160252
H    0.10400641   -2.66330251   -0.37711172    0.00088758   -0.00427933   -0.00203560
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C    2.35059188    0.00869794    0.00855823    0.02607097   -0.02659085   -0.01522179
H    3.44588666    0.02525076   -0.00238943    0.00681019    0.00120478   -0.00261117
   15
   -420.52558799
H   -2.72900929    0.63152658    0.07856305   -0.01135770   -0.00035033    0.01115198
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O   -1.85643538   -1.24946690    0.38725220    0.01636233    0.00664705    0.00104125
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C   -0.77165416   -0.73305184    0.08147299    0.00855415    0.01620252   -0.01115457
C    0.30524940    1.57437324    0.07528801    0.01909760    0.01156248   -0.00205755
C    0.36687314   -1.61788561   -0.19254422   -0.01055800   -0.03645900   -0.00142544
C    1.67284633    1.22870359    0.28661986   -0.02678545    0.01696654    0.02232448
C    1.69637959   -1.23403723   -0.21643117    0.01409747    0.00644656    0.00385219
H    0.13403664    2.63558561   -0.01529869    0.00534076   -0.00655344   -0.00337750
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H    2.30569462    2.11179608    0.47873498    0.00277128    0.00933381    0.00160564
H    2.30344916   -2.08335174   -0.43055672   -0.01967373    0.00849407    0.00329929
C    2.35442753    0.01131906    0.00745812    0.03545270   -0.02536898   -0.01539808
H    3.43689538    0.01599889   -0.01555969   -0.00195635   -0.00071538   -0.00358539
   15
   -420.52540558
H   -2.75073812    0.64011467    0.08180855   -0.02084526   -0.00625486    0.01520183
O   -2.07172886    1.23875980   -0.36785172   -0.02191002    0.01296199   -0.03064555
O   -1.86519363   -1.24707182    0.38962232    0.01192082    0.00701085    0.00160475
C   -0.80313051    0.74021634   -0.02303041    0.00491268   -0.00446580    0.02361909
C   -0.77581547   -0.73555893    0.08650260    0.00869628    0.01746522   -0.00992056
C    0.29962323    1.56229484    0.06922838    0.01212860   -0.01714823   -0.00303592
C    0.37133555   -1.61318727   -0.19308987   -0.01007599   -0.03187051   -0.00104685
C    1.67671646    1.23645182    0.29125549   -0.02178406    0.02692689    0.02420655
C    1.70297346   -1.23739557   -0.21777561    0.00549632    0.01618141    0.00782236
H    0.09272216    2.65232236   -0.02306603   -0.00107774    0.01456912   -0.00502638
H    0.14796306   -2.65693526   -0.41964766    0.00524842   -0.00474268   -0.00408909
H    2.32112923    2.09466837    0.50365318    0.00265065    0.00267067    0.00179363
H    2.32053629   -2.11325592   -0.44785542   -0.00781922   -0.00910840   -0.00122582
C    2.35613689    0.01546232    0.00728568    0.04127302   -0.02170930   -0.01485137
H    3.42919983    0.00725169   -0.02615694   -0.00880903   -0.00248195   -0.00442003
   15
   -420.52398231
H   -2.75801218    0.65279022    0.07443508   -0.02109726   -0.00522240    0.01380078
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O   -1.87449241   -1.24499545    0.39191986    0.00739415    0.00754722    0.00210579
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   15
   -420.52389754
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O   -1.88412799   -1.24326245    0.39412250    0.00320030    0.00835434    0.00244770
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C   -0.78569198   -0.74366727    0.09825124    0.00748770    0.01406300   -0.00601350
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   15
   -420.52514929
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O   -2.06526153    1.25364182   -0.36015801   -0.04980319   -0.00406182   -0.01137640
O   -1.89391147   -1.24190987    0.39621488   -0.00027959    0.00951559    0.00257921
C   -0.78765283    0.71801184   -0.03833711    0.03269374    0.00519135    0.01917507
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   15
   -420.52611934
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O   -1.90368586   -1.24099043    0.39819113   -0.00281729    0.01102955    0.00248089
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C   -0.79731330   -0.75504953    0.11141744    0.00303067    0.00441009   -0.00031305
C    0.27580534    1.53179835    0.04818548   -0.02921063   -0.02038221   -0.01309226
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   15
   -420.52585753
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O   -2.05097975    1.26357753   -0.35157965   -0.05000329   -0.00533481   -0.00683032
O   -1.91333587   -1.24057222    0.40005545   -0.00443609    0.01274787    0.00221165
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C   -0.80347423   -0.76129855    0.11811851   -0.00042116   -0.00149946    0.00295344
C    0.27264987    1.52889395    0.04448635   -0.03808846    0.00379052   -0.01498385
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C    1.70498680    1.24626697    0.29167771    0.01895810    0.01145523    0.01798117
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C    2.33550760    0.04714880    0.01760847   -0.00635747    0.02102925   -0.00360279
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   15
   -420.52500173
H   -2.72158587    0.64767496   -0.01416844   -0.00388843    0.00491497    0.00301324
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C   -0.78828640    0.69366712   -0.06388502    0.02565743    0.00100113    0.01039240
C   -0.80960822   -0.76745753    0.12464090   -0.00416814   -0.00728596    0.00622754
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C    0.40578290   -1.55922991   -0.19552657    0.01232378    0.01279703   -0.00126855
C    1.70895640    1.24377770    0.28773292    0.02649538   -0.00156360    0.01375326
C    1.74166573   -1.26856999   -0.23667165    0.02196911   -0.06111097   -0.00655812
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C    2.32981008    0.05202500    0.02093615   -0.01100949    0.02921898   -0.00183191
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   15
   -420.52566015
H   -2.72206951    0.61854192   -0.02910503   -0.01587127   -0.00801993    0.00861494
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O   -1.93199288   -1.24154196    0.40349821   -0.00625726    0.01554275    0.00165236
C   -0.79199146    0.68519959   -0.07391293    0.01649931   -0.00461454    0.00682478
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C    0.27333324    1.52168400    0.03979930   -0.03522444    0.01398891   -0.01402284
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C    2.32475629    0.05514932    0.02437854   -0.01132129    0.03437213   -0.00083517
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   15
   -420.52726639
H   -2.71164776    0.59478117   -0.04997636   -0.01926824   -0.01445450    0.00993919
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O   -1.94091338   -1.24305406    0.40510099   -0.00748119    0.01593120    0.00164116
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C   -0.82092500   -0.77816384    0.13637466   -0.00992820   -0.01603409    0.01195637
C    0.27699618    1.51677634    0.03875849   -0.02312072   -0.00281717   -0.01213895
C    0.41446594   -1.54229599   -0.19589816    0.02429066    0.02502437   -0.00257368
C    1.71157308    1.23959475    0.27751991    0.04311992   -0.01524878    0.00902498
C    1.74971146   -1.26335293   -0.24326152    0.00903577   -0.05460733   -0.00443074
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C    2.32037681    0.05621529    0.02787549   -0.00966655    0.03544669   -0.00065660
H    3.39983462    0.05897069    0.04421307   -0.00757773   -0.00059779   -0.00456684
   15
   -420.52762955
H   -2.68791105    0.58097201   -0.07778976   -0.01329692   -0.01320575    0.00768278
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O   -1.94949139   -1.24528561    0.40662833   -0.00949083    0.01539031    0.00191228
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C    0.28205558    1.51202528    0.03845102   -0.01047477   -0.01741842   -0.01006206
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C    1.70922816    1.23871899    0.27153593    0.04954982   -0.01399023    0.00886526
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H    2.50585293   -2.01160058   -0.52621461    0.01397077   -0.00179058   -0.00247031
C    2.31659198    0.05516086    0.03141662   -0.00997196    0.03185915   -0.00138676
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   15
   -420.52710810
H   -2.65506210    0.57624712   -0.11101105    0.00030938   -0.00489310    0.00337517
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O   -1.95763554   -1.24821179    0.40806782   -0.01235290    0.01388373    0.00247273
C   -0.80608417    0.66306846   -0.10549184   -0.02322027   -0.02264597   -0.00607246
C   -0.82994690   -0.78512350    0.14525613   -0.01068296   -0.01839497    0.01578213
C    0.28776069    1.50828469    0.03875085   -0.00015898   -0.02368855   -0.00772724
C    0.41740478   -1.53119767   -0.19563176    0.02989409    0.02682421   -0.00455658
C    1.70390728    1.23867075    0.26501336    0.05181196   -0.00908417    0.00916838
C    1.75567831   -1.24542537   -0.24889488   -0.01006368   -0.02185427    0.00371978
H   -0.07526426    2.58961408    0.04900846   -0.01750733    0.02513855   -0.00021645
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H    2.30073984    2.07176860    0.60322522   -0.00306331   -0.00579394    0.00392921
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C    2.31343459    0.05220363    0.03504728   -0.01493575    0.02350819   -0.00323972
H    3.38561339    0.09680870    0.10406875   -0.01102048    0.00426111   -0.00161579
   15
   -420.52718265
H   -2.62257882    0.57484189   -0.14667197    0.01602062    0.00649379   -0.00071925
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O   -1.96521711   -1.25176454    0.40939393   -0.01579007    0.01150724    0.00332930
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C   -0.83348795   -0.78695642    0.14831876   -0.00947647   -0.01698178    0.01702650
C    0.29349008    1.50593281    0.03951609    0.00715629   -0.02115904   -0.00501362
C    0.41622782   -1.52807960   -0.19511663    0.02857367    0.02341505   -0.00555907
C    1.69548554    1.23916888    0.25794086    0.04757817   -0.00354432    0.00858274
C    1.75932320   -1.23397727   -0.25193023   -0.00701212   -0.00950325    0.00491287
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H    2.53639224   -2.00568371   -0.54518259    0.02607311   -0.01242264   -0.00725048
C    2.31119795    0.04784521    0.03887950   -0.02325212    0.01111226   -0.00619327
H    3.39043350    0.11200324    0.13629537   -0.00422888    0.00651158    0.00063267
   15
   -420.52849631
H   -2.60115297    0.56913075   -0.18196713    0.02388004    0.01173103   -0.00245650
O   -1.96630983    1.28206864   -0.30544587    0.00157297   -0.00027188    0.00302058
O   -1.97208200   -1.25583588    0.41056803   -0.01934080    0.00828339    0.00444418
C   -0.80996608    0.65441464   -0.12514623   -0.04609287   -0.02530782   -0.01579537
C   -0.83645712   -0.78777002    0.15035327   -0.00800287   -0.01402664    0.01794257
C    0.29880230    1.50481828    0.04058253    0.01130681   -0.01017274   -0.00189036
C    0.41333371   -1.52636843   -0.19426639    0.02508504    0.01819631   -0.00632869
C    1.68422454    1.23989050    0.25035813    0.03581567    0.00032062    0.00628795
C    1.76334819   -1.22193058   -0.25525033    0.00479130   -0.00192059    0.00362808
H   -0.01906548    2.57500105    0.07479049   -0.00785244    0.01524667    0.00102104
H    0.09224750   -2.54432461   -0.40916200   -0.00818945    0.00548238    0.00024129
H    2.26079828    2.09153537    0.57147887   -0.00663909   -0.00447488    0.00219786
H    2.52502226   -1.99066348   -0.54749006    0.02085597   -0.00787218   -0.00587398
C    2.31036348    0.04282593    0.04308879   -0.03076089   -0.00351781   -0.00962931
H    3.39823966    0.12253952    0.16804754    0.00356645    0.00825188    0.00319383
   15
   -420.52947822
H   -2.59607187    0.55573335   -0.21560982    0.01812857    0.00491739   -0.00241950
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O   -1.97807037   -1.26028105    0.41153952   -0.02265887    0.00443477    0.00581238
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   15
   -420.52761059
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   15
   -420.52473580
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   15
   -420.52408466
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O   -1.98933789   -1.27404336    0.41259648   -0.03107011   -0.00804057    0.01005289
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C    1.62971386    1.24117166    0.21857148   -0.04852796    0.01298449   -0.00792681
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C    2.32524375    0.03256015    0.06693135   -0.00701535   -0.03938676   -0.01020052
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   15
   -420.52413325
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O   -1.99043750   -1.27814680    0.41211704   -0.03331036   -0.01126936    0.01091368
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C    0.31215377    1.49258847    0.04369838    0.03311082   -0.02143193    0.00754578
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C    1.62011239    1.24014008    0.21133980   -0.06406610    0.01774274   -0.00947502
C    1.75817638   -1.16144238   -0.27053956    0.04606551    0.03017324   -0.00435602
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C    2.33172018    0.03516467    0.07468997    0.00681383   -0.03657727   -0.00581194
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   15
   -420.52270772
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O   -1.99002912   -1.28174220    0.41114386   -0.03463716   -0.01363138    0.01138955
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   15
   -420.52077121
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O   -1.98805514   -1.28472282    0.40965512   -0.03436845   -0.01499651    0.01154174
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C    1.61287049    1.23472365    0.19861650   -0.07097390    0.01902543   -0.01010350
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   15
   -420.52081239
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   15
   -420.52310217
H   -2.60660619    0.61782968   -0.35871225    0.01223614    0.01651020   -0.00508946
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O   -1.97956315   -1.28864617    0.40511563   -0.02721464   -0.01416430    0.01097675
C   -0.72855543    0.65868272   -0.14879795    0.05167471    0.01890107   -0.01957209
C   -0.85116864   -0.79017096    0.12061488   -0.00191106    0.01286585    0.00961211
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C    1.62228293    1.22527101    0.18834781   -0.05277983   -0.00616847   -0.01092860
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   15
   -420.52392548
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O   -1.97336958   -1.28962748    0.40209085   -0.02035778   -0.01179380    0.01017453
C   -0.72304463    0.65727422   -0.14419257    0.05778268    0.01842077   -0.01709135
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C    0.29041359    1.50532305    0.03771231   -0.02599466   -0.00632727    0.00281235
C    0.35301727   -1.53691547   -0.17039533   -0.01970619    0.00237105    0.00230695
C    1.63209124    1.22065064    0.18418816   -0.03949531   -0.02726287   -0.01158894
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   15
   -420.52229819
H   -2.64568720    0.59755385   -0.35169839   -0.01841922   -0.00840034   -0.00910716
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C   -0.85356631   -0.79753539    0.10504444   -0.01109365    0.00552921    0.00559041
C    0.28674773    1.51346467    0.03594654   -0.03834229    0.01908942    0.00328254
C    0.35041104   -1.53902929   -0.16782411   -0.01644747    0.00474597    0.00296326
C    1.64428304    1.21767550    0.18072732   -0.02518500   -0.04765798   -0.01184315
C    1.67889664   -1.14089372   -0.27671103    0.00606395   -0.01050650   -0.02781300
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C    2.35615427    0.07356883    0.11907019    0.00979266    0.04307420    0.02095960
H    3.44849903    0.01410377    0.27204445    0.01249186   -0.00612387    0.00455103
   15
   -420.52221666
H   -2.65083289    0.59200041   -0.33907151   -0.02141794   -0.01162598   -0.00897275
O   -1.90835878    1.26868191   -0.24365950    0.03708596    0.00890830    0.01219758
O   -1.95860890   -1.29015766    0.39471445   -0.00265859   -0.00383212    0.00747522
C   -0.72236993    0.65141095   -0.13201172    0.05030784    0.00713435   -0.01283743
C   -0.85390672   -0.80184086    0.09669095   -0.01576185    0.00042756    0.00337473
C    0.28534986    1.52054535    0.03398574   -0.04075286    0.02675251    0.00314200
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C    1.65799903    1.21755189    0.17797904   -0.01107060   -0.06199623   -0.01137322
C    1.66327095   -1.14143210   -0.27413369   -0.00375981   -0.02081741   -0.03056414
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H    0.26495296   -2.61670096   -0.27967008    0.01138616    0.00227915    0.00232322
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H    2.29035757   -1.95435511   -0.49478607   -0.02141197    0.02112914    0.00660178
C    2.35806115    0.07599893    0.12360652    0.01789036    0.05030845    0.02465021
H    3.44038537    0.01468439    0.25951180    0.00521750   -0.00469361    0.00292608
   15
   -420.52483316
H   -2.64120890    0.59432045   -0.32007448   -0.01353600   -0.00652499   -0.00733683
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O   -1.95083891   -1.29006474    0.39048439    0.00659977    0.00096046    0.00583016
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C   -0.85329926   -0.80617040    0.08813456   -0.01934606   -0.00503097    0.00091782
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   15
   -420.52623682
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   15
   -420.52545535
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   15
   -420.52590053
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O   -1.93074013   -1.29082615    0.37644786    0.02625115    0.01166874    0.00304074
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   15
   -420.52875306
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   15
   -420.53096399
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C   -0.83277762   -0.81766986    0.04820704   -0.00553924   -0.02123690   -0.01625148
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   15
   -420.53030177
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C   -0.82635004   -0.81655428    0.04224840    0.00310193   -0.02050670   -0.02023380
C    0.31489536    1.54982023    0.01514080   -0.01238733    0.03715184   -0.00035715
C    0.33446656   -1.58417400   -0.15721274    0.00060139   -0.00074045    0.00785846
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C    2.32457642    0.03156333    0.11342728    0.00162136   -0.03905357    0.01087226
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   15
   -420.52860332
H   -2.63914980    0.52631766   -0.09560335   -0.01554684   -0.01758803    0.00335267
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O   -1.91963559   -1.29842698    0.35525495    0.02016934    0.00489024    0.00839347
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C    1.74278734    1.31817403    0.17159970    0.02116599    0.02486258    0.00000000
C    1.62781952   -1.14737742   -0.20701452   -0.00333429    0.01786786   -0.00726014
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   15
   -420.52917274
H   -2.62977724    0.53286735   -0.06233387   -0.00824235   -0.01018289    0.00378598
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C   -0.81461569   -0.81073830    0.03421514    0.02080385   -0.01557208   -0.02676572
C    0.32873977    1.54815554    0.00895987   -0.00966510    0.02584396   -0.00266798
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C    2.30630822    0.02405864    0.10125591    0.00069414   -0.05999577    0.00450961
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   15
   -420.53045336
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C   -0.81036619   -0.80633406    0.03253157    0.02724910   -0.01181615   -0.02852942
C    0.33665236    1.54460812    0.00608653   -0.00016862   -0.00477634   -0.00199904
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   15
   -420.52952011
H   -2.60307427    0.55787136   -0.00227489    0.01602178    0.01538180   -0.00106428
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O   -1.92103950   -1.30672648    0.33566782    0.00195327   -0.00761142    0.01210973
C   -0.77062532    0.68356177   -0.04137280   -0.02818803   -0.01152249    0.01424984
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C    2.28779304    0.03054524    0.08793179    0.00222698   -0.05515566    0.00114854
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   15
   -420.52800900
H   -2.60220873    0.55889951    0.02771085    0.01681638    0.01776536   -0.00153089
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O   -1.92204793   -1.30905183    0.32809774   -0.00227392   -0.01118202    0.01222366
C   -0.76579709    0.69541300   -0.03556410   -0.02021348   -0.00386521    0.01500134
C   -0.80694549   -0.79564634    0.03433930    0.02939879   -0.00305845   -0.02765549
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C    2.27834455    0.03891975    0.08112125   -0.00566281   -0.04142320    0.00052665
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   15
   -420.52833066
H   -2.61273163    0.54786932    0.05850935    0.00601548    0.00851625    0.00249034
O   -1.99414133    1.24915044   -0.22734847   -0.02164414   -0.00331192   -0.01084697
O   -1.92296015   -1.31087233    0.31997559   -0.00468776   -0.01406465    0.01165885
C   -0.75975519    0.70749788   -0.03065921   -0.01052147    0.00381105    0.01505863
C   -0.80790088   -0.78988903    0.03777714    0.02443911    0.00123552   -0.02490421
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C    0.32591578   -1.62716014   -0.16741902   -0.02546153   -0.01793358    0.00385158
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   15
   -420.52964647
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O   -1.92366627   -1.31205764    0.31132692   -0.00539969   -0.01609970    0.01043429
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   15
   -420.52981753
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O   -1.92413206   -1.31251616    0.30220685   -0.00485659   -0.01715848    0.00867170
C   -0.74637162    0.73055560   -0.02353678    0.00868942    0.01702028    0.01332180
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   15
   -420.52782179
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O   -1.92438027   -1.31219967    0.29269459   -0.00355289   -0.01728639    0.00656280
C   -0.74018070    0.74073363   -0.02121527    0.01606267    0.02171903    0.01176139
C   -0.81749849   -0.77389788    0.05602932   -0.00419289    0.00989732   -0.00959153
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C    1.74683356    1.33964431    0.16271061    0.00744601    0.02156578    0.00687843
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   15
   -420.52578638
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O   -1.92446860   -1.31110171    0.28288516   -0.00187558   -0.01665289    0.00429823
C   -0.73495170    0.74960525   -0.01960385    0.02154447    0.02499154    0.00995875
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C    1.74394511    1.32886956    0.15977847    0.00757704   -0.00027271    0.00652949
C    1.66542712   -1.26845528   -0.11626559    0.02150642   -0.05612145    0.00270175
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   15
   -420.52583112
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O   -1.92447230   -1.30924984    0.27288060   -0.00007295   -0.01553673    0.00206686
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C    1.74058228    1.31808284    0.15644692    0.01089665   -0.01651238    0.00708074
C    1.66523664   -1.28159558   -0.10834083    0.01012306   -0.06455895    0.00281194
H    0.14923617    2.61281425   -0.07746376    0.01140290   -0.02395875    0.00159743
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C    2.25067418    0.09392014    0.04046515   -0.02855993    0.07851786   -0.00446158
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   15
   -420.52609989
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O   -1.92447249   -1.30669362    0.26278164    0.00166366   -0.01424985    0.00001570
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C   -0.82499252   -0.76295249    0.07935556   -0.03001108    0.01134547    0.00894434
C    0.36962780    1.59154418   -0.01325320    0.03600913   -0.01508232   -0.00481891
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C    1.66449207   -1.29090070   -0.10059277   -0.01237801   -0.05955179    0.00423221
H    0.12816152    2.65198373   -0.07847318    0.00374441    0.00007451    0.00017390
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   15
   -420.52581569
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O   -1.92454711   -1.30349034    0.25268087    0.00311419   -0.01309098   -0.00174182
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C    1.73151416    1.29982716    0.14839210    0.02276555   -0.02261491    0.01090447
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   15
   -420.52652507
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C   -0.72896460    0.76932484   -0.01806477    0.02968614    0.02487999    0.00293674
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C    0.35885647    1.61282938   -0.01449088    0.03727109   -0.02940076   -0.00345110
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C    1.72511067    1.29274145    0.14344169    0.02740120   -0.01529827    0.01335520
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H    2.46576605   -2.09207241   -0.14603079    0.02038346   -0.01357406    0.00192659
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   15
   -420.52885552
H   -2.58576046    0.44417781    0.11555900   -0.00510543   -0.00699768    0.00878981
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O   -1.92515193   -1.29533332    0.23277503    0.00391028   -0.01201033   -0.00410017
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C   -0.81700758   -0.75803801    0.09807541   -0.03673171    0.00954902    0.02200196
C    0.35007486    1.62600376   -0.01478028    0.03115183   -0.01963563   -0.00363892
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C    1.71707133    1.28657841    0.13768604    0.02781943   -0.00739009    0.01530368
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H    2.46668174   -2.10423728   -0.12116709    0.02173120   -0.01535231    0.00290483
C    2.26713764    0.06002574    0.01843612   -0.01922653    0.04029834   -0.01665768
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   15
   -420.53228132
H   -2.58911750    0.41736572    0.10520219   -0.01165170   -0.01547995    0.01122972
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C   -0.73635250    0.76997310   -0.01877911    0.02411291    0.01915744    0.00025253
C   -0.80994784   -0.75760782    0.10195943   -0.03261233    0.00889558    0.02436398
C    0.33942955    1.64030966   -0.01484727    0.02097204    0.00132012   -0.00430335
C    0.37082816   -1.62407865   -0.18390408    0.02447998   -0.01061336   -0.01748422
C    1.70737749    1.28088052    0.13100957    0.02280454   -0.00290362    0.01630683
C    1.67973698   -1.29807887   -0.07263215   -0.04111730   -0.02776167    0.00613927
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H    2.36048830    2.13161882    0.20721576   -0.00903877   -0.00430483   -0.00185326
H    2.45238765   -2.10574931   -0.09840082    0.01570768   -0.01038942    0.00398714
C    2.27386481    0.04302117    0.01489491   -0.01991951    0.01729342   -0.01986603
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   15
   -420.53483571
H   -2.58446940    0.40124570    0.08695649   -0.01178106   -0.01638835    0.01040340
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O   -1.92639037   -1.28496842    0.21358767   -0.00016406   -0.01261971   -0.00479797
C   -0.74233481    0.76846690   -0.01919826    0.01734299    0.01524792   -0.00088030
C   -0.80093432   -0.75771462    0.10437529   -0.02481008    0.00804477    0.02565115
C    0.32753155    1.65448953   -0.01465219    0.00778249    0.03106365   -0.00529708
C    0.36964792   -1.62063781   -0.18170401    0.01620422   -0.01509410   -0.01923475
C    1.69632491    1.27537648    0.12335171    0.01378540   -0.00195932    0.01634343
C    1.69027320   -1.29475457   -0.06653789   -0.02028246   -0.02605201    0.00673461
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H    0.11399174   -2.66043130   -0.34488906    0.00296461    0.00256179   -0.00204582
H    2.37509585    2.12207466    0.19541386   -0.00213836    0.00105893   -0.00121933
H    2.42715170   -2.10015237   -0.07848960    0.00358660    0.00067888    0.00479278
C    2.28177039    0.02497188    0.01254794   -0.01541823   -0.00596983   -0.02170620
H    3.38569268    0.15014518    0.14035595    0.01564305    0.01791185    0.00503939
   15
   -420.53499839
H   -2.57169453    0.39651432    0.06135756   -0.00595622   -0.01037728    0.00727733
O   -2.00994304    1.21602688   -0.14831760   -0.00027165    0.00677909   -0.01036887
O   -1.92705352   -1.27893679    0.20431513   -0.00397167   -0.01286672   -0.00464023
C   -0.74935351    0.76604047   -0.01956458    0.00812339    0.01095368   -0.00193228
C   -0.79043690   -0.75830479    0.10524523   -0.01372412    0.00655440    0.02587176
C    0.31516217    1.66679904   -0.01413806   -0.00514582    0.05863971   -0.00599826
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   15
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   15
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   15
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   15
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   15
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   15
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   15
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   15
   -420.49661713
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   15
   -420.50044852
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   15
   -420.50203826
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O   -1.97998844   -1.34412946   -0.10313354   -0.05047313   -0.03336784    0.00623562
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   15
   -420.50352480
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O   -1.96337211   -1.33927060   -0.11513087   -0.02331348   -0.01623241    0.00617315
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C    1.54504975    1.10439765   -0.03297167   -0.06902634   -0.03980210    0.01979991
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   15
   -420.50505692
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C    2.39400374   -0.03922931   -0.15355929    0.02362612   -0.04370898   -0.02517388
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   15
   -420.50352467
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C    1.55879292    1.11149554   -0.05352145   -0.06141800   -0.02665969    0.01429928
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   15
   -420.50032305
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C    1.57138420    1.11767172   -0.06518372   -0.05089699   -0.02026590    0.01041590
C    1.84957441   -1.30362328    0.12975768    0.02511962   -0.02195843    0.01359554
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H    2.57277051   -2.13212256    0.29730665    0.02128520   -0.00364723    0.00273892
C    2.39134297   -0.03890400   -0.15396847    0.02972621   -0.03943026   -0.01526729
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   15
   -420.50041567
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C    1.58703577    1.12508142   -0.07747326   -0.03683506   -0.01545335    0.00601162
C    1.85037179   -1.30996048    0.12763488    0.03268334   -0.02959867    0.00861047
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C    2.38742179   -0.03506242   -0.15263945    0.02946032   -0.03229401   -0.01039027
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   15
   -420.50580014
H   -2.81896722    0.76337441   -0.01818208   -0.00742058    0.00769501   -0.00079038
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O   -1.89472689   -1.32223448   -0.18040319    0.08313925    0.05102575    0.01059962
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C    1.60490659    1.13343793   -0.09012534   -0.02105710   -0.01305299    0.00139554
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   15
   -420.51309592
H   -2.82340430    0.78031105    0.00941702    0.00376917    0.01672914    0.00131663
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O   -1.89102214   -1.32475212   -0.19484270    0.05763760    0.03803765    0.00677490
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C    1.84548846   -1.31687232    0.12209502    0.04934077   -0.04061234   -0.00024042
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   15
   -420.51727717
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O   -1.88990693   -1.32897740   -0.20958170    0.02518535    0.02015346    0.00089398
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   15
   -420.51700615
H   -2.84183257    0.77716371    0.06146518    0.00108600    0.01364016    0.00181584
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O   -1.88994288   -1.33411712   -0.22435867   -0.00525541    0.00217894   -0.00568311
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C   -0.80681606   -0.73650745   -0.02734639    0.02355687   -0.00437086    0.01254374
C    0.26767671    1.49466398    0.06745530   -0.00724888    0.03504713    0.00697278
C    0.42937103   -1.48551752    0.18135001   -0.02321160    0.03921532   -0.00856517
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C    1.82899162   -1.31430558    0.11665635    0.05088856   -0.03544536   -0.01096250
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   15
   -420.51481483
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   15
   -420.51099036
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   15
   -420.50462777
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   15
   -420.49771166
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   15
   -420.49338102
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   15
   -420.49330749
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   15
   -420.49654943
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   15
   -420.49963001
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   15
   -420.50099693
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   15
   -420.50173659
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   15
   -420.50159817
H   -2.74684011    0.60736646    0.22080320   -0.00560160   -0.01492789    0.00465658
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O   -1.79430759   -1.33311852   -0.34224678    0.11572157    0.05503909    0.02808276
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C   -0.83221769   -0.75202042   -0.03159928   -0.08971433   -0.04010925   -0.02804609
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C    1.75087888    1.25911887   -0.21480054    0.02606852    0.03525251   -0.00423608
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C    2.34132887   -0.00283941   -0.18761982    0.00372043   -0.02203242   -0.00092251
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   15
   -420.50047729
H   -2.73733433    0.61221509    0.21965803   -0.00009649   -0.00660822    0.00399184
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O   -1.78977963   -1.33341084   -0.35212787    0.14009900    0.06681664    0.03780548
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C    0.32203226    1.46656359    0.09752891    0.01448447   -0.05096293    0.00604348
C    0.36027265   -1.61120228    0.32000492   -0.01244906   -0.04011554    0.00021780
C    1.74825300    1.25635714   -0.21956953    0.02832634    0.03057287   -0.00394965
C    1.66492287   -1.21577431    0.17271668   -0.02253172    0.02367504    0.00725069
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C    2.33953387   -0.00395824   -0.19424506    0.00901298   -0.02675165   -0.00520317
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   15
   -420.50104512
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   15
   -420.50505663
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   15
   -420.51107242
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   15
   -420.51503150
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   15
   -420.51437820
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   15
   -420.51189480
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C    1.69266103    1.22013002   -0.24300505    0.02138384   -0.03806186   -0.00226356
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C    2.30737623    0.01730988   -0.21934390    0.00570890    0.01511805   -0.02050602
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   15
   -420.51149385
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O   -1.87527328   -1.38086113   -0.45034826   -0.05400469   -0.04876136   -0.03140581
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C    1.64044923   -1.19181409    0.20993503   -0.00835095    0.01550680    0.01620855
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C    2.29883240    0.02140401   -0.21962627    0.00237308    0.02448682   -0.01996315
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   15
   -420.51155990
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O   -1.88745674   -1.38421959   -0.46251288   -0.06474814   -0.05440119   -0.03642039
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C    1.63686333   -1.19085867    0.21109556   -0.01548610    0.01994824    0.01325347
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C    2.29011869    0.02403336   -0.21870395    0.00420098    0.03065931   -0.01887435
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   15
   -420.50941307
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O   -1.89672200   -1.38511942   -0.47303212   -0.07019976   -0.05742200   -0.03950826
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   15
   -420.50632507
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O   -1.90282004   -1.38342215   -0.48176521   -0.07082121   -0.05820670   -0.04086466
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C    1.63277103   -1.19254947    0.21124758   -0.02293733    0.01696513    0.00551080
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C    2.27150356    0.02363059   -0.21353319    0.01779939    0.03218649   -0.01530363
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   15
   -420.50430614
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C   -0.70696981    0.71557374    0.13961464    0.02836113   -0.01722975    0.01330352
C   -0.81218279   -0.77883703   -0.02581734    0.03015789    0.02185816    0.02001646
C    0.34384431    1.65930446    0.06326927    0.02262928    0.00786389   -0.00036419
C    0.32533393   -1.51605126    0.43822870    0.03479948   -0.00055002    0.03141919
C    1.61828894    1.23215088   -0.25767214   -0.04355834   -0.01742764   -0.00475700
C    1.63271167   -1.19501683    0.21070229   -0.02255095    0.00993858    0.00168293
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H    2.19148125   -2.13032585    0.30689357   -0.01650782   -0.01111279    0.00060724
C    2.26081875    0.02050374   -0.20950411    0.02208051    0.02799949   -0.01212610
H    3.31378496    0.04339378   -0.43437662   -0.00550377    0.00709956    0.00123213
   15
   -420.50294097
H   -2.54854725    0.48501047    0.01577792   -0.00112140   -0.00365181   -0.00218345
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O   -1.90562453   -1.37219548   -0.49371012   -0.05715574   -0.05286972   -0.03793129
C   -0.69934472    0.71301983    0.14486928    0.02419844   -0.01413638    0.01616350
C   -0.82799033   -0.78156212   -0.03168375    0.00241231    0.02047359    0.01388991
C    0.33941648    1.66955368    0.05859679    0.01953156    0.02203410   -0.00043961
C    0.33362307   -1.50700467    0.44320036    0.05778837    0.00621410    0.03419400
C    1.60822447    1.24006182   -0.25997835   -0.05111141   -0.00641186   -0.00608147
C    1.63400297   -1.19808328    0.21005439   -0.01954906    0.00257567   -0.00200683
H    0.16363488    2.77352343    0.09552663    0.00737619    0.02379604   -0.00048442
H    0.00979107   -2.54363931    0.47271212   -0.01199755    0.00801528   -0.01396390
H    2.38172391    1.97991206   -0.43940365    0.00745695   -0.01444803    0.00520899
H    2.17989935   -2.12145958    0.35296581   -0.02218027   -0.00499335    0.00256435
C    2.24883159    0.01569725   -0.20475095    0.01996422    0.02106599   -0.00713987
H    3.29500413    0.01422942   -0.46524935   -0.00512962    0.00395839   -0.00039134
   15
   -420.50063397
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   15
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   15
   -420.49509864
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   15
   -420.49508254
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   15
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   15
   -420.49386976
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   15
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   15
   -420.49738296
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   15
   -420.49989249
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   15
   -420.50099400
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   15
   -420.50209685
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   15
   -420.50574033
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   15
   -420.50986828
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O   -1.88884196   -1.19347897   -0.49296446   -0.04475162   -0.00014514   -0.01800244
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   15
   -420.51038105
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O   -1.88654082   -1.17867336   -0.48960952   -0.04638573    0.00451911   -0.01579048
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   15
   -420.50733888
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O   -1.88215745   -1.16407988   -0.48554450   -0.04203108    0.01106637   -0.01186591
C   -0.67832004    0.62685805    0.08489770    0.02377286   -0.06155030   -0.00707296
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C    1.66685208    1.32300134   -0.24426805    0.01055501    0.01729111    0.01756553
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   15
   -420.50265578
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C   -0.71362815   -0.76826084   -0.11617842    0.05453155    0.05322479   -0.00261198
C    0.31820789    1.56136252   -0.02369980    0.03583579   -0.04522537   -0.00588170
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C    1.66687876    1.32436511   -0.24409031    0.00272101    0.02218910    0.02078780
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H   -0.05022067    2.64890827   -0.01773820   -0.01029152    0.03224382   -0.00207650
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C    2.15732732    0.04483346   -0.23446995   -0.01268155    0.02089526   -0.02079304
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   15
   -420.49769257
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C   -0.70033308    0.62915887    0.06846074    0.00921537   -0.06652629   -0.01254306
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C    1.66673334    1.32438820   -0.24516423   -0.00364268    0.02682166    0.02290721
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C    2.16525765    0.05164019   -0.23969816   -0.00804651    0.02702369   -0.02620888
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   15
   -420.49288733
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O   -1.85989962   -1.12497927   -0.47121670    0.00741877    0.04142024    0.00863624
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C   -0.72069920   -0.77451083   -0.13261701    0.01556258    0.03842803   -0.02228445
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C    1.66679731    1.32279411   -0.24761775   -0.00784556    0.03043213    0.02387062
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H    2.31638656    2.09220957   -0.65511313    0.00200647   -0.00655555   -0.00900064
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C    2.17370552    0.05681658   -0.24335117   -0.00934680    0.03229256   -0.02968257
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   15
   -420.48788656
H   -2.62840861    0.44556051    0.08290460   -0.01319801   -0.00901156   -0.00236677
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O   -1.85192965   -1.11503136   -0.46676036    0.03281955    0.05313328    0.01708431
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C    1.66732374    1.31936862   -0.25150941   -0.00968430    0.03220865    0.02373335
C    1.59585505   -1.18211358    0.32365456   -0.03301464    0.01774049    0.00983123
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   15
   -420.48433992
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O   -1.84544558   -1.10748905   -0.46307606    0.05727363    0.06342785    0.02466832
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C    1.66842513    1.31400729   -0.25683131   -0.00937531    0.03157927    0.02256375
C    1.60205398   -1.17477294    0.32812224   -0.02182228    0.02879688    0.00716612
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   15
   -420.48512940
H   -2.59891403    0.44346664    0.12332434    0.00889023    0.00919467    0.00405269
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O   -1.84153502   -1.10281262   -0.46050160    0.07502494    0.07051391    0.02973502
C   -0.74735956    0.67626230    0.04496310   -0.01696675   -0.01582727   -0.01458681
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C    1.67008423    1.30674898   -0.26351242   -0.00719168    0.02840105    0.02031532
C    1.60958186   -1.16916985    0.33215654   -0.01239698    0.03902359    0.00449727
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   15
   -420.48973860
H   -2.58924997    0.43643199    0.14045201    0.01386119    0.01339100    0.00525210
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C   -0.73538417   -0.80577006   -0.14515004   -0.04732700   -0.02487394   -0.04681243
C    0.30445325    1.52486782   -0.04719528    0.00468165   -0.04386420   -0.00441945
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C    1.67216961    1.29778395   -0.27141611   -0.00331466    0.02308198    0.01687571
C    1.61787115   -1.16590806    0.33591467   -0.00529073    0.04551581    0.00266721
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C    2.21580176    0.05613108   -0.23913467   -0.01529508    0.03733971   -0.03240923
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   15
   -420.49553584
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O   -2.00873972    1.17477506    0.34552630   -0.02600205   -0.00898920    0.00643747
O   -1.84405158   -1.10312018   -0.45940211    0.07327254    0.07073274    0.02742165
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C   -0.73327895   -0.81197938   -0.14169892   -0.03602042   -0.03232982   -0.04222933
C    0.29881539    1.52355994   -0.05013384   -0.00270293   -0.06916391   -0.00565963
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C    1.67444882    1.28742939   -0.28033429    0.00190697    0.01648450    0.01220193
C    1.62649104   -1.16536988    0.33950433   -0.00031485    0.04625098    0.00226449
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H    2.35350055   -1.92918580    0.67081816   -0.00455101   -0.01263903    0.00201597
C    2.22886752    0.05022749   -0.23316682   -0.00630348    0.03330304   -0.03100472
H    3.31509131   -0.03722094   -0.30070869    0.00266233   -0.00115629    0.00489874
   15
   -420.50068719
H   -2.59489871    0.39944061    0.16478789   -0.00056827   -0.00397479    0.00154667
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O   -1.85040400   -1.10811620   -0.46077326    0.05503087    0.06439639    0.02035192
C   -0.77408889    0.72462646    0.03659988   -0.01661920    0.03202026   -0.01560009
C   -0.72905216   -0.81625093   -0.13571747   -0.01349179   -0.03630688   -0.03295808
C    0.29334498    1.52636180   -0.05273457   -0.01086627   -0.08020629   -0.00606013
C    0.34005999   -1.72058177    0.39639929   -0.00787380   -0.06339288    0.02438362
C    1.67660872    1.27607890   -0.28998510    0.00791782    0.00965314    0.00646052
C    1.63513806   -1.16759757    0.34294910    0.00304431    0.04079801    0.00342979
H    0.09189567    2.64454104    0.08553818    0.00050865    0.02850242    0.00536607
H    0.01248074   -2.70472833    0.78474991   -0.01161798   -0.01231089    0.00581905
H    2.33858841    2.11863626   -0.51654111    0.00715616    0.00170519   -0.00076923
H    2.39053597   -1.89483684    0.69268461    0.00160458   -0.00798744    0.00290947
C    2.24230200    0.04231893   -0.22532866    0.00509424    0.02744417   -0.02863063
H    3.31668749   -0.05059029   -0.29785279   -0.00467490   -0.00207756    0.00455441
   15
   -420.50469992
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   15
   -420.50745958
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   15
   -420.50796751
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   15
   -420.50552215
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   15
   -420.50297976
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   15
   -420.50379284
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   15
   -420.50699297
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   15
   -420.51016828
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   15
   -420.51234252
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   15
   -420.51370739
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   15
   -420.51419511
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   15
   -420.51225782
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   15
   -420.50746658
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   15
   -420.50315346
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   15
   -420.50131942
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O   -1.90923923   -1.32213406   -0.43734773    0.00212194   -0.01797184   -0.01434705
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   15
   -420.50007114
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O   -1.90712984   -1.33452407   -0.42891358    0.00030716   -0.02240070   -0.01400470
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C   -0.88875803   -0.70037525   -0.09468427   -0.08413104    0.01706040    0.01063958
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C    1.62070305    1.14727483   -0.31620590   -0.03059359   -0.00873520   -0.00043563
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   15
   -420.49912131
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C    1.62423607    1.14494689   -0.30885673   -0.02455526   -0.01104707    0.00417788
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   15
   -420.49972278
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C    1.62924703    1.14329506   -0.30175980   -0.01708174   -0.01488149    0.00870364
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C    2.33404692    0.00267565   -0.02115726   -0.00717304    0.03026339   -0.01358957
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   15
   -420.50173109
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C    0.30558187    1.56787494   -0.09322316    0.00813148   -0.01371944    0.00598303
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   15
   -420.50320931
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C    1.76386230   -1.26392227    0.34482933    0.04627948   -0.03152015    0.03519346
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   15
   -420.50198888
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O   -1.89228529   -1.37608909   -0.37747833   -0.02289001   -0.04605040   -0.00935902
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C   -0.83024672   -0.69032965   -0.13197984    0.02865640    0.00405298   -0.00063552
C    0.30543073    1.53685831   -0.09923070    0.00739044    0.01668233   -0.00148693
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C    1.64857477    1.14470302   -0.28459037    0.00508539   -0.02322991    0.01815621
C    1.75144260   -1.26636529    0.33744750    0.03108238   -0.03769619    0.03616257
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   15
   -420.49951833
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C   -0.81739678   -0.68994979   -0.14005269    0.05024232    0.00028565   -0.00501054
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C    1.65496678    1.14784181   -0.28086982    0.00997372   -0.02050216    0.01754645
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   15
   -420.49910061
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O   -1.88055516   -1.37939182   -0.35347584   -0.02060442   -0.04522317   -0.00354247
C   -0.83459878    0.75974570    0.15642156   -0.02376801    0.03409657    0.02650118
C   -0.80754276   -0.68960021   -0.14781797    0.06337702   -0.00090998   -0.01027767
C    0.30350186    1.50235377   -0.10494313    0.00760777    0.01869265   -0.00457765
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C    1.66076669    1.15220236   -0.27819799    0.01265573   -0.01421697    0.01445067
C    1.72200429   -1.26407007    0.31620492   -0.00284885   -0.04860436    0.03239551
H    0.07800127    2.49654900   -0.33498281    0.00488767   -0.03525624    0.00267037
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H    2.41923162   -2.12313438    0.36901214    0.01754162   -0.00519428   -0.01033190
C    2.35374496    0.01416660    0.04123777   -0.00979951    0.01848135    0.00018074
H    3.44905253    0.13256213   -0.03910003    0.00894297    0.01123315   -0.00028664
   15
   -420.50000783
H   -2.65780680    0.55403285    0.16123869   -0.00016012   -0.00561035   -0.00308449
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C   -0.84091104    0.75631629    0.15545503   -0.02573378    0.03340427    0.02513693
C   -0.80146960   -0.68921404   -0.15495724    0.06621083    0.00151964   -0.01641866
C    0.30187206    1.48324167   -0.10739354    0.01229522   -0.01007849    0.00165084
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C    1.66581257    1.15741009   -0.27639011    0.01307475   -0.00545424    0.00940032
C    1.70702300   -1.25867826    0.30257255   -0.01864321   -0.05209542    0.02754292
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H    0.08593349   -2.41178906    0.33678733    0.01071446    0.02129768    0.00860863
H    2.11794441    1.94364697   -0.88447461   -0.01564125    0.00016612   -0.01417394
H    2.43778218   -2.07891760    0.35662839    0.01814347    0.00355493   -0.01080897
C    2.35953789    0.01099179    0.05491561   -0.00122461    0.00361111    0.00713289
H    3.45429408    0.12494878   -0.02753881    0.00866659    0.01178077   -0.00134030
   15
   -420.50055223
H   -2.66286255    0.54882593    0.15890644   -0.00556896   -0.01481478   -0.00517229
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   15
   -420.50181674
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   15
   -420.50454820
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   15
   -420.50755668
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   15
   -420.50873054
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   15
   -420.50712493
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   15
   -420.50439402
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O   -1.83515855   -1.33564301   -0.26430834    0.08598671    0.02817497    0.02029436
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   15
   -420.50251109
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   15
   -420.50087259
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   15
   -420.49932760
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   15
   -420.49952598
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C    2.36185347    0.07966910    0.11640892    0.00358228    0.03670342    0.01214595
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   15
   -420.50196273
H   -2.82196495    0.81387421    0.27754037   -0.00411207    0.01198700    0.00219150
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O   -1.89279383   -1.32347906   -0.23174534    0.01894686    0.00797042    0.00375996
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C   -0.79405169   -0.76784768   -0.08944165    0.02627759    0.02471344   -0.00996250
C    0.27124805    1.42716730   -0.18152237   -0.01030233   -0.06331055    0.00009327
C    0.39581359   -1.62171843    0.05053486   -0.00013797   -0.04963926    0.02231765
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H    2.36769654    2.06326695   -0.21379288    0.00794404   -0.01279099    0.01051380
H    2.22268387   -2.02539889    0.48336596   -0.02977767    0.00547629    0.00618058
C    2.35974164    0.09069075    0.11325531    0.00826377    0.05443382    0.00779544
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   15
   -420.50631305
H   -2.81634934    0.84036715    0.28984573    0.00820511    0.02283270    0.00265187
O   -2.03564333    1.39174399    0.29238662   -0.04996839    0.00883057    0.00882410
O   -1.91066122   -1.32340298   -0.22656576   -0.00170298    0.00254862   -0.00134674
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C   -0.78742745   -0.78503692   -0.07215243    0.04982424    0.01361114   -0.00067493
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   15
   -420.51118054
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   15
   -420.51400998
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   15
   -420.51464426
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   15
   -420.51533367
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C    1.71027243    1.26119034   -0.16821708    0.02223824   -0.00928123   -0.01542361
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   15
   -420.51558366
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C   -0.81377285   -0.86615600    0.00478443    0.05828709   -0.04710837    0.03474458
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   15
   -420.51420727
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C   -0.83167221   -0.87620193    0.01526022    0.03555856   -0.05151042    0.03794666
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C    1.69899125    1.29316029   -0.13736250    0.01727620    0.02253030   -0.01056206
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   15
   -420.51131788
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C   -0.85169649   -0.88314412    0.02344870    0.00773143   -0.05359306    0.03961813
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   15
   -420.50847897
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O   -2.01579062   -1.32360385   -0.16859882   -0.00753953    0.00863991   -0.01799102
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C   -0.87217632   -0.88685457    0.02924824   -0.02247602   -0.05376505    0.03987925
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C    1.73988454   -1.27625145    0.13957222   -0.00615952   -0.06370889    0.01813958
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   15
   -420.50749347
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O   -2.02387781   -1.32439444   -0.15784710    0.00434859    0.00985285   -0.01671077
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C   -0.89130153   -0.88732316    0.03264120   -0.05170080   -0.05196292    0.03910485
C    0.29870857    1.57457173   -0.23586466    0.01717995   -0.00296574   -0.01919796
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H    2.55030458   -1.99304358    0.10342983    0.00166182    0.02048765   -0.00601848
C    2.32402721    0.05887409    0.08380824    0.03569522   -0.04053481   -0.00838844
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   15
   -420.50693811
H   -2.56777817    0.59761493    0.28384036    0.00574108   -0.00741246    0.00189610
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O   -2.03214987   -1.32562446   -0.14633635    0.01289726    0.00905164   -0.01564518
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C   -0.90732426   -0.88466171    0.03367174   -0.07604401   -0.04762447    0.03782605
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C    0.41399156   -1.63077278   -0.05353414    0.01809475    0.02703217   -0.02732186
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C    1.76424158   -1.28032964    0.13723455    0.01689761   -0.04767679    0.02807526
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H    2.54559242   -2.02779767    0.05634741    0.00568696    0.00986552   -0.00828082
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   15
   -420.50468438
H   -2.54182697    0.55349235    0.27347590    0.00104105   -0.01867366    0.00264166
O   -1.90337119    1.33263596    0.20697645    0.02679376    0.03270301    0.00448099
O   -2.04098293   -1.32725442   -0.13411357    0.01501285    0.00542188   -0.01514154
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C   -0.91879098   -0.87913642    0.03241509   -0.09180690   -0.04000884    0.03645297
C    0.29566075    1.60739913   -0.23377417   -0.00323756    0.05072193   -0.01608407
C    0.41513518   -1.63546633   -0.05797086    0.01928396    0.01500207   -0.02875178
C    1.65683914    1.34266731   -0.05314555   -0.00907030    0.03245602    0.00765632
C    1.77518122   -1.27770088    0.13366682    0.02521796   -0.02971607    0.03269556
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H    2.53672057   -2.06945082    0.01525978    0.01083593   -0.00417276   -0.01101655
C    2.30284036    0.05931775    0.08270000    0.00354808   -0.03865344   -0.01860263
H    3.34049335    0.23001780    0.38734317   -0.00141231    0.01248878    0.00886188
   15
   -420.50249230
H   -2.51692533    0.52240828    0.26125292    0.00127352   -0.02326267    0.00271903
O   -1.89155623    1.32239220    0.19737210    0.03342329    0.03499633    0.00380715
O   -2.05046634   -1.32911894   -0.12120202    0.00901740   -0.00121033   -0.01510372
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C   -0.92475976   -0.87120934    0.02895388   -0.09679530   -0.02883248    0.03503368
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C    1.64846553    1.34592595   -0.03683860   -0.01580874    0.02698676    0.01078035
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H    2.52025278   -2.10823139   -0.01791722    0.01269049   -0.01612446   -0.01337413
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   15
   -420.50208313
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O   -1.88123706    1.31059145    0.18759264    0.03454061    0.02909134    0.00378989
O   -2.06033092   -1.33091983   -0.10760509   -0.00434882   -0.01012285   -0.01507579
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C   -0.92492737   -0.86155326    0.02337617   -0.09130910   -0.01473405    0.03314783
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C    0.41402149   -1.64631693   -0.06165886    0.01566204   -0.02560524   -0.02711480
C    1.64104339    1.34754651   -0.02118143   -0.02163038    0.02263062    0.01347194
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   15
   -420.50187697
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O   -2.06998100   -1.33225804   -0.09332635   -0.02226752   -0.01991691   -0.01445673
C   -0.71175109    0.69848607   -0.04692446    0.02430854    0.01266225   -0.01264744
C   -0.91961214   -0.85101294    0.01579914   -0.07797754    0.00071153    0.03018297
C    0.29248891    1.63600312   -0.22355725   -0.00346030    0.02014183   -0.00805350
C    0.41196883   -1.65009487   -0.06100503    0.01384087   -0.03912894   -0.02484477
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C    1.79597086   -1.26268540    0.11047053    0.06521634    0.00294232    0.03560706
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C    2.27159545    0.07552540    0.08965415   -0.03019787   -0.00478024   -0.02140490
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   15
   -420.50102475
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O   -2.07861737   -1.33269482   -0.07839545   -0.04110959   -0.02911145   -0.01285088
C   -0.70152608    0.69538299   -0.04919689    0.02854603    0.01326124   -0.01174220
C   -0.90960220   -0.84051246    0.00640437   -0.06040476    0.01554858    0.02569499
C    0.29216096    1.64138015   -0.21885748   -0.00076651    0.00300597   -0.00323802
C    0.40906694   -1.65158003   -0.05885164    0.01429529   -0.03843389   -0.02194116
C    1.63035646    1.34685879    0.00756445   -0.02827672    0.01660616    0.01735414
C    1.79621186   -1.25747538    0.09838339    0.08023806   -0.00082415    0.03118637
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H    2.42923851   -2.14332845   -0.05831698   -0.00809939   -0.01506570   -0.01160851
C    2.26426770    0.08259793    0.09462789   -0.02641346    0.01022315   -0.01734397
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   15
   -420.50053079
H   -2.47192645    0.51983319    0.19842669    0.02321303    0.00898140    0.00018959
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O   -2.08539649   -1.33181720   -0.06288539   -0.05788675   -0.03657448   -0.01021000
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C   -0.89594453   -0.83094097   -0.00453627   -0.04169112    0.02815126    0.01961660
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C    1.62749337    1.34492645    0.02041727   -0.02907869    0.01273636    0.01875701
C    1.79161785   -1.25218785    0.08442076    0.09161757   -0.00988864    0.02469648
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H    2.40148200   -2.12872901   -0.05346605   -0.01899050   -0.00373006   -0.00854473
C    2.25850589    0.08906048    0.10064448   -0.01654736    0.02363652   -0.01208058
H    3.33530177   -0.00207592    0.25543136   -0.00239710   -0.02215254    0.00290005
   15
   -420.50188068
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O   -2.08956336   -1.32928885   -0.04691526   -0.07093969   -0.04168454   -0.00671321
C   -0.68641794    0.68679202   -0.05168958    0.03314799    0.01190179   -0.00896891
C   -0.87976248   -0.82305529   -0.01665684   -0.02349805    0.03742333    0.01225962
C    0.29178055    1.65176344   -0.20903586   -0.00713686    0.00321681    0.00054268
C    0.40051531   -1.64838964   -0.05083024    0.01879837   -0.01335379   -0.01222914
C    1.62638407    1.34223357    0.03213649   -0.02889416    0.00700098    0.01998762
C    1.78152764   -1.24631079    0.06896769    0.09402276   -0.01717613    0.01754617
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H    2.36386381    2.13180597   -0.03020627    0.00170964   -0.00945018   -0.00372458
H    2.38713462   -2.11129186   -0.04243239   -0.02539787    0.00499771   -0.00593877
C    2.25373719    0.09410985    0.10739178   -0.00529468    0.03383665   -0.00680710
H    3.31781975   -0.01841217    0.21322260   -0.01378013   -0.02361396   -0.00074876
   15
   -420.50543084
H   -2.52717866    0.51520861    0.16409695   -0.00081841    0.00020630    0.00178174
O   -1.85060898    1.24375714    0.13587583    0.04512610   -0.00976975    0.00271966
O   -2.09052706   -1.32487899   -0.03064270   -0.07987209   -0.04418217   -0.00263329
C   -0.68180994    0.68139001   -0.05207807    0.03288265    0.00922242   -0.00701621
C   -0.86215509   -0.81741276   -0.02951481   -0.00610476    0.04269475    0.00408663
C    0.29211008    1.65675466   -0.20413325   -0.01562804    0.02111748   -0.00239208
C    0.39460935   -1.64515702   -0.04554992    0.01970468   -0.00327991   -0.00538735
C    1.62701884    1.33912517    0.04264798   -0.02799002   -0.00024651    0.02099114
C    1.76582273   -1.23944208    0.05245217    0.08237802   -0.01547794    0.01058750
H   -0.08908229    2.66277816   -0.46062779   -0.00930875    0.01006927   -0.01060263
H    0.17635638   -2.74891916   -0.05748544   -0.00552909   -0.02171922    0.00094053
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H    2.39051073   -2.09687040   -0.02705711   -0.02257250    0.00437772   -0.00433647
C    2.24931476    0.09713264    0.11455447    0.00086013    0.04007574   -0.00220278
H    3.30984877   -0.01790571    0.17148153   -0.01834942   -0.02241827   -0.00325574
   15
   -420.50904486
H   -2.55928312    0.51022553    0.14534748   -0.01454806   -0.00499947    0.00213452
O   -1.84922596    1.23144355    0.12503359    0.05510610   -0.00729163    0.00219750
O   -2.08788101   -1.31847426   -0.01425185   -0.08500177   -0.04406887    0.00176804
C   -0.67917974    0.67543795   -0.05204425    0.03048906    0.00500895   -0.00466168
C   -0.84417616   -0.81433048   -0.04261825    0.01085830    0.04359363   -0.00442813
C    0.29339386    1.66042149   -0.19906806   -0.02573486    0.04791468   -0.00871532
C    0.38752128   -1.64169844   -0.03994569    0.01869833    0.00130324    0.00181932
C    1.62934194    1.33603158    0.05189237   -0.02616666   -0.00746122    0.02150933
C    1.74520523   -1.23168004    0.03529796    0.05716685   -0.00559919    0.00330611
H   -0.06437310    2.62784374   -0.46871021    0.00078813   -0.01496429   -0.00534329
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H    2.40959409   -2.08508855   -0.00855737   -0.01085004   -0.00446661   -0.00274808
C    2.24488571    0.09775318    0.12185162   -0.00169884    0.04191977    0.00213897
H    3.31446200   -0.00138249    0.13204326   -0.01279791   -0.01913047   -0.00514170
   15
   -420.51117303
H   -2.58131139    0.50855168    0.12510194   -0.02170042   -0.00541495    0.00180640
O   -1.85031797    1.21947634    0.11408944    0.05846675   -0.00884295    0.00224505
O   -2.08139067   -1.31007906    0.00205851   -0.08678944   -0.04152518    0.00624301
C   -0.67838376    0.66918825   -0.05173001    0.02619228   -0.00025701   -0.00200551
C   -0.82685329   -0.81386215   -0.05545432    0.02767224    0.03998939   -0.01285538
C    0.29621560    1.66121187   -0.19347588   -0.03203810    0.06998067   -0.01480121
C    0.37931357   -1.63829004   -0.03444865    0.01550835    0.00013628    0.00845350
C    1.63324230    1.33337891    0.05984004   -0.02327739   -0.01263619    0.02120760
C    1.72116531   -1.22358114    0.01794851    0.02497268    0.00482260   -0.00484113
H   -0.04014790    2.60345498   -0.47295682    0.00930282   -0.03564731   -0.00011018
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H    2.42001513    2.09259314    0.01385960    0.01168078   -0.00915422   -0.00227502
H    2.43630186   -2.07006959    0.01185679    0.00408651   -0.01378182   -0.00012812
C    2.24058937    0.09586379    0.12901687   -0.01007871    0.03866860    0.00692749
H    3.32788617    0.02878083    0.09632472   -0.00063329   -0.01366956   -0.00725653
   15
   -420.51320593
H   -2.58822208    0.51047204    0.10358168   -0.02035780   -0.00069333    0.00102733
O   -1.85403177    1.20792670    0.10304172    0.05359397   -0.01475081    0.00273470
O   -2.07097421   -1.29980780    0.01808628   -0.08538706   -0.03682791    0.01054195
C   -0.67916505    0.66295528   -0.05129500    0.02056233   -0.00578868    0.00075358
C   -0.81120191   -0.81579088   -0.06751538    0.04402543    0.03210316   -0.02078924
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C    0.37017895   -1.63486721   -0.02945570    0.01016989   -0.00537431    0.01371220
C    1.63854552    1.33147264    0.06651020   -0.01938543   -0.01431470    0.01990630
C    1.69561246   -1.21574635    0.00089336   -0.00684435    0.00995576   -0.01327583
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H    2.42491783    2.09354074    0.03231031    0.01241503   -0.00830475   -0.00170160
H    2.46022890   -2.04547453    0.03230977    0.01641003   -0.01751696    0.00334952
C    2.23689971    0.09166286    0.13576105   -0.01800495    0.03007234    0.01209745
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   15
   -420.51477404
H   -2.58096493    0.51261219    0.08133052   -0.01093348    0.00863519    0.00013459
O   -1.86014693    1.19706078    0.09186942    0.04079854   -0.02440704    0.00336765
O   -2.05669684   -1.28787266    0.03363737   -0.08037489   -0.03024409    0.01438601
C   -0.68118681    0.65707143   -0.05090509    0.01430354   -0.01115516    0.00342369
C   -0.79820565   -0.81964278   -0.07832360    0.05880000    0.02055788   -0.02784344
C    0.30729530    1.65052698   -0.17971815   -0.01595801    0.04540582   -0.00790319
C    0.36043623   -1.63112359   -0.02528422    0.00351260   -0.00973532    0.01748806
C    1.64501620    1.33041360    0.07198079   -0.01449950   -0.01235863    0.01774468
C    1.67044610   -1.20847988   -0.01536303   -0.03327448    0.00843478   -0.02089477
H   -0.01094337    2.62663542   -0.47967572    0.00414117   -0.01206926   -0.00731859
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H    2.42101508    2.10050135    0.05198719    0.01093014   -0.00797210   -0.00113663
H    2.47269358   -2.00869834    0.05035138    0.02282700   -0.01406810    0.00681767
C    2.23427291    0.08566524    0.14177538   -0.02086260    0.01711175    0.01690496
H    3.34796246    0.11289862    0.04229252    0.01756816    0.00253033   -0.01164576
   15
   -420.51407998
H   -2.56607249    0.50841933    0.05896781    0.00216768    0.01959877   -0.00054385
O   -1.86809769    1.18730621    0.08054489    0.02415992   -0.03482179    0.00386070
O   -2.03879002   -1.27457141    0.04853865   -0.07068697   -0.02196672    0.01743057
C   -0.68407395    0.65186142   -0.05072118    0.00810724   -0.01635588    0.00588208
C   -0.78874724   -0.82472496   -0.08745437    0.06984556    0.00640751   -0.03360520
C    0.31462774    1.64043140   -0.17193929   -0.00224948    0.01836069   -0.00048280
C    0.35047966   -1.62684185   -0.02216732   -0.00286757   -0.00423196    0.02065767
C    1.65235894    1.33008953    0.07638058   -0.00867410   -0.00794283    0.01509237
C    1.64724847   -1.20169511   -0.03036491   -0.05101786    0.00124514   -0.02669857
H   -0.00272710    2.65848592   -0.47731508   -0.00213111    0.01268919   -0.01425719
H    0.17250515   -2.65886586   -0.13844700    0.00446037    0.02610489   -0.00398290
H    2.40934361    2.11321704    0.07248701    0.00774697   -0.00784669   -0.00064605
H    2.46915398   -1.96218830    0.06353544    0.02193580   -0.00396969    0.00941978
C    2.23287452    0.07864484    0.14677318   -0.01712414    0.00174266    0.02053789
H    3.34193582    0.15532657    0.02706247    0.01637207    0.01097630   -0.01266145
   15
   -420.51222318
H   -2.55240534    0.49045533    0.03699184    0.00974217    0.02486629   -0.00116949
O   -1.87716407    1.17910754    0.06904536    0.01256200   -0.03884663    0.00433233
O   -2.01769933   -1.26027996    0.06265360   -0.05472450   -0.01194234    0.01925228
C   -0.68745534    0.64763980   -0.05089149    0.00269923   -0.02139300    0.00803996
C   -0.78347895   -0.83018842   -0.09456135    0.07401941   -0.00897446   -0.03764891
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C    0.34069031   -1.62237148   -0.02030166   -0.00809025    0.01405382    0.02411275
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   15
   -420.51052899
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   15
   -420.50923298
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   15
   -420.50865552
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   15
   -420.50793624
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   15
   -420.50635898
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   15
   -420.50586485
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   15
   -420.50708532
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   15
   -420.50906893
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   15
   -420.51059133
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   15
   -420.51011534
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C    2.25050602    0.08911160    0.12211369   -0.02890430    0.03717085    0.00503380
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   15
   -420.50742917
H   -2.45583079    0.21917860    0.01916423    0.00903762   -0.00049533   -0.00257963
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C   -0.72474411    0.70526796   -0.09928999    0.02623232    0.01993308    0.00877820
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C    0.34390323    1.51101444   -0.07058673    0.00808476   -0.07880430   -0.01214861
C    0.31460819   -1.66467009   -0.10149949   -0.01374105   -0.02548157   -0.00386143
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C    1.59481174   -1.15787349   -0.08577284    0.01140939    0.02010911    0.00411393
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H    2.30391616    2.22169286    0.28790124   -0.00498226   -0.00111056    0.00061049
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C    2.26290642    0.09196028    0.11520247   -0.00635368    0.04492889    0.00505741
H    3.27407181   -0.20027543    0.34689293   -0.01492009   -0.02185320    0.00163227
   15
   -420.50443885
H   -2.48816847    0.20759537    0.04085438   -0.00316823   -0.00770752    0.00041746
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O   -1.92642436   -1.18810451    0.20298092   -0.02549256   -0.00160494    0.01213930
C   -0.73172790    0.71372413   -0.10805066    0.02797143    0.02695456    0.00645042
C   -0.73013082   -0.73093755   -0.03807400    0.07281572    0.05391105   -0.02136149
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   15
   -420.50250769
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   15
   -420.50255045
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   15
   -420.50531671
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O   -1.95127072   -1.19790085    0.23349212   -0.05703796   -0.01484397    0.00976215
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C    1.73087942    1.32458366    0.10179324    0.00143139    0.01680145   -0.00647611
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   15
   -420.50960471
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O   -1.95480608   -1.19997658    0.24269101   -0.05799882   -0.01396579    0.00757004
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C   -0.73180788   -0.71230892    0.02014353    0.07801689    0.05765125    0.00124511
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C    1.73324723    1.32068685    0.10448508    0.00672380    0.02379493   -0.00527439
C    1.62983440   -1.22429022   -0.09199547   -0.07238989    0.00570857    0.02117748
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   15
   -420.51426378
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O   -1.95572813   -1.20142751    0.25154825   -0.05401439   -0.01071228    0.00490110
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C    1.73519835    1.31535414    0.10749407    0.01396024    0.03012663   -0.00372477
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   15
   -420.51798222
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O   -1.95422247   -1.20240126    0.26018501   -0.04384486   -0.00508141    0.00168902
C   -0.79286349    0.73123674   -0.16087539   -0.03558765    0.00377105   -0.02066223
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C    1.73630301    1.30821616    0.11073022    0.02161964    0.03315325   -0.00255172
C    1.66641650   -1.25404719   -0.10250252   -0.05071400   -0.02304286    0.01126245
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   15
   -420.51931782
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O   -1.95075495   -1.20315381    0.26874765   -0.02637158    0.00299070   -0.00219977
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C    1.73610567    1.29909951    0.11412575    0.02821583    0.03099913   -0.00236785
C    1.68975762   -1.26731327   -0.10895103   -0.02132607   -0.04203412    0.00445027
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   15
   -420.51856582
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C   -0.80128310   -0.74439841    0.07676449   -0.01738831   -0.00142785    0.03009038
C    0.31182780    1.61497493    0.04365169    0.00892940    0.00994213    0.00836218
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C    1.73421051    1.28813401    0.11767024    0.03312576    0.02376975   -0.00329982
C    1.71438812   -1.27806424   -0.11567606    0.00788088   -0.05537300   -0.00094421
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H    2.49243096   -1.97165603   -0.19957765   -0.01008989    0.03845247    0.00250407
C    2.34510326    0.01388799    0.06306175    0.02727026   -0.02729842   -0.01423790
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   15
   -420.51642894
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O   -1.94141690   -1.20555557    0.28638269    0.02696931    0.02475981   -0.01140051
C   -0.80678270    0.73136909   -0.17474307   -0.03566357   -0.01520468   -0.03400917
C   -0.82058648   -0.75487360    0.08748804   -0.05465179   -0.02159539    0.03696773
C    0.30613288    1.63231994    0.05649212   -0.00060943    0.04460485    0.01632876
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C    1.73031962    1.27574598    0.12141789    0.03647869    0.01356430   -0.00495079
C    1.73861680   -1.28555077   -0.12235683    0.02304067   -0.05244694   -0.00394888
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C    2.34898923    0.00330863    0.06181421    0.03042290   -0.03420550   -0.01016745
H    3.36583477    0.13696606    0.39953380   -0.01192622    0.01761521    0.00949674
   15
   -420.51243551
H   -2.56723199    0.31187232    0.07620259    0.00000490   -0.01107343    0.01013583
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O   -1.93793055   -1.20817966    0.29586717    0.05319938    0.03502858   -0.01525842
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C   -0.83660399   -0.76405151    0.09598440   -0.08790666   -0.03995002    0.04210440
C    0.30047128    1.64697482    0.06835231   -0.00934675    0.07713605    0.02279615
C    0.36918325   -1.55759498   -0.18112620   -0.01102026    0.02664594   -0.01363351
C    1.72422971    1.26253834    0.12546548    0.03836814    0.00318091   -0.00671494
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H    0.07493213    2.65979451    0.22430253    0.00833549   -0.02738704    0.00101879
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H    2.52343056   -2.05159502   -0.14962506    0.00668058    0.01647725    0.00516920
C    2.35107642   -0.00521779    0.06119128    0.02553266   -0.03792644   -0.00786304
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   15
   -420.50806114
H   -2.59521575    0.31560623    0.05870032   -0.00802799   -0.01884200    0.01235745
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O   -1.93681529   -1.21237617    0.30603544    0.06809590    0.04080959   -0.01685584
C   -0.80523858    0.73534525   -0.17420151   -0.01526586   -0.02050289   -0.03838333
C   -0.84737197   -0.77084051    0.10195041   -0.10787364   -0.05286311    0.04403734
C    0.29534693    1.65707270    0.07885566   -0.01266738    0.08877417    0.02513744
C    0.37251687   -1.54732382   -0.18156684   -0.01965766    0.01757193   -0.01119385
C    1.71582816    1.24912746    0.12991700    0.03851893   -0.00508538   -0.00805579
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H    0.08808019   -2.59176815   -0.32598586   -0.00419835    0.00138091   -0.00164768
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H    2.53661459   -2.11541950   -0.12989035    0.02065481   -0.00602139    0.00684657
C    2.35166029   -0.01146107    0.06105005    0.01272118   -0.03945800   -0.00671899
H    3.39399776    0.19352700    0.28435003   -0.00782481    0.02174267    0.00603246
   15
   -420.50603592
H   -2.61770621    0.33248754    0.03246768   -0.01133659   -0.01953823    0.01169250
O   -2.08349611    1.16936236   -0.26017590   -0.00864663    0.00881134   -0.00782933
O   -1.93872191   -1.21839738    0.31695544    0.06523958    0.03953269   -0.01502087
C   -0.80275445    0.73912763   -0.17050552   -0.00462876   -0.01933370   -0.03852853
C   -0.85171675   -0.77447405    0.10527467   -0.10801234   -0.05756754    0.04170359
C    0.29095840    1.66193867    0.08785488   -0.01017603    0.07430389    0.02436941
C    0.37703520   -1.53810895   -0.18132635   -0.02739846    0.00739522   -0.00948755
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   15
   -420.50634427
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   15
   -420.50748156
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   15
   -420.50754062
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   15
   -420.50584410
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   15
   -420.50315886
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   15
   -420.50026971
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   15
   -420.49781205
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O   -1.96930061   -1.28158180    0.39445730   -0.08600718   -0.03439851    0.03208889
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   15
   -420.49738247
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   15
   -420.49923406
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   15
   -420.50167015
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   15
   -420.50477697
H   -2.64405877    0.52945921   -0.35337427    0.01992517    0.01794895   -0.00306576
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   15
   -420.50942195
H   -2.62875586    0.53881124   -0.38006249    0.02532923    0.01869184   -0.00191306
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O   -1.90212038   -1.29433386    0.41546025   -0.05578416   -0.02575580    0.02903668
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C   -0.78883708   -0.70217401    0.09008302    0.03193791    0.03695962   -0.02718628
C    0.24341585    1.54008207    0.10096495    0.00644943   -0.03773834    0.00143184
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   15
   -420.51328144
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   15
   -420.51250587
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   15
   -420.50727715
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   15
   -420.50036351
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   15
   -420.49445265
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C   -0.81897055   -0.71488253    0.12626260   -0.09888093   -0.03259252    0.01636394
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   15
   -420.49051459
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O   -1.77902697   -1.29341620    0.40996164    0.14529113    0.07942823   -0.03283186
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   15
   -420.48972477
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   15
   -420.49340037
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O   -1.77473050   -1.31335791    0.41484810    0.10321793    0.04938842   -0.02362798
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   15
   -420.49875747
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   15
   -420.50150439
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C   -0.75368274   -0.70603286    0.15141162    0.05873857    0.03558391   -0.00710756
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   15
   -420.50191076
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O   -1.79883131   -1.35711774    0.42912202    0.00570670   -0.01400431   -0.00093867
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C    1.63683996    1.20823944    0.22876268   -0.00206580   -0.00623212    0.00063820
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C    2.30757453    0.05385691    0.01751097   -0.00430923    0.03249141   -0.00680396
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   15
   -420.50210280
H   -2.82139478    0.84120195   -0.58672454   -0.02703353    0.00082684   -0.01144827
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O   -1.80917477   -1.37157946    0.43437154   -0.01420453   -0.02612277    0.00327098
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C   -0.73385554   -0.70882235    0.16113510    0.10389095    0.05520460   -0.01139355
C    0.25230071    1.44184050    0.11456835   -0.00266979   -0.03291965   -0.00263882
C    0.33970638   -1.54844535   -0.16775867   -0.05481063    0.00516265   -0.00041642
C    1.63267632    1.22518993    0.22658910   -0.02432894    0.00384322   -0.00323150
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   15
   -420.50221400
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   15
   -420.50148856
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   15
   -420.50088231
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   15
   -420.50233205
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   15
   -420.50501251
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   15
   -420.50761544
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   15
   -420.50890760
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   15
   -420.50812520
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   15
   -420.50515979
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   15
   -420.50111676
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   15
   -420.49833642
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O   -1.88645483   -1.45276419    0.48601222    0.06624310    0.00596869   -0.01508843
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   15
   -420.49645298
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O   -1.90324264   -1.45910548    0.49323182    0.04281704   -0.01002060   -0.00682784
C   -0.74424795    0.69848946   -0.17432859    0.00381826   -0.01046631   -0.03421446
C   -0.90047873   -0.85813866    0.18806896   -0.07062083   -0.03792600    0.03275637
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C    1.71404326    1.29669732    0.24553082    0.06576921   -0.00759868   -0.00867781
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   15
   -420.49486587
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   15
   -420.49504093
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   15
   -420.49688848
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   15
   -420.49748866
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C   -0.71145974    0.71602482   -0.19543515    0.00976034    0.01776791   -0.03896943
C   -0.88101953   -0.86033080    0.14219453    0.02055913    0.00461736   -0.01088782
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C    1.68815698    1.29767394    0.27293970    0.01964133   -0.01591848   -0.00149628
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   15
   -420.49502135
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O   -1.99162842   -1.46967363    0.52476135   -0.07009201   -0.06761097    0.03704489
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C   -0.87642648   -0.86036037    0.13083520    0.02892937    0.00858639   -0.01849461
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C    1.67572306    1.29981350    0.28007698   -0.00814613   -0.01580264   -0.00105066
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   15
   -420.49126939
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C   -0.87355351   -0.86090068    0.12058622    0.03140282    0.01081469   -0.02446498
C    0.33243116    1.65535394    0.08926890    0.00663309    0.06358488    0.00665040
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C    1.66377519    1.30288408    0.28727209   -0.03464671   -0.01086369    0.00051447
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   15
   -420.48930913
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C   -0.87255663   -0.86208711    0.11180973    0.02926258    0.01148100   -0.02895521
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C    1.65465226   -1.14702143   -0.28859120    0.00082982   -0.00615713    0.00955873
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C    2.27033166    0.10056926    0.04284251    0.01338881    0.02388628    0.00515556
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   15
   -420.48793404
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O   -2.01469790   -1.44297355    0.52675720   -0.08597190   -0.06600438    0.04596929
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C    0.35416361    1.64361902    0.07417161    0.05140227    0.02932079    0.00316074
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C    1.64735125    1.31039515    0.30140052   -0.06831675    0.00939127    0.00634310
C    1.64367743   -1.14412051   -0.27835316   -0.02570255    0.00148679    0.02508623
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C    2.27410111    0.10907438    0.04181384    0.01575562    0.03077132    0.00512628
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   15
   -420.48592912
H   -2.63874949    0.66609648   -0.17817687   -0.02095323   -0.00136105    0.00550673
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C   -0.68594235    0.71213092   -0.17124310    0.02744377    0.03800062   -0.02501218
C   -0.87550063   -0.86646511    0.09967500    0.01613386    0.00809052   -0.03366190
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C    1.64488555    1.31363730    0.30798428   -0.07049625    0.01936754    0.00998820
C    1.63421332   -1.14128550   -0.26960232   -0.04360806    0.00447048    0.03478045
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   15
   -420.48687262
H   -2.64601521    0.64329071   -0.18112680   -0.02747070   -0.00664164    0.00677113
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C   -0.68474760    0.70492115   -0.16092493    0.03043603    0.03505676   -0.01995113
C   -0.87865352   -0.86945140    0.09659994    0.00632884    0.00398645   -0.03357409
C    0.36387238    1.62485275    0.05838864    0.07800225   -0.01335896   -0.00479807
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C    1.64664244    1.31573787    0.31396459   -0.06458429    0.02338325    0.01349927
C    1.62733245   -1.13869939   -0.26291958   -0.05068356    0.00313263    0.03741346
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   15
   -420.49356770
H   -2.63420176    0.62485807   -0.18878050   -0.02224431   -0.00508273    0.00520752
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O   -2.00386427   -1.38993782    0.51048214   -0.06481210   -0.04550339    0.03962867
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C   -0.88217690   -0.87267042    0.09554463   -0.00596266   -0.00179787   -0.03132534
C    0.36196811    1.61611452    0.05081285    0.07227025   -0.01495271   -0.00857327
C    0.37065849   -1.62804262   -0.16959322    0.07535387   -0.01246370   -0.02383915
C    1.65228533    1.31647617    0.31913197   -0.05445513    0.01727629    0.01633093
C    1.62345509   -1.13628322   -0.25846238   -0.04549080   -0.00211898    0.03265151
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C    2.27958574    0.12268891    0.03699405    0.01504106    0.03429309    0.00292371
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   15
   -420.50276047
H   -2.60699728    0.60967274   -0.20005282   -0.00672421    0.00323678    0.00149206
O   -1.87724851    1.23497443   -0.41307951    0.01364420   -0.01210892   -0.00172613
O   -1.99376936   -1.36762671    0.50125443   -0.04663613   -0.03341541    0.03270543
C   -0.68789516    0.68452165   -0.13699845    0.02953192    0.02133914   -0.00905563
C   -0.88532371   -0.87577139    0.09637078   -0.02140628   -0.00941645   -0.02647645
C    0.35574808    1.60821693    0.04375464    0.05559401   -0.00379659   -0.01215870
C    0.37003270   -1.63005914   -0.17292777    0.07632633   -0.01018834   -0.02426991
C    1.66120547    1.31621605    0.32331561   -0.04095269    0.00216737    0.01838992
C    1.62227073   -1.13372190   -0.25594760   -0.02891324   -0.01053059    0.02166859
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   15
   -420.50903935
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   15
   -420.51213736
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C   -0.69799695    0.65911933   -0.11087555    0.01965491    0.00003597    0.00158753
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   15
   -420.51464004
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O   -1.95569930   -1.29440577    0.46652093    0.04110021    0.01447713    0.00050611
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   15
   -420.51572991
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   15
   -420.51354136
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   15
   -420.50956864
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   15
   -420.50713825
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C   -0.81769691   -0.85133070    0.12064327   -0.01637794   -0.03848301   -0.00067172
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H   -0.00918565    2.61291985   -0.08637459   -0.00320127    0.03205065   -0.00520149
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C    2.28251315    0.09781334    0.02235494   -0.01764166   -0.02113842   -0.00787570
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   15
   -420.50721739
H   -2.54243299    0.41456248   -0.28439647    0.00689360   -0.00535404   -0.00189926
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O   -1.93435541   -1.18956649    0.40960171    0.04180535    0.03891937   -0.00486243
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   15
   -420.50662881
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   15
   -420.50295826
H   -2.55329970    0.42657867   -0.30482102    0.02024708    0.01803321   -0.00536422
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O   -1.94351620   -1.15987279    0.38926251   -0.00107373    0.03552553    0.00122172
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C   -0.75454729   -0.80661714    0.13122790    0.08504244    0.00219715   -0.01352068
C    0.28569159    1.47585946    0.03406652   -0.02633646   -0.03195064   -0.00704171
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   15
   -420.49861740
H   -2.57862593    0.41696062   -0.30977851    0.00914726    0.01197686   -0.00604757
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O   -1.94849675   -1.14747884    0.37907205   -0.01588893    0.03558687    0.00236798
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C    0.31529940   -1.61833794   -0.17723448   -0.06383684   -0.00130746    0.01658321
C    1.69090715    1.33396689    0.27397332   -0.00347340    0.01902185    0.00350372
C    1.62631072   -1.14941488   -0.26074492   -0.00327477   -0.02905912   -0.02699222
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C    2.30094878    0.09782525    0.02291618    0.02040187   -0.01110271   -0.00459086
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   15
   -420.49664752
H   -2.61015788    0.39908130   -0.31038012   -0.00823768   -0.00017032   -0.00669835
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O   -1.95277518   -1.13670462    0.36877847   -0.02570092    0.03698161    0.00237189
C   -0.76061137    0.61041269   -0.02144089   -0.02162850   -0.03307842    0.01868762
C   -0.73420792   -0.77603590    0.14183561    0.09527399    0.03496613   -0.00831440
C    0.29116520    1.46108531    0.04291883   -0.01239090   -0.01790980   -0.00196645
C    0.33171838   -1.61657475   -0.18194880   -0.03358746   -0.00396080    0.01132158
C    1.67928678    1.32921319    0.26180877   -0.02424053    0.02017584   -0.00193009
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H    2.33481645    2.18453707    0.62675463    0.02223975    0.01607135    0.01741892
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   15
   -420.49668233
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   15
   -420.49643770
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   15
   -420.49596159
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   15
   -420.49782786
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C    1.65225827    1.29339963    0.21449494   -0.02732098    0.04266902    0.00132654
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   15
   -420.50325867
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O   -1.95519262   -1.11081752    0.31716236   -0.00703737    0.05585701   -0.00884385
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   15
   -420.50956408
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C   -0.75699279    0.67126154   -0.01959849    0.01744194    0.00992883    0.00657952
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   15
   -420.51285299
H   -2.55820933    0.30150726   -0.17169379    0.00549966    0.00755840   -0.00427256
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O   -1.95133324   -1.11680023    0.29841638    0.02555343    0.06367316   -0.01318158
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   15
   -420.51334474
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O   -1.95075540   -1.12403775    0.28989493    0.03785920    0.06379038   -0.01375597
C   -0.76009250    0.69087488   -0.02353233    0.02510852    0.00729924    0.00553044
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C    1.74547462   -1.20091017   -0.18668362    0.04937632    0.01293657    0.00585385
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   15
   -420.51465086
H   -2.53801342    0.22845704   -0.09545383   -0.00667834   -0.01850652    0.00312013
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C   -0.80468361   -0.75095652    0.17296476   -0.07894629   -0.00945869    0.03464823
C    0.28230022    1.55007309    0.05100959   -0.02446856    0.00921715    0.00441699
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   15
   -420.51712923
H   -2.52252506    0.20767366   -0.05933328   -0.00508302   -0.02117871    0.00599469
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O   -1.95483247   -1.14694465    0.27468252    0.03565686    0.05032362   -0.01152843
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C   -0.80400971   -0.75300614    0.16853939   -0.07294807   -0.01192457    0.03302968
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C    1.65593493    1.21951892    0.15081823    0.02743519   -0.06478381   -0.00525043
C    1.77824249   -1.22122589   -0.16668622    0.06065860    0.03377888    0.02108071
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   15
   -420.51743952
H   -2.50360157    0.20181088   -0.02746888    0.00029518   -0.01830007    0.00786776
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O   -1.95938629   -1.16200704    0.26789294    0.02080226    0.03779372   -0.00933126
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C   -0.79898731   -0.75434865    0.16212614   -0.05441968   -0.01161997    0.02947176
C    0.27833900    1.59482479    0.04467365   -0.02542472    0.00221955    0.00041189
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C    2.30191377    0.03110170    0.05383907   -0.04205732   -0.00226310   -0.01629089
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   15
   -420.51451758
H   -2.48500702    0.20890923   -0.00119859    0.00759101   -0.01175060    0.00855609
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O   -1.96486667   -1.17877858    0.26152559    0.00130590    0.02377681   -0.00682945
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C   -0.79071534   -0.75499202    0.15393801   -0.02759036   -0.01056177    0.02442405
C    0.27869485    1.61678329    0.04140202   -0.02071202    0.00011952   -0.00239464
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C    1.65230131    1.21998422    0.13328112    0.04565385   -0.01247938    0.00225259
C    1.79664717   -1.24904538   -0.15164606    0.05434095    0.02586210    0.02981865
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H    2.43662255   -2.08327799   -0.57578675    0.01015217   -0.01927510   -0.02235890
C    2.31034096    0.01414495    0.06027372   -0.03153552   -0.01950666   -0.01517583
H    3.37086026    0.15440181    0.29385347   -0.00124256    0.00991563    0.01149361
   15
   -420.51115876
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   15
   -420.50910882
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   15
   -420.50617354
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O   -1.97823619   -1.23318147    0.24380169   -0.04829826   -0.01235901    0.00112276
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   15
   -420.50111528
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C   -0.75786889   -0.75096250    0.10991840    0.06256982   -0.01272974    0.00332376
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   15
   -420.49761901
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O   -1.97754934   -1.26759263    0.23193515   -0.06216315   -0.02799571    0.00620806
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   15
   -420.49898332
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C    2.36775644   -0.04756641    0.10893677    0.04128861   -0.03833841    0.01557371
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   15
   -420.50264655
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C    1.61049607    1.23295191    0.07132165   -0.07172050    0.00988795   -0.00806515
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C    2.37137800   -0.04962582    0.11577709    0.04284537   -0.03680742    0.02112471
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   15
   -420.50460305
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O   -1.95550377   -1.30930850    0.21180765   -0.06092769   -0.03904796    0.01172585
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C   -0.77439173   -0.73668301    0.06162256    0.03214954    0.00281984   -0.00756692
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C    1.76469252   -1.31728392   -0.13121150   -0.04417255   -0.03356372   -0.00277643
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   15
   -420.50459247
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O   -1.94250087   -1.31983121    0.20412986   -0.05403616   -0.03909703    0.01243762
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C   -0.78538771   -0.73280224    0.05031149    0.01369779    0.00662977   -0.01001751
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   15
   -420.50584159
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C   -0.80889700    0.82843354   -0.05857137    0.00480747    0.03821411   -0.00784839
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C    1.75926295   -1.30453999   -0.12571886   -0.04098042   -0.00519003   -0.01063082
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   15
   -420.50921746
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O   -1.90972519   -1.33567924    0.18709377   -0.02533708   -0.03221233    0.01142938
C   -0.80733301    0.83122102   -0.05832086    0.01232961    0.03919540   -0.00682103
C   -0.80861562   -0.72629578    0.02962554   -0.02819259    0.00671048   -0.01343328
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C    1.76042637   -1.29729419   -0.12214650   -0.01959415    0.00209551   -0.01624428
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C    2.35974499   -0.03664945    0.12772962    0.03894719   -0.02817989    0.03439619
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   15
   -420.51085323
H   -2.62296979    0.39313843   -0.09244812    0.01184461    0.02045204   -0.00310651
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O   -1.89125469   -1.34131816    0.17778130   -0.00358228   -0.02502432    0.00969384
C   -0.80651286    0.83164660   -0.05765749    0.01947049    0.03845284   -0.00586097
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C    0.27460882    1.70777972    0.01556152   -0.00556874    0.04294740    0.00166895
C    0.44645049   -1.56708124   -0.05048351    0.07482971   -0.01475504    0.02019886
C    1.66030315    1.21910922    0.03910846   -0.01748188    0.00333970   -0.01413350
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C    2.35059236   -0.02875088    0.12586109    0.03006253   -0.02274051    0.03481289
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   15
   -420.50836775
H   -2.63150478    0.39462891   -0.11439112    0.00662768    0.01010442   -0.00311783
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O   -1.87263077   -1.34582768    0.16803092    0.02053584   -0.01628861    0.00744908
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   15
   -420.50529887
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   15
   -420.50646560
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   15
   -420.51098254
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C   -0.81657899   -0.71238205   -0.00844420   -0.08294440   -0.00159322   -0.01064566
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   15
   -420.51480565
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C   -0.80350349   -0.70901158   -0.01396196   -0.06267796    0.00684199   -0.01105850
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C    0.39409398   -1.60474444   -0.03269014   -0.00620341   -0.02557021    0.02362886
C    1.72807225    1.21093501    0.02683132    0.07329305   -0.06224634   -0.00773116
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   15
   -420.51621512
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O   -1.80894937   -1.36268806    0.11569896    0.05803003   -0.00833564    0.00407635
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   15
   -420.51726053
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O   -1.80449288   -1.36543027    0.10472883    0.04664656   -0.01436966    0.00499668
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C   -0.76788572   -0.70410052   -0.02294152    0.00085919    0.02457098   -0.01244600
C    0.27484345    1.58504692   -0.00349854   -0.02121851   -0.02244487    0.01773916
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C    1.73474307    1.23281336    0.02604752    0.09917270   -0.00759041   -0.00214513
C    1.71780433   -1.28001132   -0.04531611    0.01580458    0.01782957   -0.02141560
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   15
   -420.51951516
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O   -1.80215287   -1.36752444    0.09353278    0.03519605   -0.01939028    0.00571042
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C    2.29040712    0.03087801    0.04539635   -0.02669622    0.02110942    0.00473037
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   15
   -420.51818673
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   15
   -420.50955223
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C    0.29751577    1.52958395   -0.02387504    0.01302573   -0.00183395    0.01038500
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   15
   -420.49939095
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O   -1.80315744   -1.36810338    0.05836068    0.01499418   -0.02233550    0.00529493
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C   -0.71176189   -0.71283403   -0.03208380    0.09883429    0.02609080   -0.00915529
C    0.30451572    1.51210266   -0.03220475    0.02928053   -0.00756660    0.00836524
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C    1.66105549   -1.29840373    0.02370541   -0.05822527   -0.06341636    0.00356992
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H    2.49349686   -1.97109956    0.14007668    0.00835629    0.02482892    0.00115915
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   15
   -420.49532170
H   -2.77611512    0.59665501   -0.13221303   -0.02088302   -0.01498865   -0.00774794
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O   -1.80515239   -1.36624735    0.04612972    0.01439709   -0.01900045    0.00425734
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C   -0.70991460   -0.71926580   -0.03277172    0.10229783    0.02208735   -0.00681689
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C    1.67931978    1.29422148    0.02480468   -0.04386488    0.03046554    0.00743775
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H    2.33685298    2.23527696    0.05622405    0.01971316    0.03017299    0.00070102
H    2.50624408   -1.95699206    0.14764823    0.01400680    0.02334972   -0.00017107
C    2.29889521    0.03398817   -0.01124924    0.01327784   -0.01846015   -0.02372713
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   15
   -420.49701240
H   -2.78048961    0.63121231   -0.10991414   -0.01613576   -0.00739156   -0.00565871
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   15
   -420.49982006
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   15
   -420.50226207
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   15
   -420.50750455
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   15
   -420.51494999
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   15
   -420.51667463
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   15
   -420.51135041
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   15
   -420.50718423
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   15
   -420.50962388
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   15
   -420.51465986
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   15
   -420.51733054
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   15
   -420.51857008
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O   -1.97421808   -1.36377833   -0.10280839   -0.02464571   -0.01301794   -0.00397006
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C   -0.83527117   -0.81052155   -0.04916006    0.00093261    0.02004187    0.00492198
C    0.22557638    1.54342426   -0.13716340   -0.04490783   -0.00347516   -0.02554922
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H    3.41611249    0.14104790   -0.03333686    0.00657584    0.00018809   -0.00447883
   15
   -420.52106389
H   -2.64311802    0.69222037    0.21600226    0.00557832    0.00089411    0.00269862
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O   -1.99860180   -1.36703294   -0.11464816   -0.04309102   -0.02055393   -0.00510789
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   15
   -420.52201198
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   15
   -420.51610208
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   15
   -420.50473138
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   15
   -420.49494765
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   15
   -420.49078417
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   15
   -420.49117330
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C    1.58789288    1.29516523   -0.14039765   -0.10200355    0.02180312   -0.00949212
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   15
   -420.49402606
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O   -2.09263495   -1.35719922   -0.18906119   -0.06299019   -0.01976308   -0.00799271
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C    1.59465642    1.30337633   -0.15242742   -0.08528911    0.04816868   -0.01201552
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   15
   -420.49878395
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   15
   -420.50649097
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   15
   -420.51311711
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   15
   -420.51280902
H   -2.61081863    0.52975441    0.27302631   -0.01519596   -0.01039036    0.00550073
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C    1.66098008    1.30541393   -0.19269177   -0.02421768   -0.01831574   -0.00076096
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H    2.42605304   -2.07093299    0.29259926    0.00385914   -0.02402622    0.00083820
C    2.35219952    0.12266246    0.05979137   -0.01632623    0.00377493    0.01552498
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   15
   -420.50751356
H   -2.59110881    0.52042213    0.25593027   -0.00227501   -0.00077943    0.00385727
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O   -2.08000555   -1.32359158   -0.23200725   -0.00253290    0.00792792   -0.00375451
C   -0.72868248    0.66206501   -0.01294451    0.03766085    0.02330831   -0.01395265
C   -0.93350317   -0.90600965   -0.09531581   -0.08293583   -0.05228969   -0.01432127
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   15
   -420.50353286
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   15
   -420.50389832
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C   -0.73172441    0.65622815   -0.00828289    0.02837921    0.01652968   -0.01408905
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   15
   -420.50630605
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C   -0.73598627    0.65169269   -0.00467368    0.02040632    0.01045041   -0.01397861
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   15
   -420.50752249
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O   -2.05928843   -1.29962569   -0.26245371   -0.02331671    0.00189619   -0.00756378
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C    0.32625510    1.53623197   -0.11117296   -0.00139035   -0.01712541    0.02386087
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   15
   -420.50970663
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   15
   -420.51523355
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O   -2.04420759   -1.28873317   -0.27590604   -0.04222529   -0.00668655   -0.01137706
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C    0.33968256    1.52118610   -0.12080988    0.01033938   -0.01493724    0.01940509
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   15
   -420.51672006
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C    1.64523887   -1.11503122    0.20563892   -0.03741774    0.02044494    0.00613442
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   15
   -420.50923561
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O   -2.02162734   -1.27670264   -0.28733271   -0.05043788   -0.01055310   -0.01273380
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C    0.35079862    1.50916487   -0.13501018    0.01414882    0.01209772    0.00907580
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C    1.77843569    1.36368416   -0.27726161    0.01210918    0.01665618   -0.00407777
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H   -0.04834104    2.48450458   -0.21530080    0.00194430   -0.02699561    0.00131989
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   15
   -420.49873933
H   -2.57229927    0.39492647    0.08086719    0.00897123    0.00653259   -0.00231720
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O   -2.00698117   -1.27000419   -0.29219065   -0.04878052   -0.01007932   -0.01218824
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C    1.77665215    1.36914966   -0.28448606   -0.00721968    0.02089044   -0.00351719
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   15
   -420.49335386
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O   -1.99014024   -1.26285474   -0.29649884   -0.04218220   -0.00788979   -0.01076656
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C    1.77525167    1.37332000   -0.29147916   -0.01572850    0.03160336   -0.00674661
C    1.57433007   -1.12807599    0.20933638   -0.12004500   -0.01510967   -0.00102421
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C    2.34663663    0.12010673    0.04118000    0.03875713   -0.02055291    0.01234390
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   15
   -420.49417771
H   -2.57918918    0.39437462    0.06617178    0.01198950    0.01491685    0.00015738
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O   -1.97140713   -1.25535459   -0.30032230   -0.02977717   -0.00375749   -0.00834123
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C    0.35974898    1.48802933   -0.15997845    0.03549590   -0.02892502   -0.00163579
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C    1.77474049    1.37555267   -0.29804917   -0.01182257    0.04775390   -0.01302399
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H    2.44134904   -1.78774462    0.36232689    0.02350871    0.01940490   -0.00786121
C    2.34585506    0.11519870    0.03832684    0.04633540   -0.02696766    0.01614000
H    3.42159634    0.12623672    0.21244701    0.00170792    0.01236623    0.00507578
   15
   -420.49625619
H   -2.59598365    0.37852984    0.05885490    0.00052855    0.00573961   -0.00296889
O   -2.00134644    1.12261586    0.32985719   -0.02361826   -0.01719444    0.01089964
O   -1.95134740   -1.24769251   -0.30377167   -0.01085963    0.00263176   -0.00471931
C   -0.76019945    0.63998515    0.05928683   -0.03056253   -0.03423618    0.00155537
C   -0.78929194   -0.77666707   -0.08031273    0.06530450    0.03607047    0.01215305
C    0.35912534    1.48261508   -0.16836775    0.03787404   -0.05065858   -0.00505129
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   15
   -420.49690207
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   15
   -420.50071424
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   15
   -420.50755898
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   15
   -420.50779665
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   15
   -420.50026596
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   15
   -420.49455260
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   15
   -420.49749928
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O   -1.86664788   -1.22240876   -0.33656067    0.09128072    0.03786875    0.01765995
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   15
   -420.50445297
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   15
   -420.50676382
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   15
   -420.50549317
H   -2.50831704    0.22319535    0.13854342   -0.00672989   -0.01642136   -0.00369481
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   15
   -420.51142763
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C    2.26869948    0.05522873   -0.04575088   -0.00958588    0.02268653   -0.00746791
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   15
   -420.51955349
H   -2.47953163    0.20709475    0.16863315   -0.00139597   -0.01587295   -0.00177371
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C   -0.73663214    0.73034496    0.12164725    0.01186382    0.00730713    0.02060640
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C    0.28683308    1.60230208   -0.21523787    0.01314464   -0.00347222   -0.01996679
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   15
   -420.51682631
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   15
   -420.50693988
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   15
   -420.50160522
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   15
   -420.50415688
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C   -0.71575133   -0.71849169   -0.09864201    0.06244968    0.02452678    0.01479192
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   15
   -420.50722238
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O   -1.90251430   -1.24709216   -0.39771529   -0.05203819   -0.02627343   -0.02120667
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   15
   -420.50237041
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O   -1.89425256   -1.24353611   -0.39878674   -0.03957222   -0.02035401   -0.01765831
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C   -0.73095863   -0.72143985   -0.11047524    0.03619326    0.01999935    0.00651999
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C    1.55947821    1.22022666   -0.26718280   -0.02468826    0.03206056    0.00459250
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   15
   -420.49369936
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   15
   -420.49528921
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C   -0.77338636    0.74857965    0.07903355   -0.00336458    0.00050898    0.00376586
C   -0.75445607   -0.72903042   -0.12376983   -0.01270797    0.00593014   -0.00733620
C    0.21493960    1.69370536   -0.16564462   -0.02282243    0.02586310    0.00415192
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C    1.55766887    1.20830288   -0.26254622    0.01917284    0.04485757   -0.00337693
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   15
   -420.50050150
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   15
   -420.49558208
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O   -1.85183489   -1.22461750   -0.39767649    0.04461516    0.02535957    0.00812572
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   15
   -420.48662653
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O   -1.84366759   -1.22131166   -0.39751565    0.06162308    0.03554950    0.01330552
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C    1.55190735    1.17816181   -0.25819854   -0.02213881   -0.04636971    0.04048035
C    1.82540864   -1.28301938    0.42150385    0.05450414    0.02843448    0.04417539
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C    2.22517763   -0.03660653   -0.07419156   -0.03670522   -0.03591486   -0.01492841
H    3.30838601    0.11626367   -0.21288515    0.00666239    0.00562819    0.00139689
   15
   -420.48645194
H   -2.63863173    0.47827048    0.28521458    0.01285385    0.02113638    0.00554102
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O   -1.83825127   -1.21959843   -0.39794600    0.06675997    0.04036060    0.01518818
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C   -0.77839624   -0.74294357   -0.14119639   -0.09788811   -0.03061541   -0.03171899
C    0.19637870    1.68911456   -0.13521682   -0.04441630    0.06474172    0.00248422
C    0.43469529   -1.57020669    0.20583679   -0.02680551   -0.01150420   -0.01377549
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   15
   -420.49594844
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   15
   -420.50473170
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   15
   -420.50401420
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   15
   -420.49986397
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O   -1.83990210   -1.22895460   -0.40495944   -0.01565692    0.01120690   -0.00455740
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   15
   -420.50569528
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   15
   -420.51071982
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   15
   -420.50322587
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   15
   -420.49401851
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O   -1.83389839   -1.24759725   -0.40946991   -0.06005274   -0.00897121   -0.01670789
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C   -0.66980289   -0.72690712   -0.11179798    0.08436225    0.02870372    0.00650398
C    0.23724565    1.58087540   -0.08925870    0.02819853    0.01832656   -0.00177613
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   15
   -420.49436989
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   15
   -420.50153795
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   15
   -420.50609727
H   -2.72977896    0.56367521    0.12716910   -0.01179458   -0.01666658   -0.00752790
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C   -0.67477578   -0.73735959   -0.09910559    0.08168397    0.02297472    0.00525975
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C    1.57567628    1.19851330   -0.35239327   -0.04101564    0.01433106   -0.01617581
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C    2.28945897    0.04323481   -0.01396134    0.03277153   -0.00109996    0.03723495
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   15
   -420.50137492
H   -2.72766237    0.57301404    0.11671211   -0.00895715   -0.01486008   -0.00724867
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O   -1.79038761   -1.26187857   -0.40338387   -0.00164577    0.00867241   -0.00226975
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C   -0.68675226   -0.74394199   -0.09561937    0.06453455    0.01299422    0.00127561
C    0.23711351    1.52320078   -0.06817984    0.00276238   -0.05695488   -0.00590744
C    0.41791534   -1.65247086    0.27899708   -0.00785106   -0.00684735    0.00468826
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   15
   -420.49476875
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   15
   -420.49871125
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   15
   -420.50171065
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   15
   -420.49541478
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   15
   -420.49120656
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   15
   -420.49837368
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   15
   -420.51256815
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   15
   -420.52253028
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   15
   -420.51960029
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   15
   -420.51181922
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   15
   -420.51328678
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   15
   -420.51256007
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O   -1.85819315   -1.41076030   -0.43347702   -0.04929393   -0.04895392   -0.03497118
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   15
   -420.50227969
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   15
   -420.49490909
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   15
   -420.49903054
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   15
   -420.50875717
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   15
   -420.51254881
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   15
   -420.50459471
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   15
   -420.49809461
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C   -0.91158331   -0.81602994    0.00325685   -0.03438816   -0.03320868    0.00802646
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   15
   -420.50224840
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   15
   -420.50019027
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   15
   -420.48937950
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   15
   -420.48430777
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   15
   -420.49131929
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   15
   -420.50274737
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   15
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   15
   -420.50306703
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   15
   -420.50320660
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   15
   -420.51221270
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   15
   -420.51239458
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   15
   -420.50402707
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   15
   -420.50068130
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   15
   -420.50715875
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   15
   -420.51750012
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   15
   -420.52217356
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   15
   -420.51699437
H   -2.64607611    0.55698519   -0.13049851   -0.00030504    0.00109405   -0.00369779
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C   -0.80020716   -0.85439691   -0.03272855    0.02039726   -0.00628232   -0.00241110
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C    1.67261851   -1.13211988    0.10305177    0.01635257   -0.00300805    0.00325286
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C    2.31327042    0.10084271   -0.19141489    0.00432048   -0.01615434   -0.00212376
H    3.38139293    0.06740449   -0.43507889    0.00505298    0.00220484   -0.00550585
   15
   -420.51475824
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   15
   -420.51828630
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   15
   -420.51223590
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   15
   -420.49918443
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   15
   -420.49214066
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   15
   -420.49559033
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   15
   -420.50405145
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   15
   -420.50786084
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   15
   -420.50512079
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   15
   -420.50963627
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   15
   -420.51935937
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   15
   -420.51831288
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C   -0.74159128   -0.79816222   -0.04775643    0.04554453    0.01582648   -0.00484549
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C    2.25627876    0.08414852   -0.16173139   -0.00900235    0.01147532   -0.02629573
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   15
   -420.50995461
H   -2.58331067    0.40134154   -0.02972459    0.00048304    0.00952969    0.00143676
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   15
   -420.50585915
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   15
   -420.50942647
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   15
   -420.51519094
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   15
   -420.51434179
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   15
   -420.50814484
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   15
   -420.51024104
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   15
   -420.51635000
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   15
   -420.51394751
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   15
   -420.50761414
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   15
   -420.50527629
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O   -1.89843183   -1.24257835    0.14770243    0.03604525    0.01061451    0.00561504
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   15
   -420.50847351
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O   -1.89018501   -1.24362147    0.16037009    0.03853903    0.01305770    0.00551391
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C   -0.76766370   -0.76332285   -0.00805425   -0.01003276   -0.04692250   -0.01433172
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C    2.27140445    0.02663670   -0.00548571    0.00354830    0.00229968    0.01767758
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   15
   -420.51361500
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   15
   -420.51429569
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   15
   -420.51214690
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   15
   -420.51638657
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   15
   -420.52047254
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   15
   -420.51611881
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   15
   -420.50924185
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   15
   -420.50702811
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   15
   -420.51045476
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O   -1.85912812   -1.27311055    0.25965678   -0.01216599   -0.00590516    0.00478332
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   15
   -420.51374004
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   15
   -420.50991223
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C    2.31461399    0.03023356    0.04218415    0.00139785   -0.01354155   -0.02080858
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   15
   -420.50375768
H   -2.65579561    0.31728290   -0.31677274   -0.01335301   -0.01946889   -0.00617111
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C   -0.82408473    0.75009674    0.03353189    0.00166974   -0.02147698    0.02315856
C   -0.75837388   -0.69120388    0.15591559   -0.00429435    0.06567791    0.01963696
C    0.28094926    1.58281795    0.03148950   -0.00997573   -0.00612541    0.01013587
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H    2.25968933   -2.01917097   -0.38205904   -0.04863642    0.03304680    0.00386736
C    2.31178514    0.03593205    0.04976313   -0.02603749   -0.00518261   -0.02336058
H    3.40283624    0.00904192    0.17256129    0.00477674   -0.00213581    0.00654253
   15
   -420.50521875
H   -2.66138513    0.33157962   -0.31716798   -0.01171333   -0.01721293   -0.00580534
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O   -1.84235878   -1.28597158    0.29696574    0.02760590    0.00317037   -0.00658426
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C   -0.76467195   -0.69563817    0.16899328   -0.01202362    0.05817206    0.02517477
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   15
   -420.50810468
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O   -1.83999540   -1.28912140    0.30667923    0.03870205    0.00847061   -0.00978713
C   -0.82897490    0.75299666    0.02891867    0.00231410   -0.00626156    0.01994675
C   -0.77024980   -0.70356310    0.18055195   -0.01835797    0.04518515    0.02999946
C    0.27916805    1.56388810    0.01383526   -0.02335859    0.01447612    0.00478931
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C    1.73115656   -1.20345840   -0.09194287    0.07505441    0.05498341    0.03009549
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   15
   -420.50619972
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C   -0.83163274    0.75527340    0.02474565    0.00100729    0.00426710    0.01736961
C   -0.77473048   -0.71420308    0.19030221   -0.02204726    0.02868272    0.03363256
C    0.28020578    1.55345598    0.00447897   -0.02485628    0.01117840    0.00459996
C    0.35615584   -1.61162309   -0.22358475   -0.05433548   -0.06761897   -0.02108521
C    1.73372444    1.24727452    0.13020237    0.04006236   -0.06856083   -0.00815989
C    1.73445774   -1.20303903   -0.11203444    0.05829642    0.06915014    0.02832741
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C    2.31679444    0.05211051    0.08148644   -0.04942433    0.02622014   -0.02548505
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   15
   -420.50394039
H   -2.65449903    0.41180740   -0.29450187    0.01516747    0.01977249   -0.00535572
O   -2.11312569    1.20057628   -0.33676442   -0.05390052   -0.01470472   -0.01472221
O   -1.84090112   -1.29680000    0.32755019    0.05223756    0.01746186   -0.01409076
C   -0.83434877    0.75729236    0.01952245   -0.00087951    0.01474084    0.01471839
C   -0.77789712   -0.72657195    0.19802654   -0.02187937    0.01100388    0.03566336
C    0.28272353    1.54242352   -0.00517242   -0.02176022   -0.00660389    0.00758559
C    0.34685900   -1.60012337   -0.22368009   -0.06746403   -0.05393885   -0.01234842
C    1.73161301    1.25218096    0.13029801    0.02817910   -0.06774812   -0.01420087
C    1.73424257   -1.20670716   -0.13380351    0.03931724    0.06508329    0.01963208
H    0.09337675    2.56384464   -0.25531715    0.00366623   -0.01654097   -0.00116379
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C    2.32450455    0.05511367    0.09518665   -0.02808174    0.02950044   -0.01998974
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   15
   -420.50541962
H   -2.66518220    0.42224668   -0.27937187    0.01120153    0.01482822   -0.00516308
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C   -0.83700816    0.75842716    0.01340775   -0.00345587    0.02377732    0.01233383
C   -0.77976333   -0.73961164    0.20360309   -0.01716274   -0.00564982    0.03588339
C    0.28653975    1.53181517   -0.01528672   -0.01517183   -0.02934804    0.01141647
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C    1.72778603    1.26109553    0.13124231    0.01879380   -0.04891503   -0.01818048
C    1.73164634   -1.21423538   -0.15673588    0.02096498    0.04580702    0.00612347
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C    2.33386017    0.05635954    0.11007669    0.00345532    0.02745905   -0.01078326
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   15
   -420.50932596
H   -2.68342116    0.42260412   -0.26059551   -0.00102172    0.00001905   -0.00380756
O   -2.10118898    1.21270822   -0.34256440   -0.03378416    0.00577409   -0.01481755
O   -1.85097611   -1.30752054    0.35090408    0.04575697    0.01842569   -0.01361948
C   -0.83945286    0.75813600    0.00654514   -0.00714283    0.03045098    0.01035735
C   -0.78061367   -0.75232309    0.20701815   -0.00808469   -0.01966663    0.03436796
C    0.29126440    1.52295298   -0.02608324   -0.00673267   -0.04667171    0.01369709
C    0.34080689   -1.56850699   -0.22225098   -0.07418909   -0.01603526    0.00740847
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C    1.72776964   -1.22448461   -0.18002735    0.00524369    0.01649708   -0.00966955
H    0.07615533    2.59314751   -0.26723797   -0.00258264    0.01325594   -0.00668624
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H    2.53839894   -2.05940084   -0.27701706    0.03573713   -0.02453527    0.00499828
C    2.34301610    0.05596196    0.12561450    0.03298773    0.02197189   -0.00080584
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   15
   -420.51101455
H   -2.70098524    0.42280938   -0.23911937   -0.01246905   -0.01289079   -0.00175560
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O   -1.85923573   -1.31413908    0.36352135    0.03464491    0.01528122   -0.01156365
C   -0.84145841    0.75601684   -0.00094590   -0.01223895    0.03442457    0.00878971
C   -0.78099026   -0.76386265    0.20836178    0.00399266   -0.03020369    0.03144103
C    0.29639314    1.51686269   -0.03769585    0.00235250   -0.05402234    0.01358669
C    0.34445870   -1.55064679   -0.22190377   -0.06785152    0.00115055    0.01496805
C    1.71688343    1.28553236    0.13639665    0.01968969    0.03237780   -0.01331397
C    1.72354280   -1.23569680   -0.20273411   -0.00382001   -0.01979977   -0.02543821
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C    2.35025749    0.05424080    0.14121983    0.04711019    0.01536898    0.00561086
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   15
   -420.50663194
H   -2.70996088    0.43181999   -0.21636827   -0.01753622   -0.01803029    0.00009851
O   -2.08313829    1.22388967   -0.34564804   -0.00983446    0.02431852   -0.01643097
O   -1.86905411   -1.32144459    0.37666005    0.02003833    0.01043337   -0.00862675
C   -0.84271765    0.75182885   -0.00897031   -0.01852341    0.03578226    0.00758561
C   -0.78161166   -0.77359451    0.20780848    0.01673629   -0.03699250    0.02760987
C    0.30138104    1.51398605   -0.05011884    0.01116784   -0.05069657    0.01124684
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C    1.70974697    1.29619844    0.14030242    0.02995661    0.08114831   -0.00329815
C    1.71949366   -1.24568937   -0.22391432   -0.00270689   -0.06020630   -0.03884618
H    0.06504137    2.59158612   -0.26169474   -0.00370048    0.01540039   -0.00545507
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H    2.27996047    2.08659571    0.45652806   -0.02529954   -0.04560302   -0.00689424
H    2.52426970   -1.96065731   -0.24864599    0.00782147    0.02081109    0.01608816
C    2.35473659    0.05159023    0.15650929    0.04447287    0.00873994    0.00753461
H    3.37723827   -0.00088322    0.49218540   -0.00893907   -0.00172347    0.00495866
   15
   -420.50143014
H   -2.70678476    0.45331044   -0.19363109   -0.01461862   -0.01473462    0.00096166
O   -2.07319520    1.22799389   -0.34609004   -0.00716270    0.02113459   -0.01577205
O   -1.87977630   -1.32922012    0.39018820    0.00398258    0.00467608   -0.00514682
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C   -0.78323558   -0.78110731    0.20558726    0.02757182   -0.04013875    0.02339696
C    0.30569890    1.51412520   -0.06321337    0.01887983   -0.03739558    0.00720542
C    0.36319689   -1.51586526   -0.22414031   -0.03558579    0.02318136    0.02041722
C    1.70088161    1.30211335    0.14444643    0.02437480    0.09971193   -0.00084949
C    1.71558648   -1.25206496   -0.24276588    0.00171616   -0.09512734   -0.04820289
H    0.06343099    2.57374753   -0.25261953   -0.00164013    0.00446053   -0.00252351
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H    2.50220969   -1.92436877   -0.24985240   -0.01611999    0.04615768    0.01913129
C    2.35656008    0.04840898    0.17135074    0.03482713    0.00258821    0.00787218
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   15
   -420.50270167
H   -2.69353636    0.48496208   -0.17148224   -0.00417329   -0.00402510    0.00008987
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O   -1.89068135   -1.33720705    0.40394888   -0.01152298   -0.00130962   -0.00140527
C   -0.84148148    0.73706337   -0.02635130   -0.03047448    0.03117337    0.00638394
C   -0.78650737   -0.78620910    0.20195089    0.03454232   -0.03997448    0.01919689
C    0.30888541    1.51649069   -0.07673943    0.02449323   -0.01728804    0.00232658
C    0.37633392   -1.50028310   -0.22705706   -0.01016550    0.02933751    0.01895312
C    1.69066552    1.30221323    0.14872255   -0.00382147    0.07787856   -0.01314386
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H    2.26255910    2.09981458    0.51994517   -0.01335959   -0.02910688    0.00012928
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C    2.35626888    0.04506555    0.18571017    0.02655950   -0.00244696    0.00928545
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   15
   -420.50596867
H   -2.67751602    0.51930454   -0.14929273    0.00986404    0.00979522   -0.00243291
O   -2.05208060    1.23388261   -0.34495887   -0.01912383   -0.00351470   -0.00931851
O   -1.90107165   -1.34513528    0.41777332   -0.02488835   -0.00710735    0.00236887
C   -0.83827867    0.72676447   -0.03563610   -0.03312843    0.02527715    0.00655088
C   -0.79184395   -0.78890771    0.19715249    0.03668283   -0.03690629    0.01520727
C    0.31060456    1.51990759   -0.09040804    0.02738087    0.00154128   -0.00218887
C    0.39006709   -1.48647111   -0.23111262    0.01883840    0.03462840    0.01597946
C    1.68067632    1.29765285    0.15380413   -0.03200600    0.04498250   -0.02794024
C    1.70855353   -1.24724413   -0.27146994   -0.04661900   -0.08980061   -0.05449780
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H    2.49363311   -1.95153677   -0.29401765   -0.00409498    0.03195078    0.01914933
C    2.35434788    0.04186262    0.19949798    0.02289584   -0.00599197    0.01266524
H    3.43937265    0.04015327    0.53987199    0.02759126    0.00297391    0.01363011
   15
   -420.50713596
H   -2.66825314    0.54697224   -0.12539068    0.01812343    0.01727096   -0.00422826
O   -2.04041002    1.23673264   -0.34366841   -0.02222333   -0.01108465   -0.00624598
O   -1.91034464   -1.35274249    0.43149084   -0.03508233   -0.01251178    0.00599708
C   -0.83309234    0.71494748   -0.04531977   -0.03182318    0.01724976    0.00723854
C   -0.79937428   -0.78938693    0.19143306    0.03388216   -0.03128283    0.01149758
C    0.31067933    1.52328748   -0.10395076    0.02793757    0.00962097   -0.00548392
C    0.40266915   -1.47475213   -0.23613092    0.04611267    0.03960218    0.01220913
C    1.67254516    1.29032550    0.16053663   -0.04542533    0.02038571   -0.03547730
C    1.70824699   -1.23631114   -0.28094424   -0.08003225   -0.06034316   -0.05103530
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H    2.27966861    2.18909975    0.57959886    0.02100555    0.02707318    0.02302156
H    2.49933243   -2.00544462   -0.33691832    0.01852293    0.00281328    0.01506843
C    2.35101488    0.03901388    0.21250962    0.02471829   -0.00790421    0.01803164
H    3.42754471    0.05121089    0.53737862    0.02190163    0.00436524    0.01070345
   15
   -420.50842796
H   -2.67120867    0.56302587   -0.09868691    0.01315239    0.01172263   -0.00216870
O   -2.02777850    1.24003420   -0.34207881   -0.01341708   -0.00573698   -0.00712712
O   -1.91803944   -1.35978399    0.44493756   -0.04166909   -0.01737926    0.00928151
C   -0.82600273    0.70209573   -0.05544283   -0.02630137    0.00750205    0.00824534
C   -0.80893195   -0.78798552    0.18501662    0.02675141   -0.02339271    0.00812112
C    0.30907636    1.52614745   -0.11716550    0.02607043    0.00585333   -0.00805613
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   15
   -420.51112337
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   15
   -420.51420260
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   15
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   15
   -420.50980839
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   15
   -420.50161419
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   15
   -420.49509077
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   15
   -420.49123115
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   15
   -420.49101577
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   15
   -420.49276216
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   15
   -420.49546164
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   15
   -420.49935686
H   -2.66828519    0.68616377    0.03244989   -0.01947491   -0.00637629    0.01097007
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C    1.74761013   -1.09922912   -0.28125277    0.03352301    0.04696242    0.02801539
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C    2.29577458    0.03761738    0.27010484    0.02624549   -0.00979704    0.01356176
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   15
   -420.50132046
H   -2.64970939    0.68661221    0.02404136   -0.01027521   -0.00128634    0.00743741
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O   -1.88917700   -1.35924919    0.55750463    0.00340770   -0.01278891    0.01145729
C   -0.76368907    0.63999830   -0.21001490    0.01637658    0.01182190   -0.01664055
C   -0.87089368   -0.80981082    0.10320443   -0.03576729   -0.00326221   -0.00528006
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   15
   -420.49765249
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   15
   -420.49280747
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   15
   -420.49091758
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   15
   -420.49127147
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O   -1.86501614   -1.33154597    0.57555303   -0.00878973   -0.00686159    0.01670916
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   15
   -420.49441575
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C   -0.81301926   -0.84198124    0.08133590    0.02635610   -0.03616233   -0.01466337
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   15
   -420.49967416
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O   -1.85123107   -1.31560805    0.58032826   -0.01163600   -0.00390307    0.01738337
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   15
   -420.50514540
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C   -0.79615515   -0.84156433    0.07810679    0.03034878   -0.03139610   -0.01215467
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   15
   -420.50915309
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C   -0.79044874   -0.83841195    0.07764276    0.02667306   -0.02532708   -0.00901294
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   15
   -420.50765331
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   15
   -420.49918904
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O   -1.81847902   -1.28253013    0.58131657    0.00505569    0.00676506    0.00555313
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C   -0.78344324   -0.82799152    0.07807944    0.01185410   -0.00939973    0.00022968
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   15
   -420.49105726
H   -2.64831783    0.63222152   -0.15772524    0.01926469    0.01297307   -0.00388904
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O   -1.81018858   -1.27469122    0.58049090    0.01279142    0.00990047    0.00094217
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C   -0.78125991   -0.82167821    0.07842516    0.00311019   -0.00126779    0.00556152
C    0.28722922    1.45788287   -0.18230084   -0.03539431   -0.01199524   -0.01472393
C    0.37906680   -1.64867526   -0.31726567    0.00594541   -0.07500493   -0.00619399
C    1.65822481    1.27472569    0.34848860    0.09632022    0.00627713    0.04628824
C    1.66313937   -1.08763747   -0.27340164    0.02857181    0.08933874    0.01019509
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H    1.98190700    2.17919344    0.70521706   -0.03616823   -0.03578253   -0.01838903
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H    3.31311262   -0.01475212    0.48604337    0.01787710   -0.00233883    0.00023262
   15
   -420.48701732
H   -2.68637031    0.62775415   -0.17372669    0.00180778    0.00099216   -0.00178234
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O   -1.80247716   -1.26730100    0.57962127    0.02013396    0.01288464   -0.00334436
C   -0.77226758    0.61518115   -0.25630262    0.00976813   -0.03089640   -0.01709996
C   -0.77926978   -0.81528323    0.07843597   -0.00461671    0.00587271    0.01059223
C    0.28753673    1.46226404   -0.18034892   -0.03583966   -0.00103906   -0.01680763
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C    1.66323676    1.28376680    0.34628004    0.08734171   -0.01407310    0.03501740
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   15
   -420.48521790
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   15
   -420.48735658
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   15
   -420.49389255
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   15
   -420.50143935
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   15
   -420.50652331
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C    1.63332217    1.34427712    0.31817977   -0.01148598    0.05253749    0.00220086
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   15
   -420.50705566
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C   -0.75727794   -0.79154188    0.06032846    0.00829055    0.00898773    0.00868602
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   15
   -420.50351831
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O   -1.77931070   -1.23573063    0.58147198    0.00726463    0.01401189    0.00297596
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C    0.31095304    1.52433119   -0.14388698    0.05235907   -0.03189493   -0.00427384
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   15
   -420.49970679
H   -2.76186548    0.58620809   -0.25484545   -0.01516286    0.00276416   -0.00398712
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O   -1.77926163   -1.23415887    0.58232890    0.00161363    0.01232873    0.00715214
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   15
   -420.49804279
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O   -1.77929068   -1.23314684    0.58286270   -0.00275761    0.01073258    0.01094573
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C    2.23864559    0.04793990    0.22036554    0.01612923   -0.00081628   -0.00545311
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   15
   -420.49847848
H   -2.73498665    0.51026596   -0.24947452   -0.02471540   -0.01293477   -0.00355969
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O   -1.77920007   -1.23262208    0.58290220   -0.00568670    0.00923767    0.01411376
C   -0.78079836    0.69745707   -0.18524676   -0.00781731    0.00715788    0.00494572
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C    1.66663354   -1.31304836   -0.23512978   -0.04250673   -0.10799083   -0.02441147
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C    2.23751447    0.04373208    0.21879527    0.02173984    0.00132921   -0.00362561
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   15
   -420.50137888
H   -2.69554092    0.48413399   -0.24288455   -0.01389660   -0.00798675   -0.00388901
O   -2.03103768    1.22404158   -0.30542844    0.00045936    0.00954027    0.00122383
O   -1.77885671   -1.23251702    0.58230426   -0.00720477    0.00788031    0.01650032
C   -0.78169860    0.70762992   -0.17772043   -0.00897261    0.00703556    0.00646792
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C    0.28006805    1.59768689   -0.11397363    0.02191385    0.00392003   -0.00971100
C    0.36598358   -1.60215975   -0.38816843   -0.01259166    0.03482831   -0.00875708
C    1.60647294    1.31124803    0.27012136   -0.05028178    0.03497661   -0.01138682
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H    2.33323914    2.06939101    0.73100480    0.03111891    0.00980846    0.01932765
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C    2.23504822    0.03943502    0.21742824    0.03128997    0.00524623    0.00133911
H    3.24472233    0.00093743    0.65427591    0.00532905    0.00147986    0.00914223
   15
   -420.50675596
H   -2.64647219    0.46333739   -0.23346062    0.00309954    0.00363161   -0.00477168
O   -2.02984738    1.21447805   -0.30935014   -0.00606046   -0.00286482    0.00150584
O   -1.77819152   -1.23277004    0.58096078   -0.00735651    0.00666230    0.01805734
C   -0.78205703    0.71738564   -0.17058352   -0.00993258    0.00525098    0.00764550
C   -0.75131920   -0.78163557    0.02746502    0.01508180   -0.01677096   -0.01518139
C    0.26754369    1.61561056   -0.10532860    0.00849947   -0.00221238   -0.01225959
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C    1.61090301    1.29029827    0.26208028   -0.03250104    0.00978923   -0.00848787
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   15
   -420.51238653
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   15
   -420.51555703
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C   -0.78096388    0.73610844   -0.15774275   -0.00919885    0.00024807    0.00900102
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   15
   -420.51357421
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O   -1.77449472   -1.23515747    0.57190795   -0.00049714    0.00356713    0.01903785
C   -0.77956438    0.74536911   -0.15212078   -0.00608248   -0.00118920    0.00917774
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C    1.62860657    1.22857939    0.23907964    0.06459694   -0.03434490    0.01730749
C    1.72395484   -1.30213969   -0.18551965   -0.00374667   -0.01269323    0.01498304
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   15
   -420.50654566
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O   -1.77303762   -1.23633870    0.56716503    0.00263649    0.00213624    0.01892867
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C   -0.76357221   -0.75938614    0.01968309   -0.02985866   -0.01375859   -0.01277371
C    0.22218160    1.68621912   -0.06266093   -0.05246723    0.04154418   -0.01191068
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C    1.62952945    1.21136643    0.23008472    0.08784864   -0.04093094    0.02159831
C    1.73725957   -1.28954204   -0.17562289    0.01622591    0.02172699    0.02463563
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H    2.51666260   -2.12946005   -0.40708219    0.02856812   -0.03164698   -0.01529045
C    2.19511348    0.00426710    0.20544345   -0.04935193    0.02656823   -0.01263780
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   15
   -420.49980172
H   -2.52899781    0.30563374   -0.13689269    0.00227606   -0.02587007    0.00246241
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O   -1.77169558   -1.23761483    0.56156264    0.00457169    0.00015798    0.01897329
C   -0.77596867    0.76408897   -0.14252141    0.00393512    0.00024330    0.00825286
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C    0.21664658    1.70029100   -0.04999952   -0.06052808    0.06416073   -0.00925224
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C    1.62524913    1.19667793    0.21981800    0.08988937   -0.05637584    0.01932307
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   15
   -420.49680099
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O   -1.77055310   -1.23889595    0.55509830    0.00443706   -0.00240151    0.01929711
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C    1.61562789    1.18542053    0.20839953    0.07315877   -0.07563050    0.01363170
C    1.75933827   -1.26983107   -0.16065707    0.06876790    0.06436910    0.03402213
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   15
   -420.49620244
H   -2.52451169    0.30951014   -0.09668221    0.00517980   -0.01506305    0.00291458
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C   -0.77328293    0.78260485   -0.13488154    0.01231730    0.00874791    0.00555735
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C    0.21661720    1.71614834   -0.02317480   -0.05904588    0.07393576   -0.00332060
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C    1.76496699   -1.26523746   -0.15614506    0.09451895    0.06136528    0.03178110
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   15
   -420.49607045
H   -2.52691612    0.33055010   -0.07980030    0.01119845    0.00014510    0.00001502
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O   -1.76873962   -1.24099104    0.53951246   -0.00200048   -0.00856399    0.02067368
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C   -0.75052937   -0.72515352    0.02478945   -0.03543606    0.00477176   -0.01450140
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C    1.58482325    1.17700269    0.18344787    0.01629004   -0.07861225    0.00209202
C    1.76492735   -1.26428633   -0.15353779    0.11035831    0.04560449    0.02622482
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   15
   -420.49836852
H   -2.53729034    0.35157853   -0.06289232    0.01546620    0.01365426   -0.00336806
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O   -1.76778328   -1.24152803    0.53033007   -0.00655135   -0.01150045    0.02132565
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C    1.75832653   -1.26613299   -0.15251798    0.10402188    0.03713095    0.02068565
H    0.11628484    2.81308179   -0.00054848    0.00542183    0.01506160    0.00165911
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H    2.25130703   -2.15899621   -0.28777113   -0.04835631    0.02901042    0.00040838
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   15
   -420.50475691
H   -2.55832068    0.36345485   -0.04375639    0.01195871    0.01630306   -0.00357958
O   -2.04031617    1.12116897   -0.34445769    0.00557292   -0.04162306    0.00152948
O   -1.76653185   -1.24154575    0.52018172   -0.01053576   -0.01377111    0.02153729
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C   -0.73076717   -0.70844092    0.03234302   -0.01376842    0.01274488   -0.01717807
C    0.24066268    1.71118396    0.01786854   -0.01115239    0.01391146    0.01039138
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C    1.55018287    1.18655474    0.15797903   -0.04556655   -0.03073315   -0.00864339
C    1.74556713   -1.27031106   -0.15274680    0.07206604    0.04411967    0.01450310
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H    2.26559194   -2.18332451   -0.25379178   -0.03404406    0.00988097   -0.00013111
C    2.21785054   -0.05544436    0.20888383    0.00945314   -0.05511312    0.00519541
H    3.25032293   -0.00689417    0.37764746   -0.03037832   -0.00690321   -0.00588377
   15
   -420.50967618
H   -2.58745102    0.36426903   -0.02231805    0.00032504    0.00807609    0.00060872
O   -2.04571238    1.11476968   -0.34724095    0.00964825   -0.03611845   -0.00238567
O   -1.76480720   -1.24094253    0.50905898   -0.01324378   -0.01501281    0.02100231
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C   -0.71928703   -0.70112967    0.03763934   -0.00027779    0.01398734   -0.01767615
C    0.25161130    1.70621318    0.03070645    0.01407789    0.00306578    0.01578242
C    0.40267806   -1.55434375   -0.34210140    0.03659501   -0.00193381   -0.00518509
C    1.53605431    1.19493019    0.14586610   -0.07007865    0.00330602   -0.01324688
C    1.72852195   -1.27714761   -0.15383300    0.02558603    0.04964692    0.00460784
H    0.12585904    2.81866544   -0.00042287    0.00326281    0.02320331   -0.00000660
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H    2.30392165   -2.21439293   -0.21981422   -0.01173641   -0.01594718    0.00071266
C    2.22863076   -0.05685658    0.21108308    0.01973147   -0.04908097    0.01172678
H    3.27984777   -0.01843045    0.33490548   -0.01976510   -0.00801548   -0.00513332
   15
   -420.50703257
H   -2.61674352    0.35937887   -0.00140076   -0.01259561   -0.00223904    0.00621973
O   -2.05155207    1.10999739   -0.34990969    0.01533571   -0.02727103   -0.00798132
O   -1.76248792   -1.23966267    0.49698701   -0.01429329   -0.01504827    0.01948077
C   -0.78118354    0.81249636   -0.11948830    0.01304568    0.03499610   -0.00510742
C   -0.70779410   -0.69465457    0.04400070    0.01399851    0.01327800   -0.01737816
C    0.26170922    1.70101042    0.04259396    0.03909651    0.00149717    0.02036378
C    0.39893856   -1.54639222   -0.32960418    0.03572239    0.00562359    0.00224193
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   15
   -420.49878650
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   15
   -420.49229218
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O   -1.75596471   -1.23512352    0.47032258   -0.01038254   -0.01139792    0.01309945
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   15
   -420.49148894
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   15
   -420.49359981
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C    1.54646587    1.20670055    0.10094127   -0.11336921    0.02403754   -0.02411469
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   15
   -420.49469274
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   15
   -420.49731266
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O   -1.74038418   -1.22162656    0.41191355    0.03020213    0.01046771   -0.00960325
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C   -0.68015493   -0.66645658    0.09921289    0.03882212   -0.00154726    0.00678451
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   15
   -420.50380291
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   15
   -420.50802196
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C   -0.69118860   -0.65763757    0.11791440    0.00451615    0.00492974    0.02044150
C    0.23262652    1.63437231    0.08567081   -0.02707175   -0.00555785    0.02118072
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   15
   -420.50561812
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O   -1.74139964   -1.21556770    0.37152655    0.06862327    0.02923755   -0.02147162
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C   -0.69767238   -0.65355992    0.12561804   -0.01151116    0.01099815    0.02547810
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   15
   -420.49988134
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C   -0.82036938    0.76726227   -0.06710627    0.00792084   -0.02080064    0.00505870
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   15
   -420.49666146
H   -2.58772121    0.27903750   -0.05104121    0.00085701   -0.01502492    0.00827013
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O   -1.75638449   -1.21755954    0.34911738    0.06570845    0.02902638   -0.02015708
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   15
   -420.49781993
H   -2.58674433    0.29331171   -0.08488452    0.00802560   -0.00335249    0.00315003
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O   -1.76843009   -1.22055505    0.33931177    0.05410401    0.02439239   -0.01727594
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C   -0.71121541   -0.64722868    0.13897374   -0.01838587    0.03498038    0.02814768
C    0.21744863    1.59395988    0.07511275   -0.06896735    0.01172344    0.00886254
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   15
   -420.49951687
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   15
   -420.49864972
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   15
   -420.49959017
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C   -0.71675738   -0.65917004    0.13747168    0.01680426    0.04319120    0.02042219
C    0.24573147    1.56094633    0.06078280   -0.04076621   -0.04526278    0.00349351
C    0.40289386   -1.57457361   -0.22579104    0.03469055   -0.03823243   -0.03365705
C    1.73175839    1.25903338    0.10487322    0.05403848   -0.00294596   -0.00017808
C    1.72908768   -1.28179379   -0.03353226    0.06294019   -0.00228966    0.02700139
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   15
   -420.50548345
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O   -1.83406566   -1.24081083    0.30621273   -0.00467163    0.00253137   -0.00236729
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C   -0.71962932   -0.66832690    0.13427091    0.02791666    0.03921114    0.01755490
C    0.26113800    1.55392946    0.05545075   -0.02165349   -0.05187948    0.00234442
C    0.40964229   -1.57377311   -0.21504216    0.04433396   -0.03801558   -0.03517226
C    1.72165686    1.27538504    0.10839705    0.03141349    0.02046655    0.00268317
C    1.72594529   -1.28104385   -0.02980304    0.03339259    0.00444372    0.03434108
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C    2.30111820   -0.00358854    0.05704346    0.01032627   -0.03774106   -0.01489192
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   15
   -420.51065890
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O   -1.85149702   -1.24670004    0.29862212   -0.01400004   -0.00002037    0.00053473
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C   -0.72417918   -0.67984339    0.13000762    0.03695450    0.03288132    0.01485083
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C    1.72083274   -1.28057641   -0.02815822   -0.00625641    0.01449263    0.04334178
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H    2.36102860   -2.10077448   -0.38836718   -0.00620549   -0.00511789   -0.01558009
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   15
   -420.51143290
H   -2.69352900    0.32111321   -0.27233988   -0.02145176   -0.01498304   -0.00627900
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C   -0.73095122   -0.69334169    0.12484567    0.04343080    0.02516534    0.01224071
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C    0.41476279   -1.56563692   -0.18725006    0.05339825   -0.02213909   -0.03124330
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C    2.32795399    0.01232138    0.03434935    0.00631182   -0.01939489   -0.02131948
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   15
   -420.51037463
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O   -1.88420893   -1.25843237    0.28327583   -0.02316846   -0.00142510    0.00424623
C   -0.85304321    0.75345304   -0.03044806   -0.04177663    0.02120666    0.00746757
C   -0.74033463   -0.70835836    0.11894363    0.04684113    0.01670799    0.00959431
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C    2.34065594    0.02236603    0.02483559    0.00629462   -0.00666852   -0.02313070
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   15
   -420.51130346
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O   -1.89907415   -1.26421060    0.27535153   -0.02281615   -0.00056895    0.00512643
C   -0.85063333    0.74884816   -0.02847093   -0.04594801    0.02016341    0.00834511
C   -0.75253256   -0.72438353    0.11246187    0.04654911    0.00784011    0.00686785
C    0.32234298    1.55261789    0.03300353    0.06414805   -0.00726551    0.00118157
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C    1.67499485    1.31458208    0.11956251   -0.05436965    0.08654287    0.00897798
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   15
   -420.51510176
H   -2.65151449    0.38548231   -0.31672036    0.00582754    0.01590318   -0.00705042
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O   -1.91291719   -1.26996595    0.26719630   -0.01900265    0.00115403    0.00553965
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C   -0.76752307   -0.74088252    0.10556417    0.04171115   -0.00109977    0.00425415
C    0.33104416    1.55556347    0.02719809    0.07822427   -0.00405282    0.00076872
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C    1.66821223    1.31278413    0.12114492   -0.07494366    0.07858700    0.00883399
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C    2.36442064    0.04302012    0.00997925    0.02563002    0.01270734   -0.02135730
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   15
   -420.51926985
H   -2.63408893    0.39681866   -0.32093213    0.01240990    0.02097225   -0.00626059
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O   -1.92591045   -1.27577629    0.25879084   -0.01190453    0.00357546    0.00564497
C   -0.83756613    0.73622846   -0.02610709   -0.04033875    0.01110863    0.01097402
C   -0.78500931   -0.75731728    0.09840709    0.03151881   -0.00957427    0.00205633
C    0.33505880    1.55880008    0.02134828    0.08340513   -0.00961081   -0.00006279
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C    1.66591066    1.30627563    0.12219513   -0.08536036    0.06220211    0.00828323
C    1.72787204   -1.28105864   -0.05844747   -0.02304463   -0.07079167    0.01493483
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H    2.44899220   -2.05612571   -0.25361484    0.00089462    0.01258688   -0.00393058
C    2.37432396    0.05246541    0.00452999    0.04292377    0.01780399   -0.01789869
H    3.46170069   -0.05190431    0.11032511    0.00576255   -0.01541892    0.00374433
   15
   -420.52142956
H   -2.62495927    0.39392476   -0.32056640    0.00877175    0.01220648   -0.00651331
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O   -1.93837320   -1.28175029    0.25012994   -0.00227363    0.00635263    0.00556307
C   -0.82724899    0.72875403   -0.02587826   -0.03039311    0.00449224    0.01249410
C   -0.80437384   -0.77317870    0.09112212    0.01582474   -0.01691563    0.00052067
C    0.33409158    1.56261899    0.01550431    0.07633741   -0.01547954   -0.00130050
C    0.38293269   -1.54280799   -0.09016423   -0.03000448    0.04829865   -0.00661712
C    1.66869035    1.29602933    0.12274410   -0.07982570    0.04092188    0.00775617
C    1.73732679   -1.27445891   -0.06976468    0.01079061   -0.09639559    0.00359321
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H    2.43616683   -2.03017390   -0.19815088   -0.01905524    0.03560020    0.00257419
C    2.38163388    0.06084409    0.00015810    0.05932759    0.02086564   -0.01348614
H    3.44445384   -0.01116457    0.09213074   -0.01307485   -0.01125563    0.00153400
   15
   -420.52425165
H   -2.62184116    0.38265573   -0.31546181    0.00004043   -0.00346712   -0.00749134
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O   -1.95073660   -1.28801184    0.24121706    0.00833224    0.00894850    0.00536468
C   -0.81511072    0.72100775   -0.02640418   -0.01707079   -0.00210077    0.01381623
C   -0.82467389   -0.78802559    0.08380270   -0.00410815   -0.02257700   -0.00044703
C    0.32856497    1.56734100    0.00974063    0.05794909   -0.01500118   -0.00285546
C    0.37640616   -1.54493819   -0.06835405   -0.04751990    0.03942908   -0.00220335
C    1.67621674    1.28332031    0.12282292   -0.05831505    0.01720320    0.00740576
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   15
   -420.52798701
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   15
   -420.52684282
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   15
   -420.52008582
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   15
   -420.51257338
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C   -0.89145320   -0.83234576    0.05541086   -0.06371232   -0.02399645   -0.00662671
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   15
   -420.50819862
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   15
   -420.50758186
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   15
   -420.50703690
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O   -2.05525702   -1.34192536    0.17167934   -0.02991062   -0.01471835    0.00990360
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   15
   -420.50428710
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C   -0.90510341   -0.85518716    0.03386509   -0.03427061   -0.00645876   -0.01631244
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C    1.70902211    1.24090913    0.10947957    0.05526718   -0.06631853    0.00193746
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C    2.39566604    0.09106541   -0.02593608    0.01863001   -0.02167447    0.00650606
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   15
   -420.50571012
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O   -2.08190142   -1.35544324    0.14855846   -0.05792278   -0.02566294    0.01042194
C   -0.74822033    0.66920601   -0.06717081    0.03829459    0.01962857    0.00293583
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   15
   -420.51101626
H   -2.65996020    0.56968735   -0.05331623   -0.02233909   -0.01287942    0.00393518
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C   -0.89710980   -0.86312391    0.02843647   -0.01108809   -0.00367781   -0.01656551
C    0.29213791    1.55123464   -0.02815394   -0.02402468   -0.00428331    0.00009717
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C    1.68022659    1.26767027    0.10377020   -0.00892164   -0.03666657    0.00074715
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C    2.40532217    0.10144484   -0.03431159    0.04305600   -0.02361045    0.00626150
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   15
   -420.51100807
H   -2.65934978    0.60322671   -0.02470308   -0.01879164   -0.00724748    0.00476831
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C   -0.89175425   -0.86673024    0.02722906    0.00024563   -0.00396721   -0.01525985
C    0.30265884    1.54190632   -0.03038052    0.00092725   -0.00185335    0.00169794
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C    1.66561647    1.28487113    0.10083334   -0.04286342   -0.01593519    0.00108975
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H    2.44519237   -1.97500759   -0.01339396    0.01060826   -0.01223199    0.01071094
C    2.40640936    0.10875215   -0.03906431    0.03416696   -0.01797197    0.00679201
H    3.49788054    0.17177861   -0.10446002    0.00792572    0.00457423   -0.00410768
   15
   -420.50480904
H   -2.64579845    0.64162245    0.00057776   -0.00553110    0.00431845    0.00391114
O   -1.90109892    1.27968866   -0.12445590    0.04464656   -0.01016556    0.00115923
O   -2.10145753   -1.36689910    0.11051765   -0.07828921   -0.02939885    0.00632515
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C   -0.88640936   -0.87009579    0.02694019    0.01072022   -0.00449143   -0.01316744
C    0.31312228    1.53265855   -0.03270776    0.02610964    0.00675260    0.00290707
C    0.43817648   -1.58488086    0.14370262    0.06131714   -0.04309020    0.02060430
C    1.65357621    1.30302910    0.09782704   -0.07229760    0.00609874    0.00213689
C    1.71534474   -1.11451341   -0.11469361   -0.05155275    0.06059258   -0.02716258
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   15
   -420.49900292
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O   -2.10116718   -1.36805935    0.09716058   -0.07857206   -0.02770921    0.00415786
C   -0.77092169    0.63286334   -0.09513385   -0.03063148    0.02179785   -0.00698236
C   -0.88170456   -0.87319130    0.02744490    0.01952240   -0.00475867   -0.01057087
C    0.32202800    1.52299601   -0.03520904    0.04705706    0.01644524    0.00376955
C    0.43347112   -1.58154068    0.15378796    0.06033670   -0.03338434    0.01765903
C    1.64586341    1.32082476    0.09468791   -0.09280428    0.02677469    0.00389512
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   15
   -420.49922105
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O   -2.09732576   -1.36796659    0.08361533   -0.07512015   -0.02489189    0.00183704
C   -0.77462333    0.62024482   -0.10140673   -0.04081658    0.01526029   -0.00874263
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C    0.32812329    1.51237330   -0.03793601    0.06093143    0.01943243    0.00416220
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H    2.50847147   -1.98027148   -0.12790872    0.03467820   -0.02434824   -0.00173766
C    2.39831303    0.13440309   -0.05568452    0.03412395    0.01684443    0.00346050
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   15
   -420.50523086
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O   -2.09009105   -1.36674816    0.06998693   -0.06765102   -0.02102384   -0.00053689
C   -0.77589251    0.60672189   -0.10715166   -0.04386110    0.00505042   -0.01036295
C   -0.87617947   -0.87852372    0.03019885    0.02904204   -0.00477882   -0.00484911
C    0.33057728    1.50063263   -0.04090911    0.06599980    0.01145520    0.00343108
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C    2.39181598    0.14188352   -0.06178677    0.04605828    0.02513341    0.00034816
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   15
   -420.50946356
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O   -1.87635179    1.30403099   -0.08258493    0.04236007    0.00413029    0.00074933
O   -2.07980225   -1.36458031    0.05638253   -0.05607407   -0.01594111   -0.00279046
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C   -0.87592892   -0.88075461    0.03210345    0.02857018   -0.00545667   -0.00201688
C    0.32909380    1.48823492   -0.04408044    0.06034899   -0.00350580    0.00089271
C    0.39946741   -1.56528389    0.17906208    0.01948041    0.03185078    0.00171551
C    1.65735774    1.36128777    0.08330890   -0.08304962    0.04914863    0.01017461
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C    2.38251600    0.14786491   -0.06790756    0.06108350    0.02932698   -0.00323745
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   15
   -420.50798409
H   -2.65266161    0.69219955    0.09908240   -0.01623465   -0.00702904    0.00878212
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O   -2.06698460   -1.36169454    0.04290362   -0.04042642   -0.00943190   -0.00471795
C   -0.77076771    0.57960101   -0.11666655   -0.03252556   -0.02294625   -0.01344300
C   -0.87738522   -0.88264984    0.03413113    0.02387587   -0.00725414    0.00060498
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C    0.38424790   -1.56209436    0.18688180   -0.00635895    0.03937935   -0.00004898
C    1.67208610    1.36897608    0.07844260   -0.05978225    0.03844464    0.01149636
C    1.70010573   -1.15427274   -0.06017938    0.02288451   -0.07264627   -0.00600032
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   15
   -420.50804590
H   -2.65428084    0.68857445    0.10773826   -0.01958238   -0.01140365    0.00945517
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O   -2.05234699   -1.35838670    0.02963673   -0.02097075   -0.00139873   -0.00609256
C   -0.76503808    0.56767728   -0.12025090   -0.02226018   -0.03701343   -0.01478336
C   -0.88026133   -0.88409961    0.03612402    0.01436538   -0.01037737    0.00286919
C    0.31631232    1.46493378   -0.05032056    0.02028513   -0.02810666   -0.00772179
C    0.36940626   -1.56123426    0.19469249   -0.03095976    0.03640742    0.00064977
C    1.69039477    1.37436350    0.07288210   -0.02959823    0.02295443    0.01259407
C    1.70107727   -1.15726690   -0.04795980    0.04059914   -0.07612414   -0.00457013
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C    2.35251242    0.15445358   -0.07937704    0.05526275    0.03198522   -0.00862247
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   15
   -420.51022751
H   -2.64242714    0.69272691    0.10972331   -0.01242210   -0.00847087    0.00779673
O   -1.87598913    1.32237277   -0.05199086    0.03565973    0.03629902    0.00098392
O   -2.03676958   -1.35502007    0.01664343    0.00156713    0.00788274   -0.00673100
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C    0.30739605    1.45548960   -0.05287960   -0.00613073   -0.03184494   -0.01159624
C    0.35641022   -1.56252265    0.20245162   -0.05032667    0.02290167    0.00375297
C    1.71047498    1.37836031    0.06656006    0.00423286    0.00792890    0.01365788
C    1.69973561   -1.15583231   -0.03551001    0.03161737   -0.04646194    0.00522514
H   -0.08353281    2.49912537    0.04416427   -0.00615340    0.01685618    0.00457337
H    0.39746744   -2.62381810    0.48308978    0.01837663   -0.00263244    0.00802371
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H    2.38490938   -1.92422777   -0.30004614   -0.01050350    0.01937597   -0.00995336
C    2.33225748    0.15488312   -0.08440278    0.01676710    0.03356537   -0.00986522
H    3.38646449    0.01513778   -0.08515451   -0.02026595   -0.01102374    0.00314011
   15
   -420.50488458
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O   -2.02126850   -1.35201288    0.00395258    0.02542372    0.01763004   -0.00658709
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C   -0.88767734   -0.88483801    0.03949079   -0.01825159   -0.01981263    0.00575985
C    0.29884507    1.44794010   -0.05474462   -0.03153314   -0.02940427   -0.01402407
C    0.34642193   -1.56515902    0.20997570   -0.06263649    0.00240347    0.00835074
C    1.73030227    1.38185074    0.05941191    0.03748699   -0.00177378    0.01472929
C    1.69648876   -1.15161326   -0.02337990    0.02007303   -0.01064626    0.01599522
H   -0.06881639    2.48265483    0.06511169   -0.00042801    0.01010712    0.00555163
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C    2.31102182    0.15329789   -0.08883476   -0.02859200    0.03216324   -0.01051791
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   15
   -420.49300307
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O   -1.88392553    1.32737009   -0.03181748   -0.00484025    0.02061204    0.00878719
O   -2.00691421   -1.34980232   -0.00844170    0.04739153    0.02647733   -0.00582365
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C   -0.89026643   -0.88356279    0.04069062   -0.03694476   -0.02473413    0.00625902
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C    1.74788367    1.38540393    0.05137285    0.06658826   -0.00265612    0.01578980
C    1.69198640   -1.14670079   -0.01219172    0.01617745    0.01593745    0.02198068
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H    0.40970327   -2.58067013    0.47300967    0.02027535    0.03425578   -0.00179228
H    2.20746527    2.39896032    0.13105020   -0.00501475    0.02541137    0.00099947
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C    2.29146273    0.14979453   -0.09263293   -0.06406761    0.02547685   -0.01071643
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   15
   -420.48503805
H   -2.60143204    0.70990556    0.09201841    0.02590098    0.01790390    0.00007709
O   -1.88808092    1.32822397   -0.02223150   -0.01359787    0.01785485    0.01015422
O   -1.99468686   -1.34878285   -0.02057268    0.06312580    0.03258333   -0.00481329
C   -0.73543562    0.54795382   -0.12501536    0.02208528   -0.05823046   -0.01871876
C   -0.89064190   -0.88079981    0.04151392   -0.05146829   -0.02799066    0.00636651
C    0.28871021    1.43771583   -0.05591115   -0.06868544   -0.01632244   -0.01429532
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C    1.76146897    1.38906705    0.04237977    0.08949722    0.00640720    0.01666377
C    1.68648106   -1.14269927   -0.00230814    0.01729973    0.03181421    0.02303141
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H    0.39397339   -2.58924119    0.46808983    0.01913115    0.03120184   -0.00133895
H    2.17387937    2.40436729    0.10563169   -0.01449564    0.01734010   -0.00011771
H    2.38626687   -2.04671337   -0.32243374    0.02367788   -0.03870980   -0.02662214
C    2.27569820    0.14477371   -0.09578459   -0.08370913    0.01416945   -0.01057678
H    3.41712144    0.09130624   -0.09013313    0.02635770    0.00061790    0.00530597
   15
   -420.48640479
H   -2.61577880    0.69673787    0.08428946    0.01327331    0.00853584    0.00177952
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O   -1.98528499   -1.34922511   -0.03248428    0.06864987    0.03425654   -0.00408226
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C   -0.88794807   -0.87636115    0.04195216   -0.05740444   -0.02784138    0.00647399
C    0.28934505    1.43431455   -0.05518611   -0.07481214   -0.01818804   -0.01408908
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C    1.76967949    1.39230691    0.03238175    0.10474704    0.02234492    0.01696728
C    1.67991880   -1.14056592    0.00620237    0.02075217    0.03627441    0.02006075
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H    2.15068299    2.39757624    0.08028782   -0.02312561    0.00464328   -0.00104578
H    2.35711689   -2.04308700   -0.29414588    0.01673571   -0.03487413   -0.02355744
C    2.26491452    0.13890584   -0.09829791   -0.08696215    0.00090785   -0.01017440
H    3.39906832    0.12082205   -0.09888769    0.02144839    0.00680862    0.00541274
   15
   -420.49279314
H   -2.63932656    0.67766895    0.07528119   -0.00543396   -0.00500479    0.00352222
O   -1.89507291    1.32698297   -0.00436938    0.00879217    0.03896535    0.00773101
O   -1.97895347   -1.35120215   -0.04420823    0.06245526    0.03075844   -0.00403919
C   -0.72587212    0.55850223   -0.12082367    0.03759835   -0.04607627   -0.02085054
C   -0.88183635   -0.87026078    0.04199729   -0.05274696   -0.02332940    0.00692013
C    0.29444803    1.43206827   -0.05360355   -0.06976056   -0.03055571   -0.01487031
C    0.34535603   -1.57278906    0.23438977   -0.04406294    0.02023532    0.00254737
C    1.77160424    1.39420170    0.02136239    0.11004190    0.03690415    0.01628782
C    1.67208684   -1.14054995    0.01351905    0.02717968    0.02541725    0.01325217
H   -0.04922128    2.42935258    0.11270845    0.01026158   -0.01434469    0.00512771
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   15
   -420.49786134
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   15
   -420.50150189
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O   -1.97397309   -1.35893885   -0.06706170    0.02515932    0.01225419   -0.00624233
C   -0.72504250    0.58012436   -0.11158962    0.03573511   -0.02983317   -0.02287750
C   -0.86099907   -0.85437388    0.04076416   -0.01974727   -0.00503811    0.00939920
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   15
   -420.51004675
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O   -1.97366671   -1.36387397   -0.07809344    0.00319929    0.00113445   -0.00787126
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C    1.74065955    1.38653030   -0.01713099    0.04355212    0.02134654    0.00994090
C    1.63696815   -1.14288513    0.03268877    0.01178186   -0.02583570   -0.00075922
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   15
   -420.51813298
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O   -1.97351651   -1.36886404   -0.08876888   -0.01591117   -0.00905672   -0.00930824
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C    1.72255585    1.38053042   -0.03135160    0.00001337    0.01283988    0.00799940
C    1.62245970   -1.14108449    0.03909694   -0.03866003    0.00385977    0.00113293
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C    2.26650847    0.11854266   -0.10241292   -0.01316831   -0.01477494   -0.00365637
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   15
   -420.51605331
H   -2.63108128    0.66138212   -0.00331858    0.01688325    0.02175615    0.00138087
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O   -1.97266226   -1.37344933   -0.09902378   -0.03029536   -0.01760504   -0.01029544
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C    1.70445114    1.37371937   -0.04605877   -0.04332594    0.01111805    0.00659824
C    1.61025346   -1.13948162    0.04546068   -0.08316780    0.02813150   -0.00143604
H   -0.09884685    2.46218177    0.07606520   -0.01291230   -0.00116268    0.00425304
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H    2.35338047   -1.99837323    0.05680003    0.01100059   -0.02087041    0.00062073
C    2.27094836    0.11753967   -0.10205528   -0.02248641   -0.00655661    0.00064872
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   15
   -420.50874751
H   -2.62897435    0.64520460   -0.02301760    0.01554464    0.02141152    0.00122576
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O   -1.97045394   -1.37724264   -0.10881372   -0.03925155   -0.02432198   -0.01070413
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C    1.68891781    1.36620148   -0.06116738   -0.07688161    0.01620932    0.00566250
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   15
   -420.50611730
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O   -1.96648484   -1.37993884   -0.11812035   -0.04282937   -0.02930606   -0.01048157
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C    1.67793927    1.35767788   -0.07661862   -0.09173259    0.02630488    0.00474463
C    1.60214445   -1.14181775    0.05880523   -0.11339570    0.03961050   -0.01299651
H   -0.06849108    2.46554431    0.03290357   -0.00371190   -0.02766382   -0.00023491
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H    2.39444234    2.19646656   -0.09901964    0.01566344    0.00010599    0.00059723
H    2.42227510   -2.00547001    0.17899291    0.03244027   -0.03347411    0.00925324
C    2.28392751    0.11602030   -0.10167706   -0.01765921    0.01634546    0.00691854
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   15
   -420.51084145
H   -2.64597608    0.57699089   -0.06344534   -0.01426809   -0.00438139   -0.00351169
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C   -0.75282926    0.67183090   -0.05053062   -0.02295991    0.01898009   -0.01888409
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C    0.36061972    1.51727092   -0.01329507    0.09345909   -0.00951824    0.00083904
C    0.37230070   -1.61441568    0.26488460    0.05145935   -0.03285747    0.02139985
C    1.67239560    1.34755756   -0.09235331   -0.08452962    0.03739564    0.00314527
C    1.60807710   -1.14649113    0.06646858   -0.09975213    0.03394385   -0.01857061
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C    2.29216841    0.11413992   -0.10202919   -0.00169660    0.02685701    0.00750363
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   15
   -420.51831215
H   -2.64497164    0.54242991   -0.08090348   -0.02112493   -0.01212722   -0.00587861
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C    0.35066002    1.53720357   -0.00688980    0.07332501   -0.01249301    0.00304282
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C    1.67188587    1.33520679   -0.10827290   -0.06209182    0.04214832    0.00052760
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C    2.30047479    0.11065037   -0.10282444    0.02155014    0.03437723    0.00596571
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   15
   -420.52159068
H   -2.62932758    0.51618939   -0.09420946   -0.01847202   -0.01286546   -0.00682715
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C   -0.75680810    0.69832475   -0.02015649   -0.02293784    0.02242503   -0.01258876
C   -0.80392353   -0.80695259    0.00834242    0.03662051    0.01516858    0.00701974
C    0.33630791    1.55791345   -0.00067479    0.04481765   -0.01971551    0.00642131
C    0.34923405   -1.61310652    0.26302120    0.00931699   -0.00343894    0.02185335
C    1.67512549    1.32038034   -0.12422162   -0.03813366    0.03260820   -0.00262645
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H    2.38003292   -1.87449693    0.31336695   -0.01503052    0.02730096    0.00376479
C    2.30746599    0.10510088   -0.10397210    0.04665120    0.03817015    0.00284859
H    3.34177187   -0.03945381   -0.30559904   -0.01791701   -0.00990890   -0.00207243
   15
   -420.52021872
H   -2.60087149    0.49879791   -0.10271451   -0.00758732   -0.00671478   -0.00586014
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C   -0.80776727   -0.80561224    0.00134104    0.02396277    0.01008654    0.00375228
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C    1.68070683    1.30365902   -0.14001326   -0.02061936    0.00813910   -0.00545355
C    1.65234077   -1.16831982    0.09637401    0.03704703   -0.02980239   -0.01159665
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H    2.36409498   -1.84308291    0.34803149   -0.04158975    0.05522509   -0.00552911
C    2.31169487    0.09725552   -0.10529620    0.05983095    0.03948452    0.00062609
H    3.32310610   -0.05507373   -0.30992875   -0.03533382   -0.00948314    0.00112262
   15
   -420.52192936
H   -2.56723830    0.48591366   -0.10710487    0.00791165    0.00465964   -0.00318964
O   -1.96039193    1.23856151    0.06893154    0.02347071   -0.00857889    0.00567410
O   -1.92187520   -1.37193525   -0.15874091    0.00441149   -0.02470494   -0.00040705
C   -0.75546391    0.71956695    0.01322836   -0.01179361    0.01719434   -0.00457513
C   -0.81303911   -0.80487205   -0.00588358    0.00712208    0.00305166   -0.00022774
C    0.30146215    1.60302313    0.01033664   -0.01870360   -0.01799644    0.01433525
C    0.32420043   -1.61039933    0.25596507   -0.04625251   -0.00032908    0.01800842
C    1.68755427    1.28647739   -0.15547873   -0.00691433   -0.02264311   -0.00757794
C    1.66690790   -1.17405265    0.10822300    0.05440112   -0.02219600   -0.01299984
H    0.05551793    2.70389485   -0.06222212   -0.00091682    0.02632060   -0.00591765
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   15
   -420.52422256
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O   -1.91101144   -1.36631935   -0.16632377    0.02349879   -0.01739552    0.00295979
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   15
   -420.51960426
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   15
   -420.51152178
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C   -0.74952708    0.74458400    0.06469325    0.01389677    0.00137688    0.00893791
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C    1.70714911    1.24869930   -0.19874885    0.03657210   -0.06679496   -0.01257791
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   15
   -420.50720076
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O   -1.88803794   -1.34610986   -0.19042973    0.06490146    0.00124225    0.01009052
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C    1.71044355    1.24362766   -0.21178969    0.05065980   -0.05418370   -0.01537440
C    1.70060814   -1.20217027    0.16892685    0.01685044    0.05650262   -0.02855335
H    0.14627731    2.74265700   -0.07683277    0.01561693   -0.01742557   -0.00311091
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C    2.30433316    0.02510750   -0.11607669   -0.03611961   -0.00197595    0.01261222
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   15
   -420.50958345
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O   -1.88564792   -1.33918176   -0.19927316    0.06119720    0.00122027    0.00958880
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C   -0.82152612   -0.79429446   -0.03625409   -0.06645719   -0.02646997   -0.01864466
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C    1.70563903   -1.21638510    0.18858072    0.01651865    0.04386021   -0.01881829
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C    2.30592708    0.00755902   -0.12018331   -0.02550140   -0.02054130    0.00973672
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   15
   -420.51443623
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O   -1.88599392   -1.33229495   -0.20854488    0.04680155   -0.00250120    0.00730946
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C    1.70713504    1.24179241   -0.23483427    0.06954092   -0.00666410   -0.02306239
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H    2.42078531   -2.04486286    0.48568884    0.01159781   -0.00925091    0.00716048
C    2.30899895   -0.00876551   -0.12486697   -0.00236781   -0.03549577    0.00454879
H    3.39049406    0.02479410   -0.28078841    0.00243138    0.00540957   -0.00155337
   15
   -420.51483970
H   -2.56619253    0.33191957   -0.07825575   -0.00418001   -0.01163549   -0.00478382
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O   -1.88843543   -1.32528622   -0.21814335    0.02499671   -0.00847153    0.00372155
C   -0.75442581    0.77668311    0.12440727    0.02870492   -0.00071050    0.02646678
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C    1.69944196    1.24226869   -0.24439501    0.06441300    0.00639185   -0.02365879
C    1.71235818   -1.25082433    0.23032912    0.03097949   -0.02808263    0.01466124
H    0.11828537    2.81231963   -0.05749506    0.00700543    0.01110474   -0.00350458
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H    2.24584613    2.10883288   -0.49661151   -0.02704707   -0.01160902    0.00652061
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C    2.31218590   -0.02297364   -0.12981962    0.02588287   -0.04452370   -0.00178177
H    3.36421127    0.04368104   -0.26201341   -0.01940522    0.00739171    0.00252363
   15
   -420.51094885
H   -2.56942978    0.33985542   -0.05905285    0.00238276    0.00262173   -0.00149989
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O   -1.89200158   -1.31789165   -0.22790838    0.00060735   -0.01486000   -0.00047958
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C    1.68791700    1.24243123   -0.25255206    0.04687498    0.00558924   -0.01905627
C    1.71323629   -1.26679124    0.25044352    0.03192331   -0.06727787    0.02934986
H    0.09448956    2.83601045   -0.04651714    0.00083814    0.02571543   -0.00311251
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C    2.31385754   -0.03451441   -0.13466979    0.04425846   -0.04857129   -0.00711409
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   15
   -420.51048360
H   -2.57439276    0.34587456   -0.03874900    0.00886701    0.01707659    0.00143177
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O   -1.89560243   -1.30982695   -0.23765183   -0.02195888   -0.02020316   -0.00465257
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C   -0.77238952   -0.76276021   -0.04357163    0.00275044   -0.00806467   -0.00974718
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C    1.71235444   -1.27889245    0.26884639    0.00123107   -0.06872497    0.03225722
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C    2.31296306   -0.04312734   -0.13910156    0.04162810   -0.05049138   -0.01024723
H    3.35986132    0.06526192   -0.23128603   -0.02368664    0.00870577    0.00507426
   15
   -420.51046698
H   -2.58532736    0.34021212   -0.01935648    0.00864815    0.02157614    0.00246818
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O   -1.89822472   -1.30085294   -0.24718584   -0.03983006   -0.02372995   -0.00837292
C   -0.77476249    0.80072258    0.15349749    0.01144008    0.01689619    0.03418486
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C    1.65791416    1.24210670   -0.26593283   -0.00287623   -0.00162001   -0.00272913
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C    2.30962549   -0.04869435   -0.14291903    0.02447442   -0.05073502   -0.01227351
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   15
   -420.50455957
H   -2.60196085    0.31982766   -0.00163572   -0.00000294    0.01307339    0.00182489
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C   -0.74370344   -0.74267733   -0.04297214    0.03157852   -0.00394346   -0.00327090
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C    0.43748129   -1.55986963    0.19112515    0.08650714    0.01049984   -0.01462623
C    1.64239576    1.24199704   -0.27211585   -0.02527596    0.00364254    0.00351778
C    1.71343492   -1.29259606    0.30009927   -0.08334456   -0.01584053    0.02533827
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C    2.30480722   -0.05120966   -0.14599276    0.00698122   -0.04770203   -0.01451609
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   15
   -420.49665132
H   -2.61844010    0.29030189    0.01477037   -0.01119934   -0.00012573    0.00116419
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O   -1.89757030   -1.27962471   -0.26498416   -0.05792624   -0.02514323   -0.01366071
C   -0.79245100    0.81227888    0.16284602   -0.00160706    0.03014798    0.03520552
C   -0.73182243   -0.73223271   -0.04227828    0.03960061   -0.00359421   -0.00063749
C    0.32430850    1.71040530    0.00466372    0.04943540    0.05079416   -0.00699078
C    0.44760425   -1.55987055    0.18987807    0.09397965   -0.00239965   -0.01079303
C    1.62837872    1.24163486   -0.27849537   -0.04218306    0.01533977    0.00650281
C    1.72029091   -1.29717938    0.31331952   -0.09437693   -0.00316554    0.02504986
H    0.02654469    2.74746489    0.00796332   -0.00872817   -0.00789916    0.00401829
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H    2.29871029    2.04556849   -0.71329002    0.01201332    0.01759908   -0.01605327
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   15
   -420.49341117
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O   -1.89346971   -1.26730418   -0.27300920   -0.05886168   -0.02351823   -0.01504416
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   15
   -420.49661997
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   15
   -420.50127650
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   15
   -420.50197156
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C    1.60022671    1.22061707   -0.30598778   -0.03933760    0.06312486   -0.00875390
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   15
   -420.50243186
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O   -1.85279192   -1.20905642   -0.29834982   -0.02519786   -0.00282381   -0.01046148
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   15
   -420.50794291
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C    0.30476120    1.60970961   -0.00199486    0.04446797   -0.03354749   -0.00219167
C    0.41529484   -1.56117553    0.20134925   -0.01783566    0.00726490   -0.02056295
C    1.60177236    1.19021314   -0.31800961   -0.03205969    0.01802746    0.00030507
C    1.81829686   -1.30409598    0.35271974    0.10279385   -0.05152931    0.04040746
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   15
   -420.51057789
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C   -0.71537469   -0.65985895   -0.04022999   -0.00366773    0.01966003   -0.00052250
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   15
   -420.50529864
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O   -2.13506183    1.14034729    0.17316968   -0.02847190   -0.00966874   -0.00652938
O   -1.80962809   -1.16355934   -0.31240907    0.03353628    0.02913912    0.00389419
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C   -0.71813861   -0.65215292   -0.04036768   -0.02256650    0.02346726   -0.00343894
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C    1.82313847   -1.28551623    0.34713729    0.06922077    0.02325291    0.01023338
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H    2.56672716   -2.12268534    0.63053574    0.02601438   -0.02929764    0.01216335
C    2.24624375   -0.01631415   -0.11670637   -0.06146701    0.02875524   -0.00289906
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   15
   -420.49739725
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O   -1.79700018   -1.15034422   -0.31712753    0.05353553    0.04052655    0.00936232
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   15
   -420.49297717
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O   -1.78678026   -1.13896073   -0.32226736    0.06793576    0.05000587    0.01391460
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C    1.61882055    1.12843419   -0.34204970    0.04436610   -0.05017405   -0.01046362
C    1.81085477   -1.27131265    0.33877281    0.04911103    0.04184744   -0.00701075
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   15
   -420.49332140
H   -2.54268357    0.20419291    0.03231446    0.00114286   -0.02213074   -0.00132651
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O   -1.77960886   -1.12983330   -0.32803139    0.07338141    0.05610632    0.01662249
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C    1.79997882   -1.26782958    0.33499503    0.04444546    0.03144888   -0.00843179
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H    2.62577359   -2.00349096    0.66791142    0.03545985   -0.01502238    0.01510632
C    2.25053270   -0.02078030   -0.09178857   -0.05916784    0.00915243    0.01778261
H    3.30072038    0.01701068   -0.43854162    0.00407435    0.00429355   -0.01139930
   15
   -420.49442346
H   -2.56884867    0.23182779    0.02032116   -0.00285629   -0.01993321   -0.00284062
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O   -1.77572885   -1.12323607   -0.33454057    0.06878589    0.05812931    0.01694679
C   -0.83825205    0.76673136    0.09524635    0.02007254   -0.01400513   -0.01917051
C   -0.70775755   -0.63760886   -0.03744373   -0.04117539    0.03874774   -0.00625619
C    0.22334375    1.53632302   -0.00836625   -0.08387356   -0.02465487    0.02193365
C    0.40259991   -1.55888476    0.24874833   -0.04353456    0.00251545    0.00283761
C    1.61678316    1.11254132   -0.35149897    0.06955926   -0.02652705   -0.02897917
C    1.78637855   -1.26617521    0.33169326    0.04686780    0.00664742   -0.00315704
H    0.22189738    2.59975344   -0.07298347    0.01807545   -0.01704841   -0.00286047
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H    2.15560066    1.95361965   -0.69339994   -0.01785766   -0.01394519    0.01023141
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C    2.25996337   -0.02412324   -0.08520623   -0.03067515   -0.00328186    0.01842758
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   15
   -420.49230319
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C   -0.69837820   -0.63919248   -0.03562461   -0.02328165    0.04249781   -0.00217097
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   15
   -420.49136149
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   15
   -420.49595983
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O   -1.78015408   -1.11880751   -0.35820973    0.02076937    0.04771429    0.00710022
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C    1.58588625    1.10151845   -0.35322494    0.01298694   -0.03552706   -0.02100864
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   15
   -420.49799163
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O   -1.78458895   -1.12193668   -0.36698939    0.00528236    0.04316995    0.00296490
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C   -0.66737395   -0.65940853   -0.03060014    0.04423581    0.03600508    0.01203625
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C    1.57191428    1.10148720   -0.35078926   -0.01722299   -0.04012712   -0.01381599
C    1.70816311   -1.24841857    0.31639134   -0.09101544   -0.01724651   -0.01209208
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   15
   -420.49451437
H   -2.69555370    0.43544194   -0.02324842   -0.00431362    0.01219652   -0.00060404
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C   -0.66059264   -0.67086395   -0.03001785    0.06172282    0.02722016    0.01519866
C    0.25433965    1.52484365   -0.04389720    0.02601224   -0.03579104    0.00325413
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C    1.55896952    1.10384660   -0.34751236   -0.04458044   -0.03765944   -0.00776506
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   15
   -420.49197772
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C    1.54868877    1.10845117   -0.34375601   -0.06547606   -0.02874159   -0.00372194
C    1.68632636   -1.23041197    0.31029739   -0.15530623    0.01353207   -0.02348614
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C    2.31951828   -0.02116502   -0.07267446    0.00912579   -0.02262607    0.02746340
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   15
   -420.49551654
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O   -1.79756151   -1.14244325   -0.39357661   -0.01512440    0.03386099   -0.00418538
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C   -0.65889113   -0.69806380   -0.03171216    0.08044721    0.00593727    0.01788873
C    0.26819287    1.53805923   -0.06188790    0.06430974   -0.00153517   -0.00820531
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C    1.54231950    1.11477028   -0.33976168   -0.07674436   -0.01520398   -0.00229956
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C    2.32724349   -0.01493691   -0.07634183    0.01815009   -0.01376037    0.01986182
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   15
   -420.50360902
H   -2.73713188    0.48316999   -0.03805086   -0.02223591   -0.00230530   -0.00850505
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C   -0.66509792   -0.71253204   -0.03415033    0.08056354   -0.00438729    0.01719355
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C    1.54053746    1.12200478   -0.33561617   -0.07741545   -0.00104347   -0.00319186
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C    2.33384229   -0.00787992   -0.08119802    0.03276299   -0.00420071    0.00982155
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   15
   -420.51015452
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C    2.33845105   -0.00056707   -0.08664672    0.04874150    0.00505241   -0.00048090
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   15
   -420.51116800
H   -2.69535924    0.51522287   -0.02196378   -0.00117587    0.01222152   -0.00130475
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O   -1.80568311   -1.17691319   -0.41881675    0.00300072    0.02917936   -0.00088694
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C    1.73388212   -1.20651595    0.31228463    0.02795860    0.00389724    0.00400320
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H    2.17293752    1.91307497   -0.68867882   -0.01120094   -0.02336367    0.00685518
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   15
   -420.51028855
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O   -1.80815161   -1.19112378   -0.42703766    0.01560350    0.02895306    0.00233209
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C   -0.71074283   -0.75223799   -0.04700129    0.04039773   -0.02760011    0.00535495
C    0.25134285    1.56598949   -0.09186515    0.02855825   -0.00821627   -0.00445369
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C    1.75051040   -1.20296434    0.31364286    0.07081128   -0.00474268    0.00955731
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C    2.33856022    0.01265051   -0.09703075    0.04547281    0.02031442   -0.01244270
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   15
   -420.51192416
H   -2.64798982    0.51479711   -0.00099715    0.01097444    0.01481964    0.00115766
O   -2.06234353    1.21636111    0.31334109   -0.03320315   -0.00433035    0.00574214
O   -1.81133328   -1.20664988   -0.43536637    0.02954527    0.02915714    0.00600100
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C   -0.73227356   -0.76268278   -0.05233652    0.01533538   -0.03204428   -0.00135080
C    0.24016216    1.57338399   -0.09824021    0.00065449   -0.00849398   -0.00020305
C    0.37650928   -1.56149374    0.31237389   -0.04111202   -0.00680519   -0.00952076
C    1.57561972    1.15115441   -0.31763249   -0.04149036   -0.03180224    0.00996903
C    1.76299428   -1.19927754    0.31446196    0.08711177    0.01456088    0.00783352
H   -0.03821212    2.65199340   -0.16370187   -0.01130888    0.01605094    0.00096077
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H    2.23763135    1.93627280   -0.71864398    0.00894510   -0.00350238   -0.00615295
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   15
   -420.51248358
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   15
   -420.50994468
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   15
   -420.50841295
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   15
   -420.51043726
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   15
   -420.51385498
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   15
   -420.51466234
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   15
   -420.51198152
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   15
   -420.50834472
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O   -1.89505834   -1.36437749   -0.51051068   -0.03370732   -0.03118376   -0.02741805
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   15
   -420.50463932
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   15
   -420.50001173
H   -2.66761917    0.57730264    0.25738559   -0.01325149   -0.01108560   -0.00062154
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   15
   -420.49621677
H   -2.69053890    0.59974526    0.29066457   -0.02142896   -0.01283765    0.00051735
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C    2.28332466    0.04402649   -0.09333986   -0.00599358   -0.02869201    0.00629752
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   15
   -420.49610912
H   -2.69861619    0.63098650    0.32353769   -0.01984083   -0.00720674    0.00226749
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C   -0.77790575    0.70513587    0.14588624   -0.03453290    0.02647450    0.03915478
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C    1.67545783   -1.24832717    0.27506719   -0.07809601   -0.06368422    0.00047406
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H    2.60005931   -1.82620559    0.59188793    0.03834528    0.00964884    0.00374858
C    2.27455452    0.05361445   -0.09103760   -0.01422518   -0.01807332    0.00754484
H    3.40204812    0.11651454   -0.16629819    0.02437730    0.01161592   -0.00307968
   15
   -420.49876138
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   15
   -420.50061056
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   15
   -420.50062953
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   15
   -420.50010996
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   15
   -420.49875906
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   15
   -420.49613921
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   15
   -420.49400548
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   15
   -420.49453103
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   15
   -420.49781101
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   15
   -420.50163419
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   15
   -420.50410952
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   15
   -420.50383252
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   15
   -420.49934761
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   15
   -420.49147994
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   15
   -420.48391890
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   15
   -420.48073438
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   15
   -420.48347799
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C    0.29208559    1.49959198   -0.16520395    0.01198089    0.00629681   -0.00138576
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C    1.67784617    1.29183681   -0.22865070   -0.02185093   -0.01838430    0.01988424
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   15
   -420.49036610
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O   -1.88200674   -1.45445640   -0.43421836   -0.00529300   -0.01717548   -0.00776625
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C    1.66956533    1.28599692   -0.22772075   -0.02310474   -0.01445389    0.01970038
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   15
   -420.49733087
H   -2.63289560    0.81416746    0.47051179    0.01040375    0.01241558    0.00359701
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C    1.66265818    1.28101485   -0.22797325   -0.01980402   -0.00751108    0.01779807
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C    2.33390674    0.09406923   -0.09095345    0.04167685   -0.00399720   -0.02069614
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   15
   -420.50113584
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C    2.32894343    0.09874678   -0.08749650    0.03560211    0.00821704   -0.02155205
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   15
   -420.50160456
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H    2.28453134   -1.90892271    0.41369497   -0.00807022    0.00132721   -0.01323148
C    2.32185275    0.10293684   -0.08274334    0.02445268    0.01864972   -0.02098117
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   15
   -420.49983972
H   -2.70568511    0.84607070    0.42981396   -0.02379067    0.00410462    0.00798648
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O   -1.89139101   -1.44341755   -0.40407575    0.02734547   -0.01029984    0.00253065
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C   -0.86720397   -0.81416735   -0.14074679   -0.02319038    0.02182420   -0.00399041
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C    0.30455264   -1.57434149    0.29151758   -0.03194779   -0.03870170   -0.00009731
C    1.64861948    1.26911208   -0.23497668   -0.02087238   -0.02987334    0.01924201
C    1.64738961   -1.06122650    0.31683286    0.03401159    0.08111883    0.00794800
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   15
   -420.49725763
H   -2.70257156    0.85017338    0.40550038   -0.01506572    0.00970354    0.00747047
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O   -1.89578753   -1.43918934   -0.39652038    0.03441258   -0.00750890    0.00436742
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C   -0.87738910   -0.80932005   -0.14680475   -0.04207040    0.01926696   -0.00778941
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C    0.30913992   -1.57464249    0.28618266   -0.03672997   -0.05021246    0.00556896
C    1.64623946    1.26764149   -0.23948754   -0.02377967   -0.04319770    0.02077047
C    1.67684418   -1.06865592    0.31391569    0.05988164    0.09885678   -0.00182836
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H    2.26823814   -2.01242657    0.52594188   -0.00448417   -0.03117612    0.00019400
C    2.30436482    0.10753489   -0.06953899   -0.01347805    0.03007714   -0.01726606
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   15
   -420.49600970
H   -2.68912512    0.84710775    0.37580291    0.00187734    0.01811237    0.00698989
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C    0.28865674    1.49329246   -0.15223336    0.00440793   -0.03632426   -0.00097851
C    0.31593959   -1.57191294    0.28050846   -0.03963811   -0.06032850    0.01169693
C    1.64528270    1.26873126   -0.24524116   -0.02380470   -0.04634604    0.01969260
C    1.70270539   -1.08198921    0.31109596    0.08013504    0.10176852   -0.00901747
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H    2.21104008    2.20699430   -0.47536999    0.00227113    0.01846341   -0.00705133
H    2.26544320   -2.03610753    0.58439636   -0.00622225   -0.03603631    0.00566939
C    2.29621622    0.10725222   -0.06130946   -0.03148354    0.03097535   -0.01467628
H    3.37053658   -0.05065345    0.01140144   -0.00456550   -0.02107294    0.00946629
   15
   -420.49863028
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   15
   -420.50607302
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   15
   -420.51434741
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   15
   -420.51886487
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   15
   -420.51945932
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   15
   -420.51626443
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   15
   -420.50860195
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   15
   -420.49833613
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   15
   -420.49047115
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   15
   -420.48929346
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   15
   -420.49400030
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   15
   -420.50091414
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   15
   -420.50899499
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   15
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   15
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   15
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   15
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   15
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   15
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   15
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   15
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   15
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   15
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   15
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   15
   -420.46356251
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   15
   -420.46580736
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   15
   -420.46784043
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   15
   -420.47544860
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O   -1.84651986   -1.39934231   -0.01216204    0.13692459    0.04374699    0.00879034
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   15
   -420.48693607
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   15
   -420.49067556
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C    0.32219746    1.64002957    0.21914630   -0.00854626    0.04756465    0.03210677
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   15
   -420.48607810
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C   -0.80499148    0.71329511    0.15944529   -0.00887505   -0.02392033    0.01728121
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   15
   -420.47974211
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C   -0.78714370   -0.80851435    0.14797164    0.08273324   -0.00100561    0.02622405
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   15
   -420.47711552
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   15
   -420.47612328
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O   -1.97057838   -1.44440365   -0.02818307   -0.08381626   -0.06034799   -0.02580562
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   15
   -420.47502490
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H    3.38737280   -0.04413734    0.02248065    0.00528548   -0.00774775    0.01778188
   15
   -420.48115260
H   -2.67808384    0.78685909   -0.27237547    0.02769611    0.04159809   -0.00011862
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O   -1.99301038   -1.44257861   -0.02642507   -0.08943747   -0.06378729   -0.02818188
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C    0.26587505    1.64229829    0.19385316   -0.05082757    0.02711924    0.01233428
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   15
   -420.48888314
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   15
   -420.49315984
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C   -0.83152392   -0.80470830    0.19277362    0.04200052    0.01256923    0.05488151
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   15
   -420.49599892
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   15
   -420.49648619
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C   -0.75671289    0.73200070    0.06470446    0.01778803    0.03249752   -0.01733872
C   -0.87682334   -0.80888263    0.18303932   -0.02268672   -0.00119732    0.04710678
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C    1.58473574    1.19726721    0.05817262   -0.05454354   -0.04252200    0.01686567
C    1.76080642   -1.23332843    0.00048427    0.02066147   -0.00538110    0.01901443
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   15
   -420.49216720
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O   -1.98799617   -1.39052260   -0.00151247    0.00504689   -0.02316692   -0.01054668
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C   -0.89844498   -0.81110084    0.17375755   -0.06241686   -0.01434580    0.03957310
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C    1.58100847    1.19173102    0.07346140   -0.04573503   -0.03881501    0.01303862
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   15
   -420.48227643
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C   -0.91628960   -0.81243773    0.16208759   -0.10242209   -0.03011054    0.03104630
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C    0.38090125   -1.52004461    0.01649342   -0.01129046    0.02217019   -0.00773411
C    1.58007946    1.18858239    0.08795978   -0.04289970   -0.04254976    0.00948515
C    1.79283139   -1.24256733   -0.00284106    0.04993613   -0.01581791    0.01484946
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C    2.32130590    0.06644480   -0.19593748   -0.00604960    0.03327492   -0.01596012
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   15
   -420.46969240
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O   -1.97941020   -1.35850971    0.01337937    0.07371149    0.01777706   -0.00036122
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C   -0.92797376   -0.81195972    0.14853648   -0.13552255   -0.04449805    0.02319776
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C    1.58176934    1.18804615    0.10189059   -0.04471631   -0.05353285    0.00485132
C    1.80473295   -1.24589299   -0.00591186    0.05876247   -0.01803037    0.01310476
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C    2.32445340    0.07554508   -0.20069192   -0.00960155    0.03527117   -0.01134492
H    3.33350426    0.23575566   -0.62618564    0.00544973    0.00470099   -0.01851238
   15
   -420.46423215
H   -2.35566043    0.52907777   -0.25027825    0.07512954    0.02812674    0.00995050
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O   -1.97933762   -1.34323122    0.02096200    0.09223016    0.02941832    0.00195927
C   -0.77233936    0.69508221    0.03826783   -0.02910112    0.00115229   -0.01605882
C   -0.93154198   -0.80882710    0.13357251   -0.15257090   -0.05157714    0.01728157
C    0.28828435    1.56164039    0.12393089    0.03414219    0.03720868   -0.00489553
C    0.37098870   -1.52683025    0.02573740   -0.02467310    0.01005117   -0.00558447
C    1.58615950    1.19073499    0.11553069   -0.04590114   -0.06222675   -0.00022350
C    1.81310080   -1.24813387   -0.00977622    0.06358028   -0.01910434    0.01155913
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   15
   -420.46992639
H   -2.41609608    0.51810205   -0.25229416    0.04573885    0.00001900    0.00353540
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O   -1.98336611   -1.32924179    0.02846388    0.08889366    0.02920391    0.00217338
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C    0.36808263   -1.53133810    0.03089387   -0.02826248    0.00469236   -0.00454260
C    1.59330836    1.19713808    0.12917579   -0.04375265   -0.06139634   -0.00362488
C    1.81764113   -1.24922082   -0.01434086    0.06487692   -0.01986313    0.01025169
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H    2.44953587   -2.14047837    0.10055444    0.00026049   -0.00868067    0.01369195
C    2.33238774    0.08748040   -0.20827443   -0.00368038    0.02974915   -0.00848055
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   15
   -420.47795937
H   -2.50887147    0.50694797   -0.25681442    0.00571152   -0.02727241   -0.00382226
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O   -1.99134715   -1.31653992    0.03587062    0.06447085    0.01928669    0.00142820
C   -0.77209176    0.67428706    0.03121278    0.00554077   -0.00483862   -0.00185024
C   -0.91176593   -0.79367544    0.10071349   -0.11493883   -0.03031516    0.01065873
C    0.28046272    1.52330076    0.10799121    0.00118215    0.01444869   -0.00955708
C    0.36687686   -1.53614606    0.03632323   -0.03007448    0.00260503   -0.00315656
C    1.60308623    1.20719783    0.14302380   -0.03817620   -0.04932736   -0.00377210
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H    2.47549872   -2.11934979    0.11434684    0.00269778   -0.00663767    0.01424497
C    2.33681851    0.09064226   -0.21127263    0.00538414    0.02369970   -0.01078938
H    3.25290188    0.34121556   -0.75709849   -0.01043203    0.01383171   -0.02028385
   15
   -420.48293804
H   -2.60629737    0.51434480   -0.25876117   -0.02606324   -0.03739054   -0.00831845
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O   -2.00220851   -1.30470049    0.04321099    0.02810161    0.00594838    0.00106300
C   -0.77186147    0.66425340    0.02808283    0.02441807   -0.00767659    0.00524676
C   -0.89065378   -0.78291652    0.08323233   -0.06873839   -0.00679693    0.00736609
C    0.27589825    1.50238578    0.10081459   -0.01900473   -0.00866278   -0.01267460
C    0.36748443   -1.54113121    0.04194283   -0.03074164    0.00425049   -0.00166397
C    1.61515730    1.22018810    0.15707893   -0.02943820   -0.02670623    0.00025716
C    1.81508601   -1.24774112   -0.02527520    0.05945611   -0.02137561    0.00858577
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H    2.10885601    2.18168116    0.46108886   -0.01273463    0.02038730    0.02132979
H    2.49954389   -2.09350227    0.11792644    0.00472821   -0.00357263    0.01403361
C    2.34091631    0.09237783   -0.21361114    0.01589145    0.01623766   -0.01447908
H    3.23461076    0.35884466   -0.77063199   -0.01748976    0.01503961   -0.01728485
   15
   -420.48529028
H   -2.68573135    0.54792314   -0.25489089   -0.04478484   -0.03497809   -0.00978320
O   -1.91459589    1.30489625   -0.14326066    0.07121438    0.03747433    0.00935506
O   -2.01434158   -1.29313917    0.05049904   -0.00939773   -0.00533905    0.00176648
C   -0.77307544    0.65469140    0.02464215    0.03695214   -0.01196173    0.01104712
C   -0.86539925   -0.77175415    0.06531218   -0.01937332    0.01833708    0.00281915
C    0.27247305    1.48199527    0.09440759   -0.03721520   -0.03200985   -0.01638555
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   15
   -420.48687685
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C   -0.77648315    0.64586272    0.02054121    0.04137851   -0.01819069    0.01529032
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   15
   -420.48832353
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   15
   -420.48573881
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O   -2.04300500   -1.25604235    0.07153506   -0.07882772   -0.01385408    0.00815934
C   -0.79050797    0.63198758    0.00941764    0.02910285   -0.03333311    0.01964379
C   -0.79243740   -0.74996070    0.01191257    0.08446392    0.06941987   -0.01448579
C    0.27794439    1.43600799    0.08205734   -0.04779220   -0.05940001   -0.02621821
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C    1.67431918    1.26995211    0.20756905   -0.00098427    0.06053922    0.03164245
C    1.77075732   -1.22959015   -0.05328751    0.02172604   -0.01655343    0.00816058
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   15
   -420.48063060
H   -2.75366071    0.79657343   -0.18560220    0.05966633    0.06704819    0.00101844
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O   -2.04648483   -1.24244047    0.07795151   -0.08646325   -0.00999713    0.01046641
C   -0.80039855    0.62783314    0.00212925    0.01545861   -0.03758631    0.02023964
C   -0.77601577   -0.75001083   -0.00460808    0.10085561    0.07306184   -0.02007666
C    0.28572446    1.42758065    0.08088626   -0.03531164   -0.05404446   -0.02708176
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C    1.68958702    1.27510893    0.21633245   -0.01014248    0.04967336    0.03214411
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   15
   -420.48367685
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O   -2.04606434   -1.22839492    0.08389449   -0.08800631   -0.00348825    0.01239394
C   -0.81120611    0.62592566   -0.00637922   -0.00170687   -0.03676283    0.02005928
C   -0.76565378   -0.75444349   -0.01991576    0.10923997    0.06951248   -0.02540917
C    0.29562056    1.42241932    0.08134657   -0.01875121   -0.04818534   -0.02667446
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C    1.70545211    1.27728061    0.22315209   -0.01635658    0.03470148    0.03246461
C    1.73811123   -1.21403585   -0.07027678   -0.00973569   -0.01257712    0.01010070
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H    3.37519471    0.22025324   -0.60801243    0.01233304    0.01186369   -0.01855451
   15
   -420.48637821
H   -2.86710885    0.75917960   -0.14341568   -0.03044983    0.01677569   -0.00211070
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O   -2.04167097   -1.21419959    0.08927778   -0.08406452    0.00530354    0.01369284
C   -0.82190344    0.62622074   -0.01609858   -0.02026796   -0.03184729    0.01942899
C   -0.76186192   -0.76304789   -0.03368839    0.11024985    0.05951537   -0.03039158
C    0.30663964    1.42019093    0.08341638    0.00005323   -0.04581773   -0.02552835
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C    1.72217875   -1.20506274   -0.07965349   -0.02496651   -0.01144131    0.01177332
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H    2.51836750   -1.95625410   -0.07920412    0.00998720    0.00716661   -0.00017225
C    2.33347578    0.10093112   -0.20283142   -0.00635346    0.00226594   -0.01132757
H    3.40354440    0.15878612   -0.53661609    0.01707289    0.00628599   -0.01550531
   15
   -420.48514169
H   -2.91273035    0.71034534   -0.12046834   -0.06132856   -0.00284116   -0.00042493
O   -2.02050519    1.25260576   -0.14783845    0.02370800   -0.00591560   -0.00358954
O   -2.03348464   -1.20025207    0.09404288   -0.07434496    0.01599621    0.01417178
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C   -0.76469983   -0.77522570   -0.04562624    0.10360235    0.04429218   -0.03470264
C    0.31765271    1.42074799    0.08702822    0.01936568   -0.04618871   -0.02399738
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C    1.73991525    1.27613459    0.23083441   -0.00388803    0.01041042    0.03468645
C    1.70773912   -1.19539914   -0.08974241   -0.03679061   -0.00999854    0.01346619
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C    2.32999884    0.10341126   -0.19804659   -0.01337228    0.01359517   -0.01228587
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   15
   -420.48562942
H   -2.91571218    0.66287922   -0.09723565   -0.06644943   -0.01086964    0.00165682
O   -2.03275647    1.25069786   -0.14795062    0.02633472    0.00345180   -0.00515775
O   -2.02195185   -1.18703656    0.09816934   -0.05742261    0.02837031    0.01345970
C   -0.83858704    0.63219530   -0.03900420   -0.05267571   -0.01997183    0.01735077
C   -0.77375776   -0.79006361   -0.05547171    0.08776082    0.02525794   -0.03773823
C    0.32750469    1.42409194    0.09208904    0.03658328   -0.04536676   -0.02197109
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C    1.75775882    1.27426685    0.23156674    0.01502065    0.00502207    0.03583355
C    1.69549643   -1.18513883   -0.10064295   -0.04301805   -0.00696066    0.01459991
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C    2.32732104    0.10506986   -0.19251749   -0.01847260    0.02478678   -0.01352381
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   15
   -420.48828021
H   -2.87201084    0.62267214   -0.07514939   -0.05152477   -0.00898692    0.00291495
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O   -2.00784910   -1.17511425    0.10169155   -0.03100352    0.04235042    0.01101275
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C    0.33516916    1.43015802    0.09847416    0.04886697   -0.04034156   -0.01906747
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C    1.68582093   -1.17447223   -0.11242073   -0.04240239   -0.00100690    0.01460917
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C    2.32575403    0.10524184   -0.18617117   -0.02228188    0.03351520   -0.01464824
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   15
   -420.48810711
H   -2.79239289    0.58809266   -0.05502449   -0.01722887    0.00691084    0.00184740
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O   -1.99238367   -1.16511889    0.10472279    0.00705659    0.05775381    0.00624889
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C   -0.80595852   -0.82297937   -0.06829269    0.01954396   -0.01949367   -0.03671571
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C    1.78918409    1.26955462    0.22650881    0.06282143    0.00584107    0.03553739
C    1.67867635   -1.16376310   -0.12507465   -0.03520550    0.00855678    0.01315177
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H    2.42568516    2.10846947    0.31143021   -0.00642658   -0.02186536   -0.00866844
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C    2.32553351    0.10340776   -0.17894017   -0.02584140    0.03808783   -0.01552213
H    3.40554947   -0.08663918   -0.17687494    0.00163491   -0.01605845    0.00551578
   15
   -420.48126615
H   -2.70081841    0.54780524   -0.03604914    0.02281585    0.03304734   -0.00189989
O   -2.07261616    1.24452025   -0.14685593   -0.06063765   -0.02487857   -0.00105342
O   -1.97728101   -1.15774659    0.10747990    0.05613434    0.07375410   -0.00099458
C   -0.83865193    0.65019132   -0.08092893   -0.07452333   -0.01888792    0.01167082
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C    1.79995690    1.26673367    0.22074375    0.07596058   -0.00192750    0.03273794
C    1.67363749   -1.15358728   -0.13851662   -0.02336061    0.02119044    0.01022569
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H    0.39421303   -2.63234652    0.54544849    0.01021723   -0.00386788    0.01598872
H    2.39945488    2.12740635    0.29046889   -0.01255864   -0.02250696   -0.01034363
H    2.36181360   -1.99070134   -0.25781580   -0.00722431   -0.00151167   -0.00761084
C    2.32687776    0.09929476   -0.17077078   -0.02974172    0.03777815   -0.01632807
H    3.39226672   -0.12772350   -0.08739756   -0.00358215   -0.01850209    0.00962061
   15
   -420.47332420
H   -2.62387702    0.48516203   -0.01588088    0.03508564    0.03599265   -0.00277688
O   -2.08268223    1.24363311   -0.14620653   -0.07050061   -0.02086693   -0.00019961
O   -1.96474034   -1.15371382    0.11028761    0.10874161    0.08776817   -0.00962032
C   -0.83003510    0.65835167   -0.09648422   -0.06986134   -0.02263121    0.00907872
C   -0.84190456   -0.85119987   -0.07248916   -0.09226511   -0.06225332   -0.02391357
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   15
   -420.46839985
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   15
   -420.46573397
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   15
   -420.46864805
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   15
   -420.47620737
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O   -1.97392524   -1.17753475    0.12779412    0.07928725    0.04824032   -0.00646397
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C    1.78823044    1.27320024    0.16719110    0.05093515   -0.02338246    0.01356528
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   15
   -420.48308196
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   15
   -420.48597521
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   15
   -420.48537645
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O   -2.07625516    1.19639679   -0.13432812   -0.06885881    0.03407193    0.00347915
O   -2.02126818   -1.22090405    0.14445352   -0.06000560   -0.01160352    0.01402910
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   15
   -420.48275385
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O   -2.03400256   -1.23531750    0.14906303   -0.08240895   -0.02179511    0.01636016
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C    0.31937426    1.55717400    0.18908417   -0.03255363   -0.01851704    0.01908302
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   15
   -420.47872999
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O   -2.04303563   -1.24875052    0.15293573   -0.09469702   -0.02966519    0.01719335
C   -0.71799725    0.76563561   -0.22466604    0.05695914    0.03489533   -0.04789983
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C    0.32506062    1.57486987    0.19465289   -0.01668309    0.00161658    0.02880946
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C    2.40089357    0.03331764   -0.02973161    0.06557951   -0.03207069    0.01205705
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   15
   -420.47605985
H   -2.50049111    0.30673978   -0.03066265    0.01727899    0.03197905   -0.00134601
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O   -2.04780105   -1.26084083    0.15603156   -0.09918671   -0.03660716    0.01714247
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C   -0.75395323   -0.78364173   -0.02147132    0.11978141   -0.01245871   -0.01027934
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C    1.64024823   -1.19854630   -0.25472384   -0.04882928   -0.00269135   -0.04683980
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C    2.39953179    0.03552185   -0.01312743    0.06802767   -0.02260281    0.02139165
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   15
   -420.47656747
H   -2.54694279    0.30162308   -0.04791103   -0.00187142    0.01656541    0.00026646
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O   -2.04808855   -1.27127188    0.15835124   -0.09762937   -0.04302295    0.01660327
C   -0.72389064    0.77807295   -0.23300133    0.03192584    0.04252331   -0.06063890
C   -0.76028265   -0.76610783   -0.01074407    0.10522888    0.00003929   -0.00695378
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C    0.33656605   -1.58991722    0.10913917   -0.03098972    0.00263341    0.03600501
C    1.67389785    1.28701579    0.06940425   -0.07838190    0.01806460   -0.04412741
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H    2.37996892   -2.02037307   -0.30771387    0.00806468    0.00673341    0.00344996
C    2.39407758    0.03908015    0.00218482    0.06615519   -0.01054827    0.03037129
H    3.49649332    0.07726229    0.09832424    0.01539601    0.00684642    0.00725452
   15
   -420.47755434
H   -2.59191373    0.28464215   -0.06527554   -0.02342007   -0.00079183    0.00078704
O   -1.98647347    1.12395648   -0.12807345    0.02226065   -0.04131837    0.01301000
O   -2.04396407   -1.27975362    0.15991872   -0.09129809   -0.04861615    0.01572652
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C   -0.77292718   -0.74859376    0.00040486    0.08086509    0.01599236   -0.00385004
C    0.34371984    1.62405929    0.19936725    0.03556095    0.02024935    0.03830464
C    0.33750185   -1.58511060    0.09597181   -0.01554903   -0.00347749    0.03480880
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   15
   -420.47715525
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   15
   -420.47599003
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   15
   -420.47578446
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O   -2.00883282   -1.29141642    0.16060063   -0.04951780   -0.05122916    0.01027160
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   15
   -420.47816072
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H    2.32967059   -2.14733008   -0.35122768   -0.00272692   -0.00804680    0.00010037
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   15
   -420.48181313
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   15
   -420.48391366
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C    1.67598341    1.24529595    0.06980717    0.02326111   -0.05829465   -0.04089801
C    1.72289448   -1.27430753   -0.17275114    0.05131008   -0.00543700   -0.01724577
H   -0.02885718    2.66810859    0.39790838   -0.00538609   -0.01304086    0.00332866
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   15
   -420.48720636
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C    1.72950588   -1.27994796   -0.15390840    0.06415445   -0.00249824   -0.00930700
H   -0.04497323    2.65839864    0.35763763   -0.00245119   -0.02237962    0.00173316
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   15
   -420.49437713
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O   -1.92428814   -1.27426229    0.15490711    0.08575143    0.01562491   -0.00519426
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C    0.29831563    1.68105216    0.12111890   -0.02080141    0.07277163    0.01035152
C    0.33567324   -1.52783142   -0.06663447   -0.01186226    0.01062068   -0.00309491
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   15
   -420.50191423
H   -2.43705912    0.25234469   -0.16881223    0.01354430   -0.02141691   -0.00303345
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C   -0.86317885   -0.71057881    0.08998470   -0.15488628    0.01553413    0.01705440
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   15
   -420.50684369
H   -2.47260703    0.24385764   -0.17069096   -0.00171332   -0.03421214   -0.00365370
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O   -1.90816948   -1.26720207    0.15335669    0.07596952    0.01463785   -0.00412492
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C   -0.83826288   -0.71891675    0.09598787   -0.11700633    0.00951420    0.01542646
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C    1.67239040    1.26903529    0.12230722    0.01717122   -0.02000433   -0.00071685
C    1.72462465   -1.29592446   -0.09585628    0.06877121   -0.00534586    0.01306726
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C    2.21032558   -0.01627913    0.00229146   -0.05218958   -0.04018443    0.01125591
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   15
   -420.50837889
H   -2.50725300    0.25938147   -0.16997568   -0.01139339   -0.03641626   -0.00368148
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O   -1.90551781   -1.26474158    0.15288325    0.04822277    0.00593853   -0.00293595
C   -0.67840440    0.70684262   -0.00189808    0.10206935   -0.02073184    0.00491435
C   -0.80636886   -0.72783843    0.10106529   -0.05970135    0.00513791    0.01235564
C    0.27622674    1.64672674    0.07316821   -0.05244020   -0.01720918   -0.01778676
C    0.33603763   -1.50914650   -0.13432553   -0.03459789    0.06374383   -0.01170405
C    1.66889678    1.28125690    0.13752543    0.02149911    0.01324914    0.01285176
C    1.71446175   -1.30074979   -0.07750028    0.05462919   -0.00775981    0.02000896
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C    2.20174425   -0.02704017   -0.01010230   -0.04995071   -0.06070103   -0.00051726
H    3.26521794    0.05042677   -0.23618332   -0.00529538    0.00232847   -0.00870853
   15
   -420.50675535
H   -2.53412299    0.30060712   -0.16664523   -0.01377972   -0.02961481   -0.00311422
O   -1.99150418    1.19998081   -0.17631224   -0.02071495    0.03854081   -0.00938128
O   -1.90503714   -1.26255299    0.15254460    0.01585694   -0.00222727   -0.00211379
C   -0.67973648    0.70392073    0.02867116    0.10585174   -0.01528254    0.01304833
C   -0.77090185   -0.73706122    0.10540146    0.00517567   -0.00100982    0.00810079
C    0.27448671    1.63497288    0.05872394   -0.05359944   -0.03168999   -0.02080330
C    0.33969786   -1.50917197   -0.15562756   -0.04161872    0.07668751   -0.01160011
C    1.66411144    1.29268958    0.15197903    0.02389422    0.04387878    0.02401601
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   15
   -420.50248297
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C   -0.68740417    0.70194100    0.05845738    0.09651530   -0.01328677    0.01996919
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   15
   -420.49482432
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   15
   -420.48512036
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O   -1.90303821   -1.25465961    0.15204685   -0.04929194   -0.00869208   -0.00137185
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   15
   -420.47959195
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O   -1.89891523   -1.25125794    0.15201514   -0.05498466   -0.00606710   -0.00125140
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   15
   -420.47831569
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   15
   -420.47743252
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   15
   -420.47699905
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O   -1.87234961   -1.24028404    0.15227684   -0.02845894    0.01173014   -0.00206953
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   15
   -420.47733139
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O   -1.86010364   -1.23726901    0.15252476   -0.00318749    0.02189494   -0.00297502
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C   -0.68581608   -0.78160391    0.13342615    0.07226543   -0.00735557    0.01891036
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C    1.65148934   -1.28921392    0.00854105   -0.04621244   -0.00711078    0.03336380
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   15
   -420.47612640
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   15
   -420.47016504
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C    1.67499988   -1.27219963    0.00601156   -0.00291828    0.03447234    0.03611008
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H    3.30727858   -0.01255260    0.04940893   -0.00740313   -0.00799681    0.00328767
   15
   -420.46152752
H   -2.69392339    0.69818510   -0.05198260    0.04107821    0.03879221   -0.00664231
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C   -0.85770705    0.75817773    0.23509583   -0.08860693   -0.01158375    0.04677773
C   -0.75048510   -0.78406343    0.13278452   -0.06963253   -0.03334969    0.02794574
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C    0.40447136   -1.72611165   -0.33365240    0.00316275   -0.08988163   -0.04979215
C    1.66409305    1.24393799    0.12930046    0.03996362   -0.05278211    0.02404646
C    1.68767022   -1.26617941    0.00150492    0.01410561    0.04874124    0.03481627
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C    2.24057589    0.07574229   -0.00341934   -0.03091410    0.07526731   -0.03328669
H    3.31899597    0.01572816    0.06344790   -0.00630095   -0.00548410    0.00207960
   15
   -420.45704630
H   -2.70862097    0.69900353   -0.03803063    0.02386177    0.02424816   -0.00402533
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O   -1.82699794   -1.24151279    0.15547437    0.14132459    0.07301278   -0.00862883
C   -0.85748960    0.77230246    0.23678470   -0.07734614    0.00525028    0.04316612
C   -0.76761494   -0.78174998    0.12937159   -0.10294499   -0.04027656    0.02861694
C    0.25708440    1.54794704   -0.02089613   -0.00418936    0.01972803   -0.01370980
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C    1.69951004   -1.26306491   -0.00509791    0.02664584    0.05467570    0.03163619
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   15
   -420.45730872
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O   -1.83095695   -1.24957522    0.15702180    0.14050551    0.06914517   -0.00934117
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C   -0.77865558   -0.77705417    0.12423417   -0.10945738   -0.03673439    0.02801848
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   15
   -420.46087727
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C   -0.84451407    0.79824720    0.23257671   -0.02499039    0.05038347    0.03506939
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   15
   -420.46665241
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O   -1.85645365   -1.27424501    0.16134806    0.06843098    0.02898352   -0.00679107
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C    1.65798198    1.24411714    0.05375199    0.01824496   -0.03162305   -0.01149225
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   15
   -420.47242845
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O   -1.87482135   -1.28907710    0.16401187    0.02296527    0.00470685   -0.00370162
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C   -0.77871416   -0.75395830    0.09932722   -0.01163713    0.02243137    0.01691264
C    0.21959628    1.51968779   -0.02611623   -0.09801044   -0.07720776    0.03230803
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C    1.72758701   -1.27974106   -0.04741670    0.02689807    0.01522002    0.00608067
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   15
   -420.47620140
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O   -1.89426046   -1.30413886    0.16684144   -0.01495369   -0.01540964   -0.00006017
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C    0.22212858    1.52005262   -0.03036889   -0.09565948   -0.08674238    0.03576269
C    0.39843061   -1.71749495   -0.32137689   -0.01496968   -0.06804548   -0.03039309
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C    1.72974869   -1.28817476   -0.06004565    0.01141731    0.00334640   -0.00327678
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   15
   -420.47804987
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O   -1.91306148   -1.31852349    0.16967371   -0.04225357   -0.02970920    0.00361320
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C   -0.77089053   -0.74277725    0.07720818    0.04468366    0.05053435    0.00519237
C    0.23035730    1.52557215   -0.03674573   -0.07585377   -0.07823996    0.03160275
C    0.40127880   -1.69738025   -0.31081953   -0.01139162   -0.05670137   -0.02631015
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C    2.33891816    0.03594786    0.14583252    0.05580688   -0.02487198    0.02331429
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   15
   -420.48293196
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O   -1.92998359   -1.33158051    0.17234334   -0.05938326   -0.03859245    0.00696070
C   -0.81172207    0.79417577    0.18653705    0.02953903    0.06902708    0.04032406
C   -0.77025496   -0.74139701    0.06549737    0.05848751    0.05507900   -0.00045837
C    0.24311394    1.53574699   -0.04500658   -0.04427314   -0.05464295    0.02207942
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C    2.34798161    0.02857034    0.16592012    0.06555472   -0.02708972    0.03125219
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   15
   -420.49056424
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C   -0.81145512    0.77874289    0.17096589    0.01287454    0.04630963    0.04577071
C   -0.77311590   -0.74332167    0.05381157    0.06414063    0.05435762   -0.00557168
C    0.25853440    1.54918952   -0.05459447   -0.00981272   -0.02371776    0.01096577
C    0.40878606   -1.64735260   -0.28508034   -0.00252798   -0.04051182   -0.02128397
C    1.63034913    1.26647574   -0.02362075   -0.04717885    0.04919220   -0.04538526
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   15
   -420.49519558
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O   -1.95543494   -1.35228216    0.17661396   -0.07045442   -0.04420453    0.01188432
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C    2.35417952    0.01848409    0.20006743    0.06307960   -0.01785030    0.04211185
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   15
   -420.49797569
H   -2.70124394    0.59073082    0.07464349   -0.02206685   -0.02887834    0.00884629
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O   -1.96344816   -1.35966665    0.17799254   -0.06801080   -0.04235393    0.01321046
C   -0.81248407    0.74099511    0.13132050   -0.00967122   -0.00310784    0.05068776
C   -0.79033884   -0.75666291    0.03170744    0.05751602    0.04045737   -0.01359682
C    0.28937144    1.57875268   -0.07525450    0.04484882    0.02300449   -0.00382370
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C    1.63191417    1.25593355   -0.03831062   -0.06897186    0.01600781   -0.05302529
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C    2.35145660    0.01523363    0.21347189    0.05220545   -0.00981549    0.04472829
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   15
   -420.50196949
H   -2.69823458    0.57933429    0.07892953   -0.02165375   -0.03131386    0.00844942
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O   -1.96838969   -1.36514001    0.17877490   -0.06173651   -0.03766084    0.01368444
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C   -0.80431057   -0.76724463    0.02177284    0.04729786    0.02843161   -0.01617651
C    0.30150574    1.59207865   -0.08542971    0.06026274    0.03271994   -0.00786753
C    0.42034678   -1.55624256   -0.23747158    0.01212960    0.00905255   -0.00851967
C    1.63868789    1.24870097   -0.04093517   -0.06346246    0.00369313   -0.05083846
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H    2.49994298   -2.12201665   -0.13803257    0.00893579    0.00212228    0.00423594
C    2.34559607    0.01257565    0.22418127    0.03738872   -0.00154065    0.04533622
H    3.43418885    0.07883947    0.36418700    0.00963726    0.00031979   -0.00099634
   15
   -420.50624048
H   -2.68027598    0.58983129    0.07728041   -0.01031353   -0.02244742    0.00550388
O   -2.03048231    1.36834310   -0.06517641   -0.00809597    0.06066104   -0.02280196
O   -1.97054399   -1.36891517    0.17893987   -0.05170537   -0.03017068    0.01321273
C   -0.81151578    0.70385459    0.07965421   -0.01551939   -0.04556634    0.04402441
C   -0.82112075   -0.77953146    0.01281012    0.03264218    0.01347199   -0.01744714
C    0.31004587    1.60344210   -0.09513011    0.06567210    0.03905044   -0.01161617
C    0.42310334   -1.52529723   -0.22017029    0.01484564    0.03277156   -0.00391143
C    1.64924520    1.24122068   -0.04050365   -0.04712641   -0.00377621   -0.04497114
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   15
   -420.50684031
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O   -1.97036835   -1.37133111    0.17850935   -0.03737577   -0.02011405    0.01167101
C   -0.80968553    0.68879384    0.04970226   -0.01384360   -0.06095021    0.03683318
C   -0.83988036   -0.79261918    0.00489441    0.01302821   -0.00428959   -0.01707724
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   15
   -420.50126947
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O   -1.96851444   -1.37284209    0.17755357   -0.01841634   -0.00805875    0.00899550
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C   -0.85940130   -0.80543512   -0.00199786   -0.01183935   -0.02448310   -0.01483414
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   15
   -420.49379539
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C   -0.80387202    0.67025769   -0.01631345   -0.00026047   -0.07513957    0.01746401
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C    1.69187410    1.22059532   -0.02500220    0.02616489   -0.01094150   -0.01898255
C    1.80590366   -1.27578494   -0.12224852    0.04649304   -0.01657184   -0.00365044
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   15
   -420.48696943
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O   -1.96334357   -1.37535298    0.17459103    0.02612821    0.01638689    0.00143269
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C    0.30989600    1.62040873   -0.12517487    0.01039346    0.07456446   -0.01712256
C    0.42439457   -1.43053573   -0.15030714    0.01873712    0.06685321    0.00478442
C    1.70486484    1.21483726   -0.01683718    0.03889404   -0.02101097   -0.01097174
C    1.81322509   -1.26017671   -0.12219286    0.06574301    0.00226029    0.00321389
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H    2.30924388    2.10045634   -0.04620873   -0.01608705   -0.00450516   -0.00999201
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C    2.30228606   -0.00490767    0.24009795   -0.03979881   -0.00045203    0.02129668
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   15
   -420.47790486
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O   -2.02352030    1.33734646    0.01994720   -0.00835326    0.03637143    0.00389729
O   -1.96201048   -1.37744321    0.17292063    0.04193380    0.02378101   -0.00166058
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C   -0.90670201   -0.82993969   -0.01836789   -0.08974589   -0.08044881   -0.00082661
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C    0.42199043   -1.41667258   -0.13333016    0.01864746    0.06170808    0.00634247
C    1.71554999    1.21035993   -0.00800890    0.04244445   -0.03295084   -0.00297755
C    1.81658234   -1.24468257   -0.12231821    0.08262438    0.01661948    0.00744095
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C    2.29737442   -0.00936141    0.23780174   -0.05159502   -0.01157428    0.01277361
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   15
   -420.46956534
H   -2.76057508    0.60536373    0.06655444   -0.03340147   -0.02414201   -0.00016390
O   -2.01757262    1.32816970    0.03701715    0.00956481    0.03988034    0.00760285
O   -1.96253440   -1.38058664    0.17131791    0.04580340    0.02435193   -0.00273559
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C   -0.91353651   -0.82973142   -0.02331928   -0.09628764   -0.08623956    0.00239716
C    0.30157072    1.60452224   -0.13410774   -0.02441961    0.07449626   -0.01150063
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C    1.72369581    1.20784849    0.00100249    0.04043763   -0.03972654    0.00438650
C    1.81496492   -1.23015906   -0.12287516    0.09500390    0.02420070    0.00804699
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C    2.29556923   -0.01310555    0.23473241   -0.06058031   -0.02457209    0.00440136
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   15
   -420.46735617
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O   -1.96508458   -1.38480565    0.16982962    0.03607531    0.01724515   -0.00128276
C   -0.79732392    0.68415571   -0.15545389    0.03424904   -0.03824199   -0.02671810
C   -0.91463080   -0.82436047   -0.02840347   -0.08649246   -0.08158146    0.00326107
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H    2.25826666   -2.10174429   -0.52393984   -0.02543974    0.00579806   -0.01366749
C    2.29740342   -0.01536706    0.23138949   -0.06467359   -0.03686757   -0.00247905
H    3.30739890   -0.01298555    0.63976286   -0.00876463   -0.00523938    0.01195077
   15
   -420.47178431
H   -2.75600649    0.63171914    0.07145108   -0.02404372   -0.00786527   -0.00035389
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O   -1.96923295   -1.38978424    0.16839183    0.01616754    0.00412520    0.00218839
C   -0.79983185    0.69544762   -0.18783532    0.03525265   -0.02027136   -0.03610554
C   -0.91055985   -0.81410130   -0.03367480   -0.06370583   -0.06786243    0.00215221
C    0.29882659    1.57149990   -0.14014905   -0.04354471    0.03475991   -0.01003917
C    0.40816486   -1.39687966   -0.08525890    0.01661540    0.06331156    0.01464291
C    1.73292754    1.20977988    0.01792143    0.03181830   -0.02719550    0.01303595
C    1.79430709   -1.20549665   -0.12525479    0.09417950    0.02444914    0.00206750
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   15
   -420.47765732
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C   -0.90266779   -0.79976669   -0.03907171   -0.03455010   -0.04836901    0.00012598
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C    0.40148750   -1.39765549   -0.07074602    0.01566444    0.06929817    0.01856052
C    1.73451859    1.21347826    0.02531047    0.02848147   -0.01042123    0.01345151
C    1.77535646   -1.19541873   -0.12674098    0.07330649    0.02573355    0.00017286
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C    2.31252314   -0.01274120    0.22534592   -0.05101408   -0.04838507   -0.00667856
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   15
   -420.48037111
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O   -1.97862865   -1.39956071    0.16501778   -0.02946064   -0.02745425    0.01054222
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C   -0.89268415   -0.78251862   -0.04447684   -0.00570443   -0.02643215   -0.00181110
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C    1.73438133    1.21779407    0.03189658    0.02617031    0.00879644    0.01178408
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C    2.32498141   -0.00717293    0.22289513   -0.03309142   -0.04454622   -0.00320305
H    3.33255428    0.03623102    0.64003416   -0.00572681    0.00484046    0.01396134
   15
   -420.48246458
H   -2.68996188    0.65398180    0.07827163    0.02826848    0.03843793    0.00192988
O   -1.99018750    1.27183839    0.11435031   -0.02401760   -0.05855152    0.01751272
O   -1.98184143   -1.40294467    0.16270912   -0.04575812   -0.04091225    0.01366116
C   -0.81894096    0.73235160   -0.27003382    0.01208211    0.02972219   -0.05637257
C   -0.88233025   -0.76367280   -0.04977570    0.01818456   -0.00423717   -0.00312685
C    0.31395184    1.50982804   -0.14483387   -0.03516915   -0.02510004   -0.00435263
C    0.38533360   -1.41189827   -0.04531504    0.01460383    0.06923262    0.02564051
C    1.73266926    1.22159545    0.03777407    0.02212163    0.02442687    0.00928142
C    1.72643488   -1.18003313   -0.12965803   -0.00298560    0.02540159   -0.00457393
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H    2.40174983   -2.00145639   -0.45893827    0.01268264   -0.00325073   -0.01554352
C    2.33941970    0.00106123    0.22062485   -0.01099409   -0.03514523    0.00286763
H    3.34952035    0.04875751    0.61989470   -0.00652990    0.00695717    0.01230486
   15
   -420.48327958
H   -2.70198625    0.61169114    0.07852320   -0.00185444    0.01156584    0.00008349
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O   -1.98300301   -1.40448336    0.15978475   -0.05547155   -0.05145304    0.01566085
C   -0.82762080    0.74231458   -0.29108923   -0.00292434    0.04140272   -0.06048465
C   -0.87304104   -0.74456683   -0.05488880    0.03514064    0.01721714   -0.00378261
C    0.32376222    1.49096816   -0.14563452   -0.02099802   -0.03236455    0.00073989
C    0.37592210   -1.42533978   -0.03482144    0.01430593    0.05888603    0.02803874
C    1.72965269    1.22397266    0.04308858    0.01156304    0.02958677    0.00702466
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   15
   -420.48009829
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O   -1.97507613    1.26056193    0.13993146    0.04577226   -0.01776125    0.02243957
O   -1.98167071   -1.40369893    0.15615377   -0.05906125   -0.05898656    0.01658582
C   -0.83611947    0.74979185   -0.30849145   -0.01882542    0.04944290   -0.06361983
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   15
   -420.47578746
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O   -1.97767766   -1.40024960    0.15177373   -0.05752123   -0.06349021    0.01656231
C   -0.84348439    0.75429827   -0.32205033   -0.03377756    0.05362108   -0.06590206
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C    1.72270832    1.22405258    0.05258467   -0.02639141    0.00306937    0.00153498
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C    2.38184826    0.03542265    0.21116209    0.03717807    0.00251305    0.02025001
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   15
   -420.47328986
H   -2.67674820    0.49016276    0.08623711   -0.02781603   -0.02362804   -0.00618422
O   -1.96725657    1.25309118    0.16145615    0.05870739   -0.00764634    0.02684220
O   -1.97109075   -1.39393169    0.14664540   -0.05165857   -0.06471584    0.01567096
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C   -0.85979070   -0.69825576   -0.06883818    0.04773812    0.07212315   -0.00356470
C    0.35609704    1.44658620   -0.14972239    0.03893210   -0.03865347    0.01747399
C    0.34316180   -1.48246926   -0.01383264    0.00025416    0.00046478    0.03148451
C    1.72100440    1.22330394    0.05710342   -0.04007797   -0.01809609   -0.00265318
C    1.64553076   -1.16234158   -0.12844300   -0.08058066   -0.01468349   -0.03259253
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C    2.39248008    0.04757934    0.20596296    0.03944506    0.01361142    0.02332090
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   15
   -420.47281325
H   -2.62747858    0.47919858    0.09606002   -0.01037147   -0.01457386   -0.00674573
O   -1.96728910    1.24994123    0.17043908    0.04487939   -0.01499671    0.02830149
O   -1.96217543   -1.38469158    0.14080932   -0.04160109   -0.06215278    0.01389234
C   -0.85136820    0.75362138   -0.33713965   -0.05525262    0.05042602   -0.06779710
C   -0.86109900   -0.69016743   -0.07303881    0.04147378    0.08402270   -0.00294519
C    0.36384347    1.43629762   -0.15276611    0.05575568   -0.04218488    0.02169045
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C    1.72167156    1.22363587    0.06178222   -0.04331948   -0.03663583   -0.00674152
C    1.63658390   -1.15732366   -0.12429263   -0.06396545   -0.02172138   -0.03677990
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H    0.22256418   -2.56301364   -0.11076063    0.01614355    0.01090793   -0.00451878
H    2.38688288    2.13605728    0.17983024    0.02433087    0.01342002    0.00123915
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C    2.40075086    0.05891765    0.19935731    0.03682262    0.02370922    0.02559440
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   15
   -420.47303446
H   -2.57124725    0.47809594    0.11068373    0.01509896    0.00452095   -0.00646294
O   -1.96931816    1.24750524    0.17813937    0.02093980   -0.03074326    0.02940092
O   -1.95139126   -1.37264775    0.13434670   -0.02649357   -0.05522806    0.01109667
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C   -0.86488884   -0.68713055   -0.07706408    0.02981135    0.08988214   -0.00176903
C    0.36825413    1.42855394   -0.15711499    0.06537243   -0.04449875    0.02459395
C    0.32076825   -1.52319984   -0.00927332   -0.01934862   -0.02147275    0.03347190
C    1.72490311    1.22615136    0.06686204   -0.03555884   -0.04879955   -0.00948122
C    1.63149194   -1.15103540   -0.11793458   -0.04463765   -0.02001225   -0.03773010
H    0.01166152    2.47166182   -0.19294282   -0.01837226   -0.00385643   -0.00886623
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C    2.40680385    0.06882888    0.19120633    0.03239092    0.03237377    0.02734123
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   15
   -420.47392774
H   -2.52565435    0.47371098    0.12997041    0.03620773    0.02316290   -0.00633765
O   -1.97229961    1.24646034    0.18450321   -0.00194129   -0.04457783    0.03117802
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C   -0.84629387    0.74101560   -0.33589423   -0.05630041    0.03446890   -0.06649033
C   -0.87044781   -0.68948925   -0.08098702    0.01136152    0.08768095    0.00033820
C    0.36875948    1.42348613   -0.16294206    0.06539116   -0.04388804    0.02567660
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C    1.73023988    1.23157248    0.07250348   -0.01881620   -0.05187504   -0.00985809
C    1.62913764   -1.14361126   -0.10930585   -0.03225632   -0.00397829   -0.03648747
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C    2.41089313    0.07679579    0.18140563    0.02882228    0.03834015    0.02832369
H    3.50431225    0.00165130    0.29885183    0.01324346   -0.00141456   -0.00217385
   15
   -420.47638055
H   -2.50486158    0.45398783    0.15387920    0.03713232    0.02068541   -0.00700083
O   -1.97525755    1.24735006    0.18944638   -0.00876602   -0.03633782    0.03436130
O   -1.92728180   -1.34163509    0.12010817    0.02482548   -0.02642974    0.00159471
C   -0.83861985    0.73131952   -0.32921403   -0.04586508    0.02495279   -0.06510610
C   -0.87665252   -0.69710288   -0.08493695   -0.01525199    0.07598456    0.00373809
C    0.36536046    1.42105717   -0.17031108    0.05544381   -0.04025153    0.02457610
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C    1.73668933    1.24007816    0.07872604    0.00290872   -0.04454221   -0.00724787
C    1.62876585   -1.13600336   -0.09847270   -0.02592672    0.02297071   -0.03467460
H    0.00008695    2.46081178   -0.26205833   -0.01897014   -0.00304825   -0.01247622
H    0.14819887   -2.65540080   -0.06680067    0.00468599   -0.01703714   -0.00582758
H    2.16167114    2.22530724    0.34425897   -0.00897996    0.01255735    0.00699821
H    2.29503635   -1.99187745   -0.01923474   -0.00292248    0.00568867    0.00685444
C    2.41322730    0.08246476    0.16989816    0.02756307    0.04018340    0.02808094
H    3.50145954   -0.01298867    0.24395901    0.00828792   -0.00282043   -0.00562428
   15
   -420.47719738
H   -2.50974354    0.42062957    0.18275570    0.02085534   -0.00176483   -0.00647357
O   -1.97787004    1.24980751    0.19283360   -0.00225124   -0.00769720    0.03676416
O   -1.91628695   -1.32397164    0.11276430    0.06132737   -0.00501516   -0.00528381
C   -0.82820570    0.72011026   -0.31859887   -0.02881186    0.01618975   -0.06319708
C   -0.88189823   -0.70926545   -0.08911941   -0.04893014    0.05513476    0.00838743
C    0.35864912    1.42105348   -0.17915526    0.03744457   -0.03484932    0.02123952
C    0.29692101   -1.57402993   -0.01737517   -0.03831774   -0.03968707    0.02879412
C    1.74296521    1.25123399    0.08537299    0.02419045   -0.02873079   -0.00192751
C    1.62995834   -1.12978385   -0.08554509   -0.01917269    0.04995089   -0.03232061
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H    2.26517976   -2.04363812    0.02718832    0.00091871   -0.01422065    0.00863394
C    2.41388322    0.08572750    0.15670003    0.02845983    0.03730180    0.02632003
H    3.49277133   -0.02564279    0.19308041    0.00120077   -0.00348322   -0.00851561
   15
   -420.47390368
H   -2.52956367    0.38843346    0.21613224    0.00263715   -0.02329153   -0.00336807
O   -1.98037674    1.25262108    0.19456345    0.00392719    0.01998509    0.03646427
O   -1.90808120   -1.30608671    0.10566211    0.09928448    0.01785340   -0.01261712
C   -0.81606550    0.70791649   -0.30416695   -0.00851841    0.00848449   -0.06023241
C   -0.88417901   -0.72473360   -0.09381078   -0.08346307    0.02866697    0.01330995
C    0.34969530    1.42316044   -0.18927427    0.01504952   -0.03006952    0.01596915
C    0.29320639   -1.58670788   -0.02375670   -0.04079764   -0.04755379    0.02488864
C    1.74780620    1.26411615    0.09213181    0.03998917   -0.01071140    0.00426591
C    1.63229491   -1.12654272   -0.07066933   -0.00952241    0.06870009   -0.02869071
H    0.04006997    2.46065336   -0.29640005   -0.00735276   -0.00921477   -0.01148588
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H    2.23493151   -2.08556700    0.06742413    0.00036745   -0.02754416    0.00991167
C    2.41281622    0.08675414    0.14191743    0.02965820    0.03049866    0.02310289
H    3.48317323   -0.03581290    0.14827647   -0.00509772   -0.00373014   -0.01053684
   15
   -420.47058197
H   -2.55163938    0.37234004    0.25185187   -0.00987638   -0.03408012    0.00112239
O   -1.98303891    1.25457253    0.19464722    0.00430520    0.03625767    0.03392186
O   -1.90434609   -1.28899668    0.09912646    0.12803227    0.03665711   -0.01833222
C   -0.80340455    0.69520546   -0.28610005    0.01070583    0.00160229   -0.05572362
C   -0.88146507   -0.74194088   -0.09929852   -0.10730683    0.00327396    0.01649465
C    0.33983117    1.42710302   -0.20035288   -0.00737324   -0.02868369    0.00942996
C    0.29195316   -1.59651535   -0.03164091   -0.04206554   -0.05423535    0.02045698
C    1.75026866    1.27767087    0.09864226    0.04794556    0.00268677    0.00866084
C    1.63519999   -1.12739864   -0.05406676    0.00161649    0.07592826   -0.02340229
H    0.07038029    2.46921754   -0.30086337    0.00006742   -0.01070116   -0.00981329
H    0.04384658   -2.66284316    0.01177333   -0.00811319   -0.00649155   -0.00242375
H    1.99015426    2.24921709    0.47166001   -0.03482678   -0.00814239    0.00267491
H    2.20466419   -2.10820736    0.10059764   -0.00435634   -0.03171292    0.00991146
C    2.40996626    0.08594676    0.12574294    0.02880640    0.02159921    0.01881875
H    3.47701270   -0.04329249    0.11101229   -0.00758653   -0.00401420   -0.01177507
   15
   -420.47236960
H   -2.56702060    0.38016307    0.28678780   -0.01528167   -0.03429639    0.00524015
O   -1.98587596    1.25492206    0.19319582   -0.00088029    0.04092270    0.03034196
O   -1.90634008   -1.27353373    0.09340692    0.13578504    0.04599752   -0.01996472
C   -0.79136717    0.68239552   -0.26467126    0.02525426   -0.00489837   -0.04959150
C   -0.87237847   -0.75938442   -0.10576408   -0.10808753   -0.01469969    0.01578022
C    0.33039387    1.43280518   -0.21199830   -0.02598863   -0.03209697    0.00223702
C    0.29323910   -1.60306651   -0.04076073   -0.04241831   -0.05618081    0.01566369
C    1.74986748    1.29109466    0.10464359    0.04872990    0.01005966    0.01026014
C    1.63800933   -1.13278170   -0.03605753    0.01240466    0.07013955   -0.01636178
H    0.10069287    2.48524994   -0.29826799    0.00670395   -0.00831814   -0.00792396
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H    1.97789031    2.26536644    0.50948731   -0.03334018   -0.00070196    0.00624967
H    2.17772425   -2.10859844    0.12673425   -0.01235387   -0.02599756    0.00822438
C    2.40538862    0.08383435    0.10843327    0.02518838    0.01242524    0.01392265
H    3.47601750   -0.04786410    0.08219379   -0.00521133   -0.00454059   -0.01243358
   15
   -420.47914650
H   -2.57188885    0.41205908    0.31806856   -0.01234289   -0.02386856    0.00738256
O   -1.98865051    1.25345796    0.19036604   -0.01222418    0.03393810    0.02726814
O   -1.91439668   -1.26011711    0.08857373    0.11790306    0.04475607   -0.01652546
C   -0.78082370    0.66988260   -0.24025000    0.03320289   -0.01155474   -0.04210674
C   -0.85689736   -0.77598408   -0.11316031   -0.08097007   -0.02391886    0.01044253
C    0.32249650    1.44046439   -0.22377752   -0.03832859   -0.03855406   -0.00527900
C    0.29708583   -1.60626392   -0.05082418   -0.04189722   -0.04948538    0.01013730
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C    1.64007611   -1.14233764   -0.01706799    0.02161276    0.05077324   -0.00751329
H    0.12626510    2.50705457   -0.28996701    0.01189692   -0.00247220   -0.00596874
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   15
   -420.48600996
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   15
   -420.48944685
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O   -1.94472578   -1.23897304    0.08080074    0.03847352    0.02832339   -0.00118894
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   15
   -420.49187771
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O   -1.96348477   -1.23053432    0.07718340    0.00044029    0.02200199    0.00594496
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C   -0.79336901   -0.81607008   -0.13696365    0.06852906   -0.03880637   -0.01608622
C    0.31333559    1.47834153   -0.25526305   -0.03477802   -0.03880912   -0.02966107
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C    1.72260833    1.33518327    0.12205735    0.01686021    0.04018132    0.01853600
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H    0.14286227    2.56617462   -0.24521870    0.01788884    0.00909706    0.00005145
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   15
   -420.49384273
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O   -1.98229939   -1.22310549    0.07330371   -0.02830606    0.01870674    0.01116386
C   -0.75788991    0.63126713   -0.12261977    0.01599168   -0.04025626   -0.00197297
C   -0.77643249   -0.82518010   -0.14366853    0.10177554   -0.04400379   -0.02325723
C    0.31489939    1.49593630   -0.26283871   -0.02433561   -0.02775591   -0.03747508
C    0.33645275   -1.60127520   -0.09274436   -0.02431695    0.03460977   -0.01925546
C    1.71179949    1.34151850    0.12414042    0.00771452    0.04957575    0.02444255
C    1.63621763   -1.19650396    0.05805782   -0.03488187   -0.00530492    0.01769044
H    0.12356375    2.57469688   -0.22848700    0.01668833    0.00612817    0.00156188
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H    2.29319154   -2.04968208    0.22019069   -0.00508068   -0.00157755    0.00007950
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   15
   -420.49121252
H   -2.63643005    0.53475224    0.42828360   -0.01642262    0.00105336    0.01435218
O   -1.97816115    1.23964098    0.15789956   -0.02825141    0.01449492    0.00439702
O   -1.99986510   -1.21653350    0.06892432   -0.04768159    0.01754943    0.01458079
C   -0.75565064    0.62664865   -0.09125796    0.00717516   -0.04514849    0.01026636
C   -0.76556766   -0.83164581   -0.14897308    0.11844366   -0.04587716   -0.02919179
C    0.31792484    1.51519594   -0.26815322   -0.01185491   -0.01393753   -0.04425909
C    0.35097762   -1.60199556   -0.10140460   -0.01157180    0.04426067   -0.02312756
C    1.70051982    1.34487129    0.12474505   -0.00064165    0.05581288    0.03036975
C    1.63645252   -1.20976565    0.07471614   -0.06700537   -0.00584374    0.01936649
H    0.09233260    2.57891383   -0.21285795    0.01402927    0.00129347    0.00266403
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C    2.35064592    0.06930053   -0.00068532    0.03417225   -0.00922650   -0.02433056
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   15
   -420.48610093
H   -2.65784775    0.52276966    0.43660449   -0.03139957   -0.01109909    0.02063438
O   -1.96986659    1.23706004    0.14903679   -0.01080422    0.02495806   -0.00661577
O   -2.01529554   -1.21076127    0.06388819   -0.05951598    0.01733325    0.01670078
C   -0.75384338    0.62475021   -0.06051771   -0.00203912   -0.04794958    0.02263047
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C    0.32166005    1.53530201   -0.27079823    0.00200468   -0.00079995   -0.04963417
C    0.36619170   -1.60533902   -0.10867925    0.00322853    0.04334678   -0.02443587
C    1.68927908    1.34487725    0.12352006   -0.00902586    0.05644570    0.03496548
C    1.64067898   -1.22264103    0.09019824   -0.08724400   -0.01269892    0.02200232
H    0.05109230    2.58214795   -0.19911680    0.00984033   -0.00270337    0.00341732
H    0.09957875   -2.61422806    0.21453901   -0.00523515    0.00501406    0.01198241
H    2.31807586    2.16418983    0.49136231    0.00706447   -0.00275273    0.01370600
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C    2.33606240    0.06865226   -0.01611618    0.03690487   -0.00506655   -0.03071677
H    3.41209494    0.01387041    0.10821443   -0.00113221   -0.00158325   -0.00406819
   15
   -420.48381468
H   -2.65742332    0.51817120    0.43038478   -0.03355648   -0.01301784    0.02166295
O   -1.96104836    1.23338867    0.14045633   -0.00221216    0.02422875   -0.01292523
O   -2.02804645   -1.20577579    0.05809740   -0.06571918    0.01721669    0.01799052
C   -0.75191104    0.62573953   -0.03114294   -0.01159504   -0.04833645    0.03436624
C   -0.76518610   -0.83650473   -0.15400482    0.10859981   -0.03545020   -0.03796756
C    0.32526960    1.55547356   -0.27044892    0.01675433    0.00897041   -0.05351384
C    0.38121709   -1.61126302   -0.11448355    0.01675738    0.03437812   -0.02430758
C    1.67858758    1.34150297    0.12018978   -0.01799086    0.05049091    0.03773430
C    1.65009694   -1.23472691    0.10434252   -0.09056736   -0.02389155    0.02604225
H    0.00286989    2.58714936   -0.18782611    0.00397740   -0.00367230    0.00407529
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H    2.37561302    2.12526721    0.43981766    0.01196697   -0.00671617    0.01151711
H    2.46031674   -2.03202823    0.27568821    0.03124107   -0.01601135    0.00316313
C    2.31927781    0.06830451   -0.02969018    0.03361239    0.00030488   -0.03692831
H    3.39044734    0.03176861    0.13355633   -0.00208388   -0.00121434   -0.00182101
   15
   -420.48542637
H   -2.63358552    0.52240944    0.40886889   -0.02306247   -0.00571808    0.01757339
O   -1.95209812    1.22865598    0.13244421   -0.00215724    0.01326548   -0.01440274
O   -2.03783216   -1.20157058    0.05149239   -0.06743128    0.01688361    0.01869798
C   -0.74927689    0.62964007   -0.00383969   -0.02122440   -0.04634132    0.04470727
C   -0.77510842   -0.83551770   -0.15320212    0.08884076   -0.02523415   -0.04065469
C    0.32786678    1.57512131   -0.26687062    0.03128418    0.01513302   -0.05589827
C    0.39524927   -1.61925323   -0.11881571    0.02631225    0.02283531   -0.02455733
C    1.66898234    1.33510299    0.11458315   -0.02647057    0.03899759    0.03930017
C    1.66489537   -1.24535440    0.11690350   -0.07458933   -0.03786019    0.03173113
H   -0.04812890    2.59460892   -0.17946973   -0.00332187   -0.00160974    0.00470636
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H    2.47779965   -2.00260904    0.28978367    0.02467370   -0.00507220    0.00128600
C    2.30049388    0.06793598   -0.04103142    0.02381720    0.00607793   -0.04301680
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   15
   -420.48685604
H   -2.59385107    0.53018662    0.37495796   -0.00100062    0.01099405    0.00930350
O   -1.94301740    1.22336060    0.12506849   -0.01043303   -0.00785273   -0.01149538
O   -2.04457426   -1.19813087    0.04404122   -0.06484193    0.01643676    0.01878575
C   -0.74536314    0.63633321    0.02077047   -0.02997724   -0.04233557    0.05289807
C   -0.79037519   -0.83300709   -0.14994797    0.06329854   -0.01448404   -0.04187488
C    0.32858467    1.59386171   -0.25991930    0.04324094    0.01971522   -0.05676373
C    0.40771459   -1.62864100   -0.12165403    0.03104377    0.01437172   -0.02641943
C    1.66096205    1.32636135    0.10660060   -0.03173281    0.02410910    0.04064716
C    1.68411039   -1.25368140    0.12753734   -0.04009270   -0.05378600    0.03897337
H   -0.09671887    2.60317396   -0.17448871   -0.01085960    0.00136529    0.00510264
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H    2.47815209   -1.96994490    0.30305592    0.00770444    0.01247997   -0.00225049
C    2.28029339    0.06720094   -0.04977341    0.00932029    0.01163728   -0.04859777
H    3.34991866    0.06991332    0.18600634    0.00261203   -0.00023455    0.00436276
   15
   -420.48511261
H   -2.55356302    0.52984099    0.33434515    0.02305906    0.03020585    0.00130985
O   -1.93345758    1.21843592    0.11821143   -0.01939868   -0.03192108   -0.00801984
O   -2.04839226   -1.19543775    0.03574091   -0.05742515    0.01621796    0.01801056
C   -0.73965037    0.64557864    0.04219564   -0.03589970   -0.03668068    0.05825499
C   -0.80944917   -0.82961374   -0.14417019    0.03348559   -0.00508155   -0.04132920
C    0.32671534    1.61140589   -0.24954302    0.04960981    0.02499881   -0.05604299
C    0.41832176   -1.63892415   -0.12288891    0.03191558    0.01092718   -0.02932400
C    1.65483047    1.31616880    0.09615777   -0.03098363    0.00776936    0.04233822
C    1.70570077   -1.25876957    0.13581409    0.00360134   -0.06634809    0.04606714
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   15
   -420.48453566
H   -2.52874547    0.50880000    0.29234672    0.02902679    0.03240429    0.00020622
O   -1.92308489    1.21489375    0.11174188   -0.01135500   -0.03921259   -0.01020909
O   -2.04962536   -1.19348281    0.02662738   -0.04451336    0.01659994    0.01617571
C   -0.73179367    0.65703450    0.06011429   -0.03641040   -0.02940705    0.06030282
C   -0.83052894   -0.82590046   -0.13590259   -0.00020664    0.00179873   -0.03886211
C    0.32188622    1.62742925   -0.23578579    0.04798694    0.03198051   -0.05366298
C    0.42700864   -1.64988149   -0.12235475    0.03076291    0.01013301   -0.03137344
C    1.65053620    1.30550634    0.08315290   -0.02301763   -0.00855493    0.04423660
C    1.72712814   -1.25992970    0.14132762    0.03674267   -0.06224536    0.04860938
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H    2.48499513    2.02561663    0.16654433    0.02231750   -0.01080886    0.00106182
H    2.47723989   -1.94418531    0.33736754   -0.02249279    0.03636794   -0.00757969
C    2.23921818    0.06334161   -0.05819925   -0.02329413    0.01969638   -0.05511447
H    3.30303818    0.10843495    0.22614519    0.00313885    0.00186851    0.00960616
   15
   -420.48735306
H   -2.52344659    0.46586512    0.24986784    0.01319948    0.01206338    0.00427373
O   -1.91227295    1.21303971    0.10575116    0.01552428   -0.02381464   -0.01626159
O   -2.04885922   -1.19228358    0.01678341   -0.02625357    0.01761406    0.01341091
C   -0.72177239    0.67025977    0.07440261   -0.02953422   -0.02031776    0.05903323
C   -0.85157889   -0.82228103   -0.12529356   -0.03725497    0.00571930   -0.03464403
C    0.31419836    1.64151294   -0.21879150    0.03776576    0.03997262   -0.04960999
C    0.43383742   -1.66144663   -0.11993464    0.02905337    0.00835924   -0.03118003
C    1.64760274    1.29535454    0.06747474   -0.00897058   -0.02353739    0.04567693
C    1.74644819   -1.25745022    0.14394268    0.04838172   -0.03441224    0.04327435
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H    0.30761628   -2.74337431    0.09344294    0.01094421   -0.01140978    0.01132446
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   15
   -420.48697520
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C    0.30426237    1.65318562   -0.19880508    0.02045432    0.04657483   -0.04392246
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   15
   -420.48221246
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O   -2.04474006   -1.19233784   -0.00459038    0.01458474    0.01948065    0.00782816
C   -0.69733702    0.69969919    0.09256101    0.00441921    0.00378762    0.04836110
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   15
   -420.47856555
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O   -2.04319597   -1.19366930   -0.01587229    0.02568833    0.01840915    0.00642603
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C    1.63822430    1.27614546    0.00396363    0.02943328   -0.04988575    0.04102657
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   15
   -420.48005995
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O   -2.04276732   -1.19582582   -0.02744883    0.02368848    0.01465276    0.00584001
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C    0.27223588    1.67174674   -0.12482061   -0.04171080    0.02333353   -0.01711382
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C    1.63235693    1.27525312   -0.02238379    0.02947086   -0.04987854    0.03577930
C    1.79299696   -1.24885527    0.13461938    0.07025220    0.07327134    0.00728124
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   15
   -420.48556546
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O   -2.04336371   -1.19863752   -0.03928990    0.00865972    0.00835308    0.00514486
C   -0.66625145    0.73959012    0.09938502    0.06493281    0.04974721    0.02152670
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C    1.62474023    1.27734781   -0.05088445    0.02296865   -0.04402598    0.02841115
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C    2.17012660    0.03349663   -0.00968180   -0.06762704   -0.03467322   -0.02765997
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   15
   -420.49016050
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O   -2.04432285   -1.20182371   -0.05136068   -0.01434695    0.00081385    0.00351256
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C    0.26113243    1.67611590   -0.06939091   -0.06639639   -0.01563944    0.00481031
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C    1.79256273   -1.26524157    0.12516473    0.09328980    0.03557186    0.00703008
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   15
   -420.49189356
H   -2.41058826    0.42506947   -0.09332105    0.03455944    0.02530999   -0.00109976
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O   -2.04462742   -1.20504861   -0.06358685   -0.03840461   -0.00628943    0.00085418
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C    0.26126598    1.67912209   -0.04177901   -0.06723403   -0.02347915    0.01313982
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C    1.78427156   -1.27742445    0.11984103    0.09861091   -0.00029228    0.00886898
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H    2.25652824    2.14620316   -0.34496846   -0.00560741    0.01202474   -0.00673857
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   15
   -420.49586042
H   -2.41571997    0.43868991   -0.13609928    0.03374438    0.02856783   -0.00080354
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O   -2.04320602   -1.20799456   -0.07584996   -0.05821658   -0.01169229   -0.00229013
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C   -0.82269779   -0.81424319    0.00832948   -0.03078037    0.02470686    0.00992645
C    0.26541963    1.68348398   -0.01494664   -0.05898117   -0.01868763    0.01851408
C    0.43234646   -1.72803927   -0.05144004    0.03363634   -0.03210243    0.00269905
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C    1.77013301   -1.28966066    0.11401472    0.08137442   -0.02290157    0.00436517
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   15
   -420.50117734
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C    0.27310280    1.68892192    0.01077847   -0.04330029   -0.00327570    0.02147067
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C    1.75120390   -1.30061110    0.10795709    0.03928979   -0.02686035   -0.00623209
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H    2.49934033   -2.01934365    0.34091855   -0.01231812    0.01533763    0.00673640
C    2.19684485    0.03953870    0.05943823   -0.02522069   -0.02650240    0.01233668
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   15
   -420.49961794
H   -2.48330411    0.41907768   -0.21379210   -0.00547749   -0.00585324   -0.01674201
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C   -0.76895090   -0.82372477    0.04309788    0.02977092    0.01011988    0.02313754
C    0.28338297    1.69453646    0.03521006   -0.02327567    0.01632689    0.02344351
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C    1.58025753    1.31021480   -0.20600329   -0.03699133    0.03427749   -0.03021943
C    1.72992652   -1.30995747    0.10227042   -0.00874000   -0.02618081   -0.01591328
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C    2.20966591    0.04615079    0.07651994   -0.00506084   -0.01425837    0.02325671
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   15
   -420.49131003
H   -2.51907173    0.40878643   -0.23792162   -0.01909064   -0.01439518   -0.02241565
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C    0.40284773   -1.72184220   -0.02039581    0.03425450   -0.01292320    0.01181190
C    1.57520920    1.31449825   -0.23453888   -0.04718458    0.04262864   -0.04008583
C    1.70912285   -1.31769855    0.09752204   -0.04638098   -0.02938684   -0.02098122
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C    2.22279803    0.05362474    0.09220187    0.01408862   -0.00189129    0.03286164
H    3.30570711    0.10535263   -0.01345360    0.00001726    0.00176773   -0.00351054
   15
   -420.48254876
H   -2.54161117    0.40845444   -0.24616562   -0.02400842   -0.01602781   -0.02384118
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O   -2.00669510   -1.21359866   -0.12256923   -0.07800414   -0.01213497   -0.01264625
C   -0.71899343    0.72975962    0.08765695   -0.00930327    0.00264753   -0.01978617
C   -0.72234905   -0.83536279    0.07233426    0.08664505   -0.01857373    0.03315474
C    0.30688066    1.70197438    0.07964403    0.01783540    0.03710596    0.03045938
C    0.38864626   -1.71780329   -0.01134078    0.02058628   -0.01030785    0.01018884
C    1.57300680    1.31623775   -0.26066313   -0.05574320    0.04428784   -0.04741356
C    1.69104246   -1.32364660    0.09402123   -0.06783944   -0.03578763   -0.02179733
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C    2.23510106    0.06122183    0.10590447    0.02870910    0.00880636    0.04089278
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   15
   -420.47727010
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O   -1.93666299    1.22945683    0.06644596    0.02954074    0.02349621    0.01955228
O   -1.98875019   -1.21343046   -0.13308061   -0.07247747   -0.00827424   -0.01470014
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C   -0.70604729   -0.83995802    0.08408825    0.11145657   -0.03500587    0.03628122
C    0.31763257    1.70256062    0.09921961    0.03466782    0.03442751    0.03599376
C    0.37323736   -1.71314445   -0.00289654   -0.00041452   -0.00697116    0.00752416
C    1.57415826    1.31532425   -0.28392981   -0.06080928    0.04091911   -0.05278533
C    1.67697601   -1.32742194    0.09182359   -0.07151319   -0.04402608   -0.01959349
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H    2.53659910   -2.08982327    0.17849192    0.03214401   -0.01738937    0.00791774
C    2.24570258    0.06829851    0.11714044    0.03651424    0.01712539    0.04762798
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   15
   -420.47491372
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O   -1.96753160   -1.21288945   -0.14292680   -0.06292697   -0.00368147   -0.01625477
C   -0.74659479    0.71272483    0.09024324   -0.04748360   -0.02249918   -0.02774763
C   -0.69645202   -0.84244399    0.09365470    0.12931998   -0.04983575    0.03805553
C    0.32631133    1.70107481    0.11662019    0.04682002    0.02964320    0.04118237
C    0.35786883   -1.70808185    0.00508860   -0.02437962   -0.00023138    0.00559657
C    1.57895999    1.31194714   -0.30400848   -0.06045126    0.03527051   -0.05729590
C    1.66714232   -1.32851970    0.09080298   -0.05692270   -0.05525030   -0.01583123
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   15
   -420.47261780
H   -2.52523253    0.45941578   -0.17975657    0.01141769    0.01569227   -0.00556554
O   -1.96239243    1.23317723    0.05530731   -0.00621344    0.00220580    0.00496349
O   -1.94347911   -1.21218348   -0.15203965   -0.04762726    0.00152489   -0.01667612
C   -0.75665045    0.70588374    0.09394081   -0.05984970   -0.03294204   -0.02935451
C   -0.69461641   -0.84193826    0.10092668    0.13486921   -0.06023807    0.03839696
C    0.33218716    1.69778078    0.13153759    0.05327493    0.02777900    0.04492680
C    0.34395850   -1.70302129    0.01272861   -0.04513572    0.00947001    0.00488902
C    1.58738606    1.30643702   -0.32062203   -0.05380627    0.02954104   -0.06176971
C    1.66067733   -1.32625800    0.09074296   -0.02818170   -0.06957533   -0.01267496
H    0.04885636    2.75955952   -0.06737883    0.00167750    0.01787732   -0.00829830
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H    2.43541874   -2.06219503    0.05671888   -0.00621032    0.01298618    0.00083342
C    2.26029861    0.07900582    0.13064447    0.03450092    0.02759619    0.05775675
H    3.32755692    0.02093148   -0.12037971    0.00436175   -0.00365156   -0.00638159
   15
   -420.47104858
H   -2.51954843    0.46877868   -0.14156343    0.02700961    0.03125521    0.00094060
O   -1.97530793    1.23456528    0.04920127   -0.02533508   -0.01091794   -0.00215294
O   -1.91729650   -1.21155039   -0.16040320   -0.02410686    0.00776662   -0.01510778
C   -0.76312234    0.70102904    0.09940368   -0.06507592   -0.04216475   -0.02897644
C   -0.70084766   -0.83782254    0.10588511    0.12254058   -0.06413840    0.03697425
C    0.33487083    1.69278186    0.14374703    0.05377424    0.03076317    0.04686715
C    0.33273481   -1.69852510    0.02007399   -0.05744400    0.01744108    0.00397964
C    1.59903744    1.29913512   -0.33349906   -0.04144334    0.02480093   -0.06636851
C    1.65592122   -1.31981712    0.09145992   -0.00072889   -0.07757431   -0.01129452
H    0.01470741    2.75383208   -0.01941906   -0.00369985    0.01914819   -0.00569588
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H    2.28491320    2.08606637   -0.69568891    0.00700631    0.00579028   -0.00399680
H    2.38313355   -2.05573335   -0.00627267   -0.02609574    0.02816516    0.00052891
C    2.26438901    0.08199999    0.13230301    0.02967947    0.03033938    0.06054465
H    3.33102372    0.00405415   -0.13717876    0.00679052   -0.00468131   -0.00689940
   15
   -420.47497063
H   -2.53214644    0.45692290   -0.10363739    0.02418589    0.02646058    0.00111707
O   -1.98713699    1.23637165    0.04317044   -0.02867650   -0.00486136   -0.00381851
O   -1.89005974   -1.21127693   -0.16809234    0.00991559    0.01597526   -0.01059723
C   -0.76569975    0.69871492    0.10660915   -0.06211651   -0.04946629   -0.02664517
C   -0.71438250   -0.82985973    0.10862009    0.08891338   -0.06183026    0.03299731
C    0.33433005    1.68589980    0.15313099    0.04872784    0.03818061    0.04703356
C    0.32493354   -1.69504763    0.02718840   -0.05958144    0.01841433    0.00121667
C    1.61317507    1.29032839   -0.34236398   -0.02509118    0.02097815   -0.07058971
C    1.65131440   -1.30880078    0.09285116    0.00709786   -0.06348935   -0.00815379
H   -0.01689961    2.73469635    0.03257987   -0.00703749    0.01410540   -0.00204463
H    0.02875617   -2.70695191   -0.29163024   -0.00679045   -0.00587377   -0.00986391
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H    2.34839918   -2.06831276   -0.06955874   -0.02646277    0.02367220   -0.00119230
C    2.26668302    0.08316821    0.13031039    0.02513178    0.03126102    0.06123143
H    3.32976120   -0.00948792   -0.14905398    0.00648189   -0.00516500   -0.00661878
   15
   -420.48021379
H   -2.56119536    0.42713255   -0.06638731    0.00587989    0.00379221   -0.00090509
O   -1.99771881    1.23833443    0.03730654   -0.01831223    0.01735168   -0.00376056
O   -1.86331417   -1.21173968   -0.17531417    0.05469964    0.02715168   -0.00253494
C   -0.76455803    0.69937653    0.11541793   -0.05169628   -0.05355962   -0.02269202
C   -0.73319369   -0.81817345    0.10937695    0.03541930   -0.05636748    0.02556997
C    0.33086506    1.67669713    0.15967773    0.03915751    0.04777806    0.04575670
C    0.32069662   -1.69263964    0.03424044   -0.05401733    0.01071176   -0.00371560
C    1.62882324    1.28025352   -0.34696697   -0.00737395    0.01700449   -0.07333531
C    1.64636266   -1.29404764    0.09470864   -0.00127005   -0.02974896   -0.00007730
H   -0.04357209    2.70570432    0.08604285   -0.00815564    0.00414258    0.00174289
H    0.01112316   -2.72049547   -0.24949154   -0.00986490   -0.01192667   -0.00867921
H    2.29799245    2.03448048   -0.76048015    0.00242176   -0.00323928   -0.00372357
H    2.33177933   -2.09684119   -0.13166352   -0.01164975    0.00166158   -0.00786128
C    2.26745193    0.08245564    0.12462617    0.02154668    0.03023382    0.05962461
H    3.32400812   -0.01935440   -0.15621891    0.00324718   -0.00494658   -0.00540844
   15
   -420.47869152
H   -2.59451632    0.39451988   -0.02864253   -0.01241182   -0.01807097   -0.00058916
O   -2.00746872    1.23952385    0.03162403   -0.00765702    0.03675457   -0.00622596
O   -1.83907352   -1.21344523   -0.18243263    0.10519363    0.04102274    0.00851107
C   -0.76031694    0.70325371    0.12559308   -0.03584526   -0.05290719   -0.01754004
C   -0.75408896   -0.80307620    0.10860464   -0.02926771   -0.05109573    0.01483950
C    0.32504710    1.66461668    0.16346155    0.02665676    0.05492533    0.04357698
C    0.31971125   -1.69084434    0.04152395   -0.04530420   -0.00398952   -0.00998322
C    1.64492466    1.26915965   -0.34714915    0.00887823    0.01114885   -0.07317255
C    1.64148446   -1.27749977    0.09656295   -0.00973286    0.00556126    0.00957125
H   -0.06443587    2.67381035    0.13829813   -0.00805251   -0.00707398    0.00475857
H    0.00049196   -2.72577396   -0.20119576   -0.01123475   -0.01260240   -0.00591233
H    2.30086484    2.01037670   -0.78870902    0.00012445   -0.00694088   -0.00386287
H    2.32364753   -2.12660740   -0.18799851    0.00224873   -0.02027457   -0.01634793
C    2.26691563    0.07992228    0.11534669    0.01829439    0.02769267    0.05588067
H    3.31603540   -0.02569798   -0.15953289   -0.00192133   -0.00409554   -0.00349001
   15
   -420.47285951
H   -2.61941369    0.37433659    0.00940362   -0.02255792   -0.03032572    0.00178908
O   -2.01684796    1.23909097    0.02623217   -0.00293207    0.04459882   -0.01081398
O   -1.81958043   -1.21701055   -0.18993786    0.14865673    0.05417212    0.01960619
C   -0.75392550    0.71029971    0.13682483   -0.01642674   -0.04610968   -0.01155770
C   -0.77323949   -0.78488773    0.10693851   -0.08868192   -0.04573326    0.00352018
C    0.31762229    1.64925909    0.16461296    0.01303899    0.05321333    0.04074147
C    0.32146758   -1.68878751    0.04941201   -0.03675236   -0.02271393   -0.01640119
C    1.66050653    1.25740849   -0.34292655    0.02171771    0.00198084   -0.06895886
C    1.63716284   -1.26124241    0.09785197   -0.01213426    0.03218131    0.01667042
H   -0.07946423    2.64676064    0.18719067   -0.00854348   -0.01416340    0.00674017
H   -0.00216468   -2.72228524   -0.14869423   -0.01061608   -0.00820796   -0.00228765
H    2.30351799    1.99110718   -0.81406470   -0.00006885   -0.00795920   -0.00549164
H    2.31437451   -2.14237384   -0.23270095    0.00853075   -0.03252694   -0.02263681
C    2.26527997    0.07571720    0.10269576    0.01359084    0.02456025    0.05052566
H    3.30943439   -0.02911316   -0.16034154   -0.00684236   -0.00288662   -0.00144209
   15
   -420.47042446
H   -2.62862574    0.37536690    0.04614801   -0.02334778   -0.03191023    0.00446138
O   -2.02606976    1.23667958    0.02133251   -0.00479547    0.04038825   -0.01580155
O   -1.80674249   -1.22300554   -0.19831416    0.16850668    0.05974275    0.02581006
C   -0.74655404    0.72010039    0.14875333    0.00572124   -0.03256312   -0.00513088
C   -0.78715122   -0.76395953    0.10503741   -0.12357697   -0.03507795   -0.00345321
C    0.30941149    1.63075138    0.16330555   -0.00122797    0.03820431    0.03687237
C    0.32545096   -1.68535462    0.05828686   -0.02892443   -0.04181977   -0.02180479
C    1.67479241    1.24555330   -0.33455458    0.03109742   -0.01030655   -0.06070436
C    1.63355385   -1.24687959    0.09815213   -0.01020378    0.04840785    0.01990299
H   -0.08821620    2.62942881    0.23125201   -0.01098959   -0.01346385    0.00834924
H    0.00272569   -2.71306854   -0.09453852   -0.00835775   -0.00088585    0.00121031
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H    2.29937346   -2.13533519   -0.26132075    0.00782004   -0.03432554   -0.02530194
C    2.26283919    0.07002550    0.08699364    0.00553653    0.02173664    0.04427056
H    3.30760410   -0.03044537   -0.16007722   -0.00907155   -0.00169248    0.00009281
   15
   -420.47417562
H   -2.62162401    0.39863101    0.07975846   -0.01406050   -0.02075340    0.00577809
O   -2.03504379    1.23248477    0.01714479   -0.01479066    0.02298591   -0.01946667
O   -1.80142505   -1.23165957   -0.20782832    0.15582840    0.05188437    0.02343451
C   -0.73954079    0.73184007    0.16099228    0.03026503   -0.01303323    0.00126583
C   -0.79376837   -0.74096537    0.10330394   -0.12352539   -0.01366301   -0.00243890
C    0.30128626    1.60999325    0.15977518   -0.01775422    0.01142949    0.03165131
C    0.33117950   -1.67941425    0.06847045   -0.02021485   -0.05654539   -0.02523390
C    1.68720806    1.23432731   -0.32252411    0.03836714   -0.02375779   -0.04995203
C    1.63055066   -1.23538805    0.09726989   -0.00588508    0.05321055    0.01884943
H   -0.08898623    2.62140706    0.26927155   -0.01452987   -0.00645669    0.01038213
H    0.01360572   -2.70315499   -0.04119817   -0.00553327    0.00541833    0.00376181
H    2.30734900    1.96820744   -0.85029319    0.00433765   -0.00369629   -0.01280798
H    2.27909449   -2.10418041   -0.27196437    0.00106342   -0.02589346   -0.02382847
C    2.26008302    0.06301532    0.06861580   -0.00627860    0.01964504    0.03766588
H    3.31206000   -0.03054436   -0.15983717   -0.00727863   -0.00072445    0.00093783
   15
   -420.47847058
H   -2.60517365    0.43589540    0.10940231    0.00606179    0.00568067    0.00392453
O   -2.04330722    1.22730460    0.01382768   -0.03489264   -0.00919676   -0.01983956
O   -1.80308006   -1.24262000   -0.21837662    0.11751212    0.03158081    0.01346167
C   -0.73436486    0.74435043    0.17315753    0.05606308    0.00990000    0.00710156
C   -0.79306079   -0.71719646    0.10168232   -0.09478042    0.01770253    0.00551620
C    0.29425353    1.58857011    0.15433509   -0.03785320   -0.02053109    0.02556220
C    0.33811669   -1.67010168    0.08016853   -0.00875082   -0.06202131   -0.02634807
C    1.69730731    1.22452946   -0.30747377    0.04478861   -0.03547177   -0.03893442
C    1.62789184   -1.22704539    0.09527227    0.00073382    0.04432584    0.01294208
H   -0.07935710    2.61795664    0.29978971   -0.01704289    0.00192282    0.01279390
H    0.02853808   -2.69682057    0.00950280   -0.00354079    0.00656474    0.00513273
H    2.30553855    1.96172424   -0.85604479    0.00591645   -0.00194429   -0.01609581
H    2.25843134   -2.05504925   -0.26573135   -0.01205483   -0.00635509   -0.01760747
C    2.25771466    0.05481533    0.04796041   -0.01965006    0.01782250    0.03096610
H    3.32157439   -0.03011253   -0.16025273   -0.00250034    0.00007705    0.00140106
   15
   -420.47715660
H   -2.59327470    0.46873868    0.13642234    0.02817842    0.03607494   -0.00089361
O   -2.04997524    1.22255902    0.01139645   -0.05706588   -0.04446391   -0.01679399
O   -1.81003340   -1.25499386   -0.22952419    0.07001775    0.00603297    0.00035338
C   -0.73256888    0.75626606    0.18489818    0.07954475    0.03197370    0.01197499
C   -0.78668164   -0.69451156    0.09971542   -0.05370892    0.05173184    0.01585436
C    0.28951833    1.56837308    0.14734866   -0.05929738   -0.04944866    0.01952268
C    0.34556804   -1.65709342    0.09345009    0.00563312   -0.05669569   -0.02549014
C    1.70470051    1.21685376   -0.29006012    0.05059189   -0.04260304   -0.02957683
C    1.62518229   -1.22132179    0.09251119    0.00811075    0.02389284    0.00352025
H   -0.05759793    2.61331400    0.32111397   -0.01714592    0.00724439    0.01489333
H    0.04609414   -2.69483969    0.05655387   -0.00269450    0.00164692    0.00570431
H    2.29958699    1.95677234   -0.85032015    0.00552355   -0.00235232   -0.01750562
H    2.24674013   -2.00185871   -0.24704335   -0.02951131    0.02111754   -0.00799050
C    2.25652400    0.04554251    0.02543127   -0.03090038    0.01498292    0.02446118
H    3.33286443   -0.02973462   -0.16168847    0.00271256    0.00084321    0.00199577
   15
   -420.47572715
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C   -0.73554080    0.76627786    0.19591973    0.09440088    0.04810461    0.01584451
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   15
   -420.48029160
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O   -1.83160170   -1.27954921   -0.25133688   -0.00529130   -0.03442542   -0.02088498
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C   -0.76650837   -0.66016070    0.09242268    0.01784334    0.09926271    0.02947131
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C    1.71008005    1.20916416   -0.25024164    0.05593807   -0.03677848   -0.01800274
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   15
   -420.48523673
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O   -1.84282156   -1.28990998   -0.26104694   -0.02689558   -0.04514931   -0.02668435
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C   -0.75701363   -0.65134003    0.08628249    0.04233214    0.10679391    0.03079913
C    0.29982788    1.52885232    0.12059013   -0.06941823   -0.05986075    0.00371133
C    0.36227279   -1.60097681    0.14192079    0.04330135   -0.01375829   -0.01671942
C    1.70776229    1.20880586   -0.22854850    0.05159418   -0.02539476   -0.01346325
C    1.61646807   -1.21041792    0.08369739   -0.05676917    0.02882918    0.00746203
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   15
   -420.48813384
H   -2.67886687    0.41484852    0.23535524   -0.02742291   -0.02554366    0.01725657
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O   -1.85285372   -1.29824280   -0.26955743   -0.03977569   -0.05038751   -0.02951837
C   -0.77722353    0.77821145    0.22239214    0.04717237    0.04104968    0.02715520
C   -0.75004956   -0.64892489    0.07829464    0.06090384    0.10371195    0.02913171
C    0.31208821    1.52341697    0.11080449   -0.04468581   -0.04243086   -0.00245192
C    0.36345851   -1.57941842    0.16036787    0.04323667   -0.00456804   -0.01300460
C    1.70236190    1.20997702   -0.20605096    0.03973936   -0.01272014   -0.00704861
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C    2.27188390    0.00342598   -0.07624400   -0.01973909   -0.01737183    0.00616095
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   15
   -420.49226467
H   -2.68026875    0.41462006    0.24031830   -0.02641967   -0.02483407    0.01852093
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O   -1.86110552   -1.30430582   -0.27673803   -0.04608385   -0.05123173   -0.02983395
C   -0.79888937    0.77660302    0.22825702    0.00975217    0.03034031    0.03141488
C   -0.74674624   -0.65273704    0.06855544    0.07488985    0.09162042    0.02535675
C    0.32700681    1.52057027    0.10117287   -0.01112326   -0.02926990   -0.00971079
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C    1.69459965    1.21192836   -0.18314054    0.01973278   -0.00208918    0.00192121
C    1.62402797   -1.21049306    0.07634379   -0.09753853    0.04695712    0.00892106
H    0.17968595    2.56549036    0.26609612    0.00686395   -0.01916561    0.01029688
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H    2.25608949    2.00595372   -0.65538942   -0.00585820   -0.01010362   -0.01220188
H    2.44701059   -2.02021408   -0.07517200    0.03609222   -0.01234307   -0.01412488
C    2.27990166   -0.00589491   -0.10317230   -0.00925800   -0.02490572    0.00279254
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   15
   -420.49861041
H   -2.66332502    0.43161217    0.23217502   -0.01398054   -0.01279942    0.01590753
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C   -0.74795039   -0.66205547    0.05728918    0.08443903    0.07259055    0.02026623
C    0.34258292    1.51954789    0.09212986    0.02545126   -0.02644556   -0.01714307
C    0.35875697   -1.53566597    0.19937926    0.01391278    0.00196306   -0.00487917
C    1.68567491    1.21402200   -0.16035169   -0.00638321    0.00546357    0.01194166
C    1.63617860   -1.21458907    0.07183641   -0.08967475    0.04403997    0.00405309
H    0.22793707    2.58034690    0.22787238    0.01090057   -0.01254016    0.00900945
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C    2.28849761   -0.01372403   -0.13026904   -0.00232781   -0.02956360   -0.00066381
H    3.35678032   -0.05217169   -0.22866663   -0.00897687   -0.00052244    0.00758975
   15
   -420.50375964
H   -2.63694940    0.45712689    0.21277547    0.00860790    0.01043172    0.01015670
O   -2.05718099    1.22228915    0.02420925    0.00395216   -0.02972511   -0.02255434
O   -1.87134669   -1.30962434   -0.28714303   -0.04308822   -0.04239212   -0.02441567
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C   -0.75423211   -0.67574160    0.04480135    0.08806732    0.04907454    0.01434101
C    0.35663280    1.52016384    0.08411493    0.05942269   -0.03121914   -0.02285428
C    0.35461112   -1.51390915    0.21945340   -0.00896648    0.00742590   -0.00079396
C    1.67714422    1.21579613   -0.13827798   -0.03401045    0.01082382    0.02058278
C    1.65367034   -1.22130968    0.06709232   -0.06535875    0.03320211   -0.00247342
H    0.26837079    2.60389693    0.18320015    0.01438561   -0.00038850    0.00713352
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H    2.26040265    2.07551782   -0.51357183    0.00008146    0.00649256   -0.01414209
H    2.45198626   -2.04427426    0.05264970    0.03244024   -0.01047058   -0.00442687
C    2.29726176   -0.01978218   -0.15732479   -0.00071502   -0.03083510   -0.00428420
H    3.36978309   -0.05863976   -0.25628307   -0.00585933   -0.00240119    0.00693057
   15
   -420.50491659
H   -2.61677422    0.47505549    0.18600882    0.03039237    0.03377618    0.00543980
O   -2.05852453    1.22433027    0.03120557   -0.00690244   -0.05303976   -0.01611054
O   -1.87347449   -1.30927907   -0.29061099   -0.03309990   -0.03322574   -0.01927008
C   -0.85854158    0.76251705    0.23360064   -0.08668425    0.01315940    0.04054651
C   -0.76579468   -0.69238643    0.03145002    0.08254923    0.02367979    0.00759605
C    0.36712786    1.52266867    0.07746634    0.08560548   -0.03624327   -0.02544282
C    0.35099520   -1.49263209    0.23957730   -0.02946846    0.01870150    0.00292957
C    1.67064729    1.21692078   -0.11743252   -0.05698172    0.01511816    0.02598254
C    1.67504860   -1.22998846    0.06249504   -0.02797840    0.01258283   -0.00839941
H    0.29846677    2.62778017    0.13346677    0.01751647    0.01097774    0.00399370
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H    2.41787307   -2.04406304    0.12330445    0.01525729    0.00263122    0.00006870
C    2.30608994   -0.02399280   -0.18412017   -0.00318979   -0.02867135   -0.00815580
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   15
   -420.50450625
H   -2.61714633    0.47020002    0.15495017    0.03100725    0.03281353    0.00642159
O   -2.05961935    1.22867821    0.03895752   -0.00178711   -0.05135722   -0.01560654
O   -1.87412790   -1.30743853   -0.29321006   -0.01580917   -0.02080036   -0.01265023
C   -0.87020679    0.75589615    0.23068466   -0.09874855    0.00956712    0.04239638
C   -0.78228433   -0.71046462    0.01764572    0.06403713   -0.00153237   -0.00045806
C    0.37250680    1.52733473    0.07233976    0.09966853   -0.03531275   -0.02474246
C    0.34912288   -1.47250204    0.25952477   -0.04240191    0.03301172    0.00649622
C    1.66754356    1.21713386   -0.09813909   -0.06944074    0.01882815    0.02754144
C    1.69809186   -1.23939108    0.05838878    0.01425524   -0.01470228   -0.01111155
H    0.31599455    2.64407452    0.08091443    0.01995178    0.01717242   -0.00009454
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H    2.26596523    2.12796478   -0.33328644    0.00062898    0.01719021   -0.00761729
H    2.37313874   -2.04611077    0.19410079   -0.00745777    0.02115103    0.00152299
C    2.31511694   -0.02648295   -0.21042050   -0.00687149   -0.02383753   -0.01238162
H    3.40389669   -0.06503393   -0.32547553    0.00563861   -0.00589819    0.00405990
   15
   -420.50416912
H   -2.63851685    0.44326549    0.11916386    0.01054736    0.00739710    0.00912649
O   -2.06069042    1.23525360    0.04742640    0.01751490   -0.02395548   -0.01739811
O   -1.87409412   -1.30466687   -0.29524073    0.00939989   -0.00503460   -0.00451996
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C   -0.80257186   -0.72845520    0.00387873    0.03075617   -0.02578107   -0.01038196
C    0.37192907    1.53409063    0.06869717    0.09968033   -0.02537071   -0.02160413
C    0.34976547   -1.45435637    0.27907760   -0.04564130    0.04502859    0.01042169
C    1.66857042    1.21621147   -0.08049502   -0.06829395    0.02186558    0.02588067
C    1.72033155   -1.24794990    0.05494287    0.04510195   -0.03276977   -0.01187133
H    0.31923260    2.64841019    0.02843365    0.02114757    0.01658953   -0.00425288
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H    2.26794765    2.13727257   -0.23348477   -0.00219717    0.01656040   -0.00205537
H    2.33326746   -2.06284314    0.26390069   -0.02185923    0.03046676    0.00161227
C    2.32455156   -0.02753601   -0.23597001   -0.00901556   -0.01809783   -0.01699593
H    3.41706000   -0.06248252   -0.36502090    0.00858711   -0.00687231    0.00244826
   15
   -420.50191052
H   -2.66747686    0.41093826    0.07705316   -0.01090284   -0.01802238    0.00807619
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O   -1.87451009   -1.30167720   -0.29707111    0.04058898    0.01341675    0.00484773
C   -0.87587943    0.74125159    0.21707404   -0.08569806   -0.00260988    0.04482835
C   -0.82465926   -0.74489168   -0.00925200   -0.01430404   -0.04892510   -0.02191084
C    0.36538574    1.54233601    0.06635583    0.08722466   -0.00661705   -0.01741044
C    0.35312773   -1.43890576    0.29799669   -0.04090941    0.05155471    0.01501963
C    1.67366589    1.21397273   -0.06440777   -0.05502165    0.02365252    0.02255410
C    1.73995341   -1.25465369    0.05223732    0.05523443   -0.02710170   -0.01669560
H    0.30733762    2.64118936   -0.02103715    0.02081057    0.00956670   -0.00756153
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H    2.30806068   -2.10010058    0.33223102   -0.01938586    0.01757992    0.00647738
C    2.33451433   -0.02748920   -0.26049006   -0.00780895   -0.01334330   -0.02191223
H    3.42425885   -0.05502694   -0.40634547    0.00788205   -0.00706214    0.00110567
   15
   -420.49587224
H   -2.68915971    0.39089792    0.02932853   -0.02319774   -0.03241729    0.00371938
O   -2.06578708    1.25039804    0.06663216    0.03469049    0.02348510   -0.01162673
O   -1.87676764   -1.29929671   -0.29912124    0.07152514    0.03186068    0.01409140
C   -0.87064112    0.73396224    0.20623711   -0.06738922   -0.01075308    0.04448315
C   -0.84586595   -0.75838181   -0.02105820   -0.06229882   -0.06935136   -0.03328434
C    0.35360813    1.55095597    0.06506901    0.06658298    0.01706235   -0.01348383
C    0.35894534   -1.42654402    0.31600496   -0.03239022    0.05232655    0.02011231
C    1.68205556    1.21031571   -0.04968462   -0.03512829    0.02298612    0.01922122
C    1.75628966   -1.25978862    0.05056435    0.05426126   -0.00769564   -0.02572864
H    0.28054866    2.62732128   -0.06514590    0.01895384   -0.00135539   -0.00948965
H    0.07474342   -2.49565728    0.44021686   -0.00834314   -0.00943407   -0.00573574
H    2.27945711    2.12355148   -0.03339643   -0.00904883    0.00717569    0.00818908
H    2.29637839   -2.14928651    0.39557669   -0.00945688   -0.00735107    0.01635847
C    2.34492927   -0.02662726   -0.28368393   -0.00269630   -0.01014652   -0.02700829
H    3.42597953   -0.04253781   -0.44849288    0.00391454   -0.00640904    0.00017539
   15
   -420.48816116
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   15
   -420.48400312
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O   -1.89179104   -1.29940418   -0.30539443    0.09219159    0.04841010    0.02175856
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   15
   -420.48422193
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C   -0.83563566    0.71754630    0.15825164   -0.00295155   -0.02387690    0.03290147
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   15
   -420.48354884
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C   -0.87790648   -0.76644641   -0.04522777   -0.07859191   -0.05023695   -0.03101157
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H    0.06580643    2.61860534   -0.16615327   -0.00210750    0.00432954   -0.01578259
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C    2.38358400   -0.01839520   -0.35732468    0.02100533   -0.00100055   -0.04140046
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   15
   -420.47939320
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O   -1.94048263   -1.31357246   -0.32090871   -0.00729743    0.00216224   -0.00256642
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C    0.26269682    1.56419150    0.06658933   -0.04283307    0.01715345    0.00510397
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   15
   -420.47422503
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O   -1.95843188   -1.31965729   -0.32644794   -0.04217506   -0.01591817   -0.01164885
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C    0.41922575   -1.40759854    0.38972829    0.01379920    0.03549162    0.02630341
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C    1.78580151   -1.28991681    0.07629770    0.05787044   -0.06335053    0.01227820
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C    2.39643895   -0.01332701   -0.37986705    0.02454095    0.00220267   -0.04144407
H    3.45327482    0.08355206   -0.67693451    0.00738830    0.00714665   -0.01039561
   15
   -420.46765429
H   -2.65943609    0.60020587   -0.31845315   -0.00384724   -0.00813099   -0.01335021
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O   -1.97450070   -1.32503676   -0.33146681   -0.06837465   -0.02962681   -0.01859831
C   -0.79279242    0.71240493    0.06901088    0.07639685    0.00099084    0.00501339
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C    0.23572249    1.55760163    0.06681703   -0.07702975   -0.00133802    0.00469954
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C    1.75156380    1.16862738    0.02711151    0.03127704   -0.01309949    0.01645046
C    1.77892195   -1.28934199    0.08287683    0.04278720   -0.06835463    0.02107460
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H    2.35925301   -2.09037765    0.39991346   -0.02834240    0.02675879   -0.00451651
C    2.40069470   -0.01094877   -0.38737107    0.02965026    0.00254554   -0.04102075
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   15
   -420.46019915
H   -2.68504400    0.61211606   -0.36682896   -0.02021777   -0.02332608   -0.02758107
O   -2.09312934    1.28729993    0.15472002   -0.01139868    0.03616305    0.03680207
O   -1.98749881   -1.32908973   -0.33564954   -0.08617220   -0.03863432   -0.02349793
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C   -0.84277198   -0.73192847   -0.04163755    0.02732927    0.04310876    0.00265426
C    0.22871521    1.55418603    0.06647769   -0.08743721    0.00089781    0.00184477
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C    1.75657741    1.16457591    0.03471556    0.03607698   -0.01129243    0.02021271
C    1.76955376   -1.28475440    0.08822233    0.00911206   -0.05044737    0.02220473
H   -0.12805310    2.58238776   -0.09570012   -0.01892130    0.00023374   -0.01316598
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C    2.40314355   -0.00872208   -0.39239247    0.03744424    0.00245139   -0.04095418
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   15
   -420.45373579
H   -2.69680991    0.64006320   -0.39587999   -0.02461188   -0.02576286   -0.03289649
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O   -1.99661270   -1.33140557   -0.33877198   -0.09709830   -0.04342226   -0.02680619
C   -0.79408058    0.71158157    0.02086128    0.07605067    0.00532724   -0.00752331
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C    0.44448199   -1.42731596    0.40457899    0.04221703    0.03729957    0.00182605
C    1.75941766    1.16121637    0.04110002    0.03916385   -0.01126374    0.02341850
C    1.75965164   -1.27713152    0.09222475   -0.02812350   -0.02868440    0.02302116
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C    2.40332185   -0.00664518   -0.39493469    0.04636559    0.00263411   -0.04130852
H    3.44269891    0.10532324   -0.71769004    0.00206994    0.01057204   -0.01032850
   15
   -420.45179204
H   -2.69154609    0.68594439   -0.40184418   -0.01715307   -0.01760101   -0.02791525
O   -2.08829645    1.29128410    0.17094289   -0.00982203    0.03097335    0.04226056
O   -2.00134144   -1.33176452   -0.34068265   -0.10248936   -0.04463319   -0.02889263
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C   -0.82938441   -0.72487840   -0.03894017    0.04975114    0.06389899    0.01188953
C    0.23062002    1.54657385    0.06563988   -0.08422348    0.01960815   -0.00304557
C    0.44848798   -1.43857291    0.40869042    0.04515186    0.02772015   -0.00080649
C    1.75990667    1.15855806    0.04607568    0.03887913   -0.01511429    0.02516620
C    1.75139116   -1.26773217    0.09482423   -0.05405959   -0.01461919    0.02577934
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H    2.46803149    1.91950324    0.33706750    0.00400644   -0.01939709    0.01128601
H    2.54769611   -2.07839913    0.31447830    0.03198865   -0.02154353    0.00235996
C    2.40070432   -0.00472977   -0.39497944    0.05360183    0.00321757   -0.04146404
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   15
   -420.45532559
H   -2.67475450    0.74383604   -0.38849368    0.00394587    0.00153301   -0.00991990
O   -2.08523983    1.29104677    0.17619244   -0.02610334    0.01099811    0.02635046
O   -2.00143837   -1.33010995   -0.34128640   -0.10290857   -0.04271755   -0.02988564
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C   -0.82689676   -0.72687330   -0.03853836    0.05491238    0.06630520    0.01502548
C    0.23933012    1.54131262    0.06543186   -0.06915964    0.02323857   -0.00406184
C    0.44979147   -1.45148477    0.41282587    0.04251195    0.01393864    0.00137925
C    1.75806268    1.15683364    0.04953502    0.03506676   -0.02278383    0.02576192
C    1.74631663   -1.25741108    0.09586499   -0.06347007   -0.00806392    0.02851018
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H    2.47311206    1.93374177    0.30845133    0.00806053   -0.01477719    0.01060236
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C    2.39487038   -0.00300822   -0.39252299    0.05581993    0.00366797   -0.04033149
H    3.42450509    0.08337839   -0.70734042   -0.00596498    0.00853734   -0.00676377
   15
   -420.46112844
H   -2.66139072    0.80026437   -0.36859230    0.03340384    0.02555309    0.01658211
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O   -1.99688538   -1.32652844   -0.34053876   -0.09811254   -0.03775675   -0.02962990
C   -0.82646051    0.70918002   -0.04704656    0.01131828   -0.01079059   -0.02521980
C   -0.82770669   -0.73284977   -0.03903979    0.05533802    0.06302466    0.01705110
C    0.25219245    1.53468526    0.06547208   -0.04808233    0.01930354   -0.00555256
C    0.44854764   -1.46523336    0.41686044    0.03517114   -0.00100011    0.00686964
C    1.75410704    1.15649457    0.05143652    0.02944153   -0.03190431    0.02630274
C    1.74499454   -1.24657606    0.09519072   -0.05562080   -0.00693589    0.02946680
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H    2.47234321    1.95845728    0.27220486    0.01284233   -0.00743224    0.00987258
H    2.59116003   -2.01955540    0.25291559    0.03616086   -0.01497410   -0.00462351
C    2.38569746   -0.00150457   -0.38763790    0.05079944    0.00337225   -0.03713029
H    3.42049146    0.06275317   -0.69420665   -0.00460732    0.00660881   -0.00608316
   15
   -420.46958049
H   -2.67091520    0.83937414   -0.35956806    0.04352130    0.03229846    0.02572761
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O   -1.98790385   -1.32124650   -0.33845262   -0.08708688   -0.02940055   -0.02778924
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   15
   -420.47899333
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O   -1.97500035   -1.31464555   -0.33511321   -0.06817010   -0.01704718   -0.02391489
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C    0.44028585   -1.49188531    0.42339753    0.01604702   -0.01932968    0.01351398
C    1.74117692    1.16201523    0.05036535    0.01952017   -0.04247000    0.03030925
C    1.75067434   -1.22329471    0.08860870    0.00886188   -0.02088341    0.02457195
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   15
   -420.48170418
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O   -1.95904066   -1.30728842   -0.33069814   -0.03943157   -0.00009629   -0.01754065
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C    0.43440280   -1.50368870    0.42551407    0.00858036   -0.02109125    0.01161105
C    1.73280136    1.16849249    0.04715082    0.01556225   -0.03968381    0.03368683
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   15
   -420.48059868
H   -2.80227939    0.86991586   -0.37634167   -0.03409697   -0.00965492   -0.03000915
O   -2.04617372    1.29386411    0.19457814    0.03443117    0.00668670    0.04141641
O   -1.94133331   -1.29994434   -0.32549759    0.00020431    0.02143504   -0.00843647
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C   -0.85802068   -0.78752656   -0.05103406   -0.02221484   -0.00442293    0.00603344
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C    0.42798726   -1.51422392    0.42693151    0.00376301   -0.02131924    0.00906749
C    1.72348829    1.17733840    0.04189793    0.01083019   -0.03070063    0.03726708
C    1.75432954   -1.19543898    0.07635282    0.06165566   -0.00485257    0.00552772
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C    2.32655834    0.00368026   -0.34899485   -0.00724736   -0.01017282   -0.01433867
H    3.40024976   -0.04588791   -0.59819571    0.00984530   -0.00678701   -0.00339781
   15
   -420.47784984
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O   -1.92366792   -1.29358439   -0.31992226    0.04822095    0.04584062    0.00270310
C   -0.87594119    0.71690360   -0.12732464   -0.08136676   -0.00476064   -0.03930024
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C    0.33467993    1.49222392    0.07455591    0.04590484    0.00056091   -0.01870108
C    0.42133368   -1.52346470    0.42779005    0.00101207   -0.02250275    0.00855535
C    1.71353263    1.18801753    0.03439335    0.00365135   -0.01713841    0.04042693
C    1.75118136   -1.18064413    0.06939181    0.05404650    0.03709830   -0.01081625
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   15
   -420.47069663
H   -2.81196520    0.90272883   -0.31086548   -0.02452191   -0.00021747   -0.01672830
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O   -1.90818825   -1.28929731   -0.31446835    0.09523734    0.06823806    0.01343276
C   -0.87435204    0.72003144   -0.13668195   -0.08501952   -0.00167305   -0.04021185
C   -0.87109803   -0.81817569   -0.06019052   -0.10708100   -0.05615247   -0.01216323
C    0.34688882    1.48349632    0.07931415    0.06131486    0.00349326   -0.01781916
C    0.41461401   -1.53133462    0.42811533   -0.00073066   -0.02565755    0.01116940
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C    1.74476987   -1.16808334    0.06308143    0.04435525    0.07785951   -0.02655323
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H    2.28420829    2.10717485   -0.03242896   -0.01082163   -0.00285579   -0.00570656
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C    2.29567579    0.00896906   -0.32302137   -0.02556018   -0.02519781   -0.00462786
H    3.35776179   -0.08207174   -0.53276733   -0.00190238   -0.01177069    0.00251651
   15
   -420.46096463
H   -2.78724913    0.92171405   -0.25664395    0.00746138    0.01692429    0.00493410
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O   -1.89696631   -1.28807139   -0.30960780    0.12539426    0.08138502    0.01990688
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C   -0.86927731   -0.82920643   -0.06396010   -0.13208353   -0.07237322   -0.01743550
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C    0.40793616   -1.53764361    0.42775132   -0.00198207   -0.03061485    0.01647765
C    1.69366974    1.21162353    0.01191694   -0.02126368    0.00807752    0.04438216
C    1.73564722   -1.16014876    0.05835378    0.03988203    0.10265591   -0.03778409
H    0.29901619    2.45291516    0.52251576    0.02521076   -0.01686863    0.00597152
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H    2.25074939    2.12807244   -0.07929458   -0.01488334   -0.00290371   -0.00690755
H    2.50067724   -2.01588579    0.23955596    0.02510020   -0.02608761    0.00482088
C    2.28230870    0.01365862   -0.30947179   -0.02923451   -0.02905392   -0.00108939
H    3.33602425   -0.08824383   -0.50163315   -0.00960208   -0.01247532    0.00513146
   15
   -420.45622083
H   -2.76809535    0.92836998   -0.20586650    0.04050460    0.03501482    0.02372560
O   -2.02122804    1.29938028    0.18907959   -0.04770339   -0.03925563   -0.01553242
O   -1.89131845   -1.29048111   -0.30562332    0.12546410    0.07975596    0.01930841
C   -0.85604194    0.72639722   -0.14804089   -0.07156286    0.00552105   -0.04224432
C   -0.85962417   -0.83592885   -0.06671027   -0.12662870   -0.07515306   -0.01588510
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C    0.40137552   -1.54209918    0.42638629   -0.00266680   -0.03584433    0.02263980
C    1.68525016    1.22306131   -0.00329337   -0.03513604    0.01274802    0.04495354
C    1.72410212   -1.15832614    0.05588157    0.03760290    0.10821721   -0.04310335
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H    2.47840201   -2.03637091    0.25316520    0.02514689   -0.03215973    0.00764229
C    2.27070297    0.02007349   -0.29585151   -0.03157915   -0.02664074    0.00149843
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   15
   -420.46519472
H   -2.77548859    0.91103541   -0.17068630    0.03296435    0.03391390    0.01966570
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O   -1.89125011   -1.29645659   -0.30249066    0.09604112    0.06429438    0.01238901
C   -0.84013372    0.72918998   -0.14992170   -0.05467445    0.01156594   -0.04294093
C   -0.84246774   -0.83816807   -0.06853190   -0.09083569   -0.06580527   -0.00805911
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C    0.39497092   -1.54440171    0.42366286   -0.00227712   -0.03804087    0.02666295
C    1.67892858    1.23375640   -0.02121331   -0.04369026    0.01186631    0.04369952
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H    0.35842758    2.42379781    0.58532154    0.03384183   -0.01483973    0.00776021
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C    2.26101095    0.02806414   -0.28231823   -0.03457994   -0.01727452    0.00333730
H    3.31555637   -0.07404044   -0.45124403   -0.01223486   -0.01101794    0.00654634
   15
   -420.48054474
H   -2.80453031    0.87042318   -0.14885623   -0.00766534    0.01469862    0.00233693
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C   -0.81990342   -0.83645528   -0.06988025   -0.03790933   -0.05084042    0.00260485
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C    0.38869596   -1.54443960    0.41935099   -0.00024399   -0.03316129    0.02597044
C    1.67520287    1.24374864   -0.04176192   -0.04315480    0.00805280    0.03959829
C    1.69432704   -1.17319139    0.05861633    0.03443590    0.06133897   -0.03537477
H    0.35286242    2.42663483    0.60904484    0.03349780   -0.00586683    0.01166865
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C    2.25341302    0.03707478   -0.26898384   -0.03807000   -0.00302115    0.00458303
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   15
   -420.48882818
H   -2.82870126    0.81909507   -0.12914347   -0.03969015   -0.00333481   -0.00888023
O   -1.99387512    1.31505007    0.18406213    0.01356310    0.00848459    0.02099310
O   -1.90202366   -1.31606844   -0.29746287    0.00574434    0.01827284   -0.00574921
C   -0.79983295    0.73215324   -0.14592352   -0.00550975    0.02937749   -0.04106867
C   -0.79505379   -0.83166269   -0.07138217    0.01683825   -0.03668015    0.01257224
C    0.34218665    1.44460697    0.12032330    0.04408835   -0.05617429   -0.02800171
C    0.38242584   -1.54251716    0.41349308    0.00373984   -0.01946430    0.02051297
C    1.67403958    1.25325373   -0.06468818   -0.03326663    0.00422459    0.03208459
C    1.67627301   -1.18706197    0.06336063    0.03574528    0.01334100   -0.02347354
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H    2.33541786   -1.98441825    0.26404902   -0.02434652    0.01660233   -0.00178259
C    2.24810988    0.04626277   -0.25592424   -0.04003493    0.01231414    0.00535105
H    3.32589285   -0.02893648   -0.41870963    0.00170243   -0.00595853    0.00401700
   15
   -420.49083152
H   -2.82555915    0.76965976   -0.10354029   -0.05104273   -0.01305869   -0.01174905
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O   -1.90886259   -1.32765783   -0.29476529   -0.03038959   -0.00147912   -0.01156823
C   -0.77839454    0.73125568   -0.14016029    0.02278388    0.03931226   -0.03801973
C   -0.77118151   -0.82463266   -0.07363098    0.06367956   -0.02616073    0.01991499
C    0.32941398    1.44304451    0.13293258    0.01139062   -0.06853391   -0.02598291
C    0.37591995   -1.53944943    0.40640542    0.00962985    0.00047108    0.01291691
C    1.67485570    1.26249250   -0.08953875   -0.01693573    0.00248465    0.02137836
C    1.65609919   -1.20175930    0.06952373    0.02799641   -0.02996283   -0.01159306
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H    0.14837892   -2.49106534    0.90673129   -0.00311033   -0.00362910    0.00901413
H    2.22625495    2.20042538   -0.22910107   -0.00569610    0.00957451   -0.00667039
H    2.30129330   -1.96752694    0.26505414   -0.04337984    0.03911680   -0.00723741
C    2.24520912    0.05471996   -0.24318680   -0.03829197    0.02495039    0.00580526
H    3.33205304    0.00105881   -0.40730562    0.00710209   -0.00188816    0.00273736
   15
   -420.49447700
H   -2.78673430    0.72911503   -0.06979071   -0.04416013   -0.01400121   -0.00925925
O   -1.97548932    1.32562184    0.17755875    0.01557903    0.02890617    0.02475866
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C   -0.75832075    0.72798988   -0.13210213    0.04835174    0.04730995   -0.03412120
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   15
   -420.49793204
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   15
   -420.49482948
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   15
   -420.48919007
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   15
   -420.48808509
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   15
   -420.48838686
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O   -1.89819646   -1.37736574   -0.26658443   -0.03953757   -0.04311475   -0.00152208
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   15
   -420.48542208
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O   -1.88720731   -1.37942608   -0.26064143   -0.01119599   -0.03752017    0.00409451
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C    2.25364933    0.06299436   -0.16419913    0.02229214    0.01491240    0.01008158
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   15
   -420.47914614
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O   -1.87573855   -1.37980564   -0.25488702    0.02462450   -0.02622251    0.01045130
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   15
   -420.47435101
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   15
   -420.47513450
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O   -1.85802297   -1.37779825   -0.24510927    0.10443387    0.00905481    0.02344307
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   15
   -420.47602639
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O   -1.85533990   -1.37697563   -0.24166628    0.13320610    0.02347540    0.02767303
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C    0.25785949   -1.58932220    0.26982832   -0.06320333   -0.00711309    0.03399806
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C    1.64172516   -1.23560967    0.16678312    0.03234482   -0.00241603   -0.00034027
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H    2.37099212    2.13248235   -0.40240963    0.00161726   -0.00833661    0.00630420
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C    2.24056073    0.04211075   -0.13112503    0.01240520   -0.01070982    0.01546192
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   15
   -420.47528008
H   -2.49410555    0.59431456    0.29508816    0.04077208    0.02619331   -0.00036114
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O   -1.85862331   -1.37717692   -0.23946652    0.14157018    0.02710949    0.02862790
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C    1.63320108    1.34706013   -0.29621026   -0.00824258    0.04064880   -0.05613866
C    1.64965027   -1.22569734    0.17658547    0.02910646    0.03140464   -0.00006639
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H    2.35395637   -2.12347046    0.25266994    0.01497793   -0.02830004   -0.00089824
C    2.23524519    0.03744371   -0.12507959    0.01335838   -0.01814867    0.01515520
H    3.29833823   -0.05417230   -0.34214346   -0.00025947   -0.00686496    0.00066793
   15
   -420.47922212
H   -2.55360076    0.63844929    0.31050126    0.02461577    0.02363211    0.00183130
O   -1.86837464    1.25384715    0.08352655    0.03652730   -0.04728196   -0.00757498
O   -1.86823654   -1.37855772   -0.23855173    0.12537235    0.01766391    0.02590427
C   -0.70743864    0.67616010    0.09510599   -0.02458561   -0.02522571    0.00190073
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   15
   -420.48588819
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   15
   -420.48996897
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   15
   -420.49086646
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   15
   -420.48881668
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   15
   -420.48543283
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   15
   -420.48046528
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   15
   -420.47490820
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   15
   -420.47107071
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   15
   -420.46694798
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   15
   -420.46677250
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   15
   -420.47310509
H   -2.62393121    0.40512532    0.20157321   -0.03664202   -0.03601092    0.01603899
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   15
   -420.48131216
H   -2.55247358    0.36298167    0.16707555   -0.01777682   -0.03501309    0.01441875
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O   -1.99329276   -1.29145966   -0.23429890   -0.06223386   -0.02712386   -0.02750729
C   -0.70377714    0.75536335    0.28595141    0.02818547    0.00420105    0.05916219
C   -0.80486865   -0.84680281    0.03042133    0.01953960   -0.00816610    0.02998260
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   15
   -420.48523749
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   15
   -420.48500842
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   15
   -420.48217138
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O   -1.95584576   -1.22945779   -0.21227689    0.05547232    0.02344678   -0.00062680
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   15
   -420.47797401
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O   -1.94571200   -1.20978823   -0.20421828    0.09652537    0.03957499    0.01045089
C   -0.75797982    0.75225945    0.25557498   -0.02418068    0.00190091    0.03557725
C   -0.85209337   -0.86692255    0.06053098   -0.13731482   -0.04709023    0.01012666
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   15
   -420.47614232
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   15
   -420.47883251
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C   -0.77965226    0.75020282    0.22562391   -0.02062757    0.02259759    0.02060977
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   15
   -420.48422662
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O   -1.94383109   -1.16267926   -0.18377003    0.08310989    0.04591752    0.01389935
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   15
   -420.48842427
H   -2.54474213    0.34110753   -0.31200442   -0.01971235   -0.02973379   -0.03171516
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O   -1.95204989   -1.15127493   -0.17837367    0.04162706    0.04102306    0.00689811
C   -0.79635756    0.74271404    0.19064151   -0.01488142    0.04195163    0.00800226
C   -0.79230602   -0.84591450    0.07676559   -0.02848346   -0.04586386    0.02586625
C    0.27400948    1.57450814   -0.00982087   -0.00965639   -0.02444736    0.00822004
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C    2.33431429    0.01954268   -0.05418001    0.02960281   -0.02642240   -0.01105635
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   15
   -420.48884102
H   -2.59762820    0.38919587   -0.33690408   -0.02944413   -0.02686350   -0.03555773
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O   -1.96216135   -1.14173665   -0.17329092    0.00086237    0.03726068    0.00000982
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C   -0.76551295   -0.83307596    0.07810690    0.02872975   -0.03994647    0.03264172
C    0.26380650    1.56110884   -0.01398066   -0.01549981   -0.03747236    0.01677639
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C    2.34992250    0.02470183   -0.04654253    0.03382645   -0.01545376   -0.01222669
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   15
   -420.48761450
H   -2.62989836    0.45630785   -0.33658904   -0.02910278   -0.01826424   -0.03267222
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O   -1.97234055   -1.13389420   -0.16821477   -0.03250005    0.03483712   -0.00528258
C   -0.80918188    0.72540952    0.15366971   -0.02162987    0.04492977   -0.00184810
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C    0.25454475    1.54992834   -0.01914341   -0.02209760   -0.04107646    0.02302393
C    0.38597403   -1.68598271   -0.05472817   -0.03651635   -0.02524272   -0.01954520
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C    1.74017592   -1.26131344    0.20171503    0.05397823   -0.04205589    0.03349675
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C    2.36349067    0.03080689   -0.03816705    0.03686040   -0.00664981   -0.01313138
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   15
   -420.48865562
H   -2.64217129    0.53576841   -0.31341199   -0.01237875    0.00382068   -0.01858025
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O   -1.98108088   -1.12763432   -0.16290648   -0.05643003    0.03298105   -0.00852821
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C   -0.71979926   -0.80053989    0.07472253    0.10858517   -0.02542302    0.03597679
C    0.24662043    1.54118292   -0.02568305   -0.02890068   -0.03489921    0.02615324
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C    1.73699797   -1.27662722    0.19184280    0.03812390   -0.04988911    0.03085640
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H    2.43310378   -2.01407260    0.39793753   -0.02618677    0.03580154    0.00051601
C    2.37482767    0.03732865   -0.02899898    0.04020978   -0.00068309   -0.01371878
H    3.47709415   -0.07479475   -0.06140818    0.01309225   -0.01475130   -0.00098198
   15
   -420.48593903
H   -2.64687418    0.61138023   -0.27771404    0.02495788    0.04233687    0.00849231
O   -2.04972212    1.20966154    0.12588178   -0.03768820   -0.05084330   -0.01461292
O   -1.98729572   -1.12287158   -0.15721798   -0.07114125    0.03130256   -0.00984762
C   -0.81677017    0.69778403    0.11705147   -0.02789534    0.02090983   -0.00717521
C   -0.70568718   -0.78174157    0.06978786    0.12682426   -0.01274233    0.03390920
C    0.24044315    1.53450635   -0.03378799   -0.03550668   -0.02055461    0.02607614
C    0.39114013   -1.66537358   -0.03039783   -0.02705823    0.00014687   -0.00206962
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   15
   -420.47889308
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O   -1.99031204   -1.11953182   -0.15108845   -0.07795920    0.03037884   -0.00963730
C   -0.81811129    0.68165120    0.09932296   -0.02444115   -0.00281644   -0.00817291
C   -0.69917567   -0.76220321    0.06280821    0.13119301    0.00595416    0.03064722
C    0.23640725    1.52905672   -0.04345970   -0.04082706   -0.00316614    0.02404175
C    0.39637078   -1.65474167   -0.01778800   -0.01394398    0.00094511    0.00332097
C    1.68999370    1.28800404   -0.16543636    0.01137280    0.03127985   -0.03284018
C    1.72612893   -1.29929005    0.16697305   -0.03401730   -0.02121712    0.01865002
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C    2.38994017    0.05026649   -0.00816915    0.04884131    0.00728485   -0.01356412
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   15
   -420.47801190
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O   -1.98981537   -1.11757652   -0.14452531   -0.07824147    0.03103200   -0.00844203
C   -0.81799057    0.66571984    0.08208608   -0.01770389   -0.03271490   -0.00863463
C   -0.70054016   -0.74305465    0.05397860    0.12387858    0.03043328    0.02665691
C    0.23482510    1.52382539   -0.05458857   -0.04309605    0.00901596    0.02260569
C    0.40243270   -1.64412871   -0.00536581    0.00153975   -0.00578962    0.00608767
C    1.69346720    1.28009572   -0.15912207    0.02056821    0.02531429   -0.03352147
C    1.72263412   -1.30821187    0.15267484   -0.05841136   -0.01557089    0.01677581
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C    2.39320756    0.05618722    0.00348225    0.05134663    0.01189207   -0.01264660
H    3.47538415    0.00599381    0.06652081   -0.00023771   -0.00614525    0.00214371
   15
   -420.47689539
H   -2.79069493    0.63456394   -0.22472824   -0.02827485    0.00566318   -0.01389304
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O   -1.98579046   -1.11703447   -0.13758132   -0.07264998    0.03309779   -0.00664642
C   -0.81680404    0.65178298    0.06537164   -0.00995717   -0.06566771   -0.00912470
C   -0.70935182   -0.72576111    0.04354032    0.10757090    0.05760710    0.02195336
C    0.23582953    1.51810450   -0.06709616   -0.04149521    0.01047167    0.02336173
C    0.40840806   -1.63314608    0.00669717    0.01579625   -0.01625427    0.00710944
C    1.69570339    1.27066747   -0.15078998    0.02848010    0.01713112   -0.03229692
C    1.72260451   -1.31615349    0.13735437   -0.06925505   -0.01773368    0.01648772
H    0.05036006    2.51268400   -0.41592263    0.01357010   -0.01449588   -0.00893744
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H    2.12617827    2.27515558   -0.07216462   -0.01953271    0.01279125    0.01100138
H    2.53021842   -2.17313214    0.15581915    0.03544151   -0.03036733    0.00181591
C    2.39339402    0.06138375    0.01589655    0.04902124    0.01744881   -0.01135115
H    3.46951086    0.04506890    0.10677762   -0.00386299   -0.00253620    0.00246065
   15
   -420.47568628
H   -2.83900110    0.60397721   -0.20699605   -0.05403817   -0.01246411   -0.02298260
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O   -1.97849186   -1.11799838   -0.13033741   -0.06095343    0.03632914   -0.00439962
C   -0.81501114    0.64180593    0.04921009   -0.00304445   -0.09615992   -0.00981916
C   -0.72463553   -0.71193581    0.03177900    0.08443839    0.08152746    0.01632936
C    0.23932822    1.51179367   -0.08102097   -0.03681938    0.00345394    0.02495648
C    0.41344480   -1.62119467    0.01832981    0.02680702   -0.02386921    0.00818801
C    1.69622631    1.26020705   -0.14051410    0.03453852    0.00811844   -0.02919634
C    1.72668877   -1.32298864    0.12103514   -0.06508084   -0.02690504    0.01649849
H    0.08335928    2.53415892   -0.41702326    0.01537285   -0.00171098   -0.01193542
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H    2.50489255   -2.17571460    0.08764541    0.02750551   -0.02505653   -0.00206688
C    2.39064884    0.06552193    0.02899736    0.04024386    0.02357329   -0.01003069
H    3.46614446    0.08597775    0.14525102   -0.00301539    0.00094058    0.00297727
   15
   -420.48035039
H   -2.84964243    0.58161777   -0.17327816   -0.05863586   -0.01772671   -0.02239524
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O   -1.96845435   -1.12061629   -0.12289550   -0.04206664    0.04106823   -0.00171577
C   -0.81302287    0.63759495    0.03364284    0.00167451   -0.11679049   -0.01059739
C   -0.74499566   -0.70298677    0.01903544    0.05517171    0.09458784    0.00966997
C    0.24504409    1.50528463   -0.09644528   -0.03013317   -0.00580907    0.02473465
C    0.41687713   -1.60784529    0.02946011    0.03442687   -0.02272001    0.01059346
C    1.69467280    1.24925199   -0.12848054    0.03807038   -0.00018813   -0.02448653
C    1.73462380   -1.32815167    0.10372494   -0.04407443   -0.04500774    0.01509384
H    0.10537355    2.55689289   -0.40959154    0.01575444    0.01075840   -0.01391642
H    0.00128744   -2.55821709   -0.22900005   -0.00808419    0.02258477   -0.00768438
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H    2.46039362   -2.16092457    0.02087589    0.00905215   -0.00852633   -0.00448481
C    2.38549506    0.06823477    0.04270525    0.02650486    0.02958605   -0.00878147
H    3.46473006    0.12620759    0.18155499    0.00144650    0.00435735    0.00390830
   15
   -420.48978291
H   -2.81915583    0.57136608   -0.12380635   -0.04439684   -0.01148074   -0.01532558
O   -2.05279653    1.19973484    0.16712211    0.01337062   -0.00551707    0.01824395
O   -1.95654126   -1.12510612   -0.11537722   -0.01438253    0.04808999    0.00134662
C   -0.81112337    0.64036587    0.01871605    0.00395030   -0.12136561   -0.01128930
C   -0.76865813   -0.69967085    0.00571141    0.01901520    0.09040014    0.00216826
C    0.25257532    1.49911623   -0.11334990   -0.02202725   -0.01310363    0.02149134
C    0.41824569   -1.59316893    0.03994643    0.03832451   -0.01245187    0.01361772
C    1.69083425    1.23829926   -0.11497151    0.03813835   -0.00674220   -0.01867875
C    1.74515414   -1.33054937    0.08552000   -0.00984112   -0.07091300    0.01022267
H    0.11611895    2.57220981   -0.39228368    0.01488659    0.01784700   -0.01351922
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H    2.09254837    2.25056677   -0.05661734   -0.02583297    0.01138965    0.00532412
H    2.40985693   -2.14062150   -0.04286620   -0.01677307    0.01768722   -0.00365317
C    2.37874307    0.06916201    0.05694261    0.01172635    0.03477149   -0.00724483
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   15
   -420.49837810
H   -2.75802518    0.56835192   -0.06363466   -0.00851567    0.01185612   -0.00284269
O   -2.05441434    1.20039101    0.17194000   -0.01944208   -0.02815093    0.00879177
O   -1.94401186   -1.13178917   -0.10792022    0.02279221    0.05806011    0.00444477
C   -0.80945493    0.65038779    0.00447100    0.00468623   -0.10840092   -0.01176458
C   -0.79343165   -0.70172762   -0.00774261   -0.02477426    0.06762498   -0.00552734
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C    0.41732111   -1.57776042    0.04961427    0.03737717    0.00199707    0.01568117
C    1.68471156    1.22774503   -0.10033505    0.03372834   -0.01148548   -0.01242797
C    1.75629854   -1.32869840    0.06670914    0.02037488   -0.08816036    0.00325233
H    0.11621792    2.57511083   -0.36538063    0.01283675    0.01770637   -0.01081131
H   -0.01427105   -2.57871002   -0.11473876   -0.01727965    0.00118695   -0.00691551
H    2.11781334    2.22464929   -0.06119460   -0.02285221    0.00900273    0.00298155
H    2.37094712   -2.13267852   -0.10409045   -0.03480812    0.03695994   -0.00129929
C    2.37126692    0.06799466    0.07161410   -0.00014713    0.03830138   -0.00494529
H    3.45523664    0.19483640    0.24492929    0.00919628    0.01066707    0.00584768
   15
   -420.50295155
H   -2.69138226    0.55591919   -0.00136040    0.03503810    0.04702921    0.00809585
O   -2.05511687    1.20237944    0.17635723   -0.05833036   -0.06248194    0.00049048
O   -1.93254252   -1.14111560   -0.10066233    0.06648244    0.07036571    0.00688145
C   -0.80807009    0.66689602   -0.00906454    0.00550809   -0.08163989   -0.01183370
C   -0.81667967   -0.70780769   -0.02086707   -0.07367948    0.03176756   -0.01226808
C    0.27109198    1.48935712   -0.15066306   -0.00462393   -0.01843818    0.00802512
C    0.41416184   -1.56246594    0.05834141    0.03132572    0.01519385    0.01625024
C    1.67657534    1.21788027   -0.08494600    0.02411193   -0.01517530   -0.00637782
C    1.76632651   -1.32167691    0.04767831    0.02911887   -0.07517139    0.00053789
H    0.10712530    2.56568284   -0.33077974    0.00989867    0.01054994   -0.00662089
H   -0.00519086   -2.59474178   -0.04998320   -0.01948692   -0.00942813   -0.00450257
H    2.15934755    2.19221599   -0.06792834   -0.01675323    0.00719839    0.00078232
H    2.35563593   -2.14954737   -0.16406714   -0.02992436    0.02794142   -0.00387362
C    2.36377301    0.06452297    0.08657944   -0.00672935    0.03945897   -0.00162725
H    3.44184022    0.21874756    0.27064847    0.00803429    0.01284112    0.00607483
   15
   -420.50704653
H   -2.64745203    0.51169622    0.05596539    0.03957344    0.04921842    0.00592298
O   -2.05333281    1.20707517    0.18070055   -0.05792587   -0.06442808    0.00443881
O   -1.92407943   -1.15363061   -0.09371008    0.10709984    0.08149216    0.00765014
C   -0.80702864    0.68830397   -0.02188705    0.00839871   -0.04730706   -0.01138819
C   -0.83548904   -0.71579752   -0.03326098   -0.11876262   -0.00638031   -0.01675546
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C    0.40912846   -1.54806704    0.06609030    0.02117012    0.02378970    0.01593241
C    1.66700609    1.20893052   -0.06916760    0.00954691   -0.01827929   -0.00104594
C    1.77466292   -1.31022070    0.02858725    0.02423807   -0.04066072    0.00294212
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H    2.21277691    2.15453661   -0.07523754   -0.00782656    0.00640350   -0.00121395
H    2.36104706   -2.18532067   -0.22088826   -0.01144797   -0.00073741   -0.01215524
C    2.35665751    0.05867763    0.10163851   -0.00767077    0.03807664    0.00260233
H    3.42289770    0.23347602    0.29203583    0.00294001    0.01392663    0.00558322
   15
   -420.50873909
H   -2.62968862    0.43486117    0.10926573    0.00770573    0.00819017   -0.00034999
O   -2.04906078    1.21451684    0.18482983   -0.02275839   -0.02330901    0.01193262
O   -1.92040923   -1.16981332   -0.08709606    0.13011062    0.08464273    0.00605057
C   -0.80651292    0.71256519   -0.03402186    0.01463774   -0.01131560   -0.01073313
C   -0.84720811   -0.72344991   -0.04465674   -0.14550239   -0.03504140   -0.01828699
C    0.29084741    1.48399042   -0.18991920    0.00764802   -0.02206546   -0.00560703
C    0.40282631   -1.53507630    0.07287531    0.00867494    0.02634868    0.01565238
C    1.65687560    1.20108088   -0.05332050   -0.00815551   -0.02025845    0.00321986
C    1.78151938   -1.29628947    0.00932195    0.02136899   -0.00828486    0.00486093
H    0.07012849    2.53295314   -0.25053183    0.00238193   -0.01189073    0.00170593
H    0.05344221   -2.60320340    0.08652871   -0.01356420   -0.01530478    0.00282938
H    2.27173943    2.11223290   -0.08168369    0.00275162    0.00571335   -0.00300435
H    2.37493054   -2.22084347   -0.26899206    0.00400880   -0.02572275   -0.02007076
C    2.34998590    0.05054070    0.11653807   -0.00469187    0.03441140    0.00723828
H    3.40199013    0.23824222    0.30943284   -0.00459784    0.01388603    0.00458174
   15
   -420.50367043
H   -2.61813366    0.35156749    0.16236276   -0.01573363   -0.02668435    0.00019658
O   -2.04370506    1.22304369    0.18844595    0.00181239    0.01327084    0.01272780
O   -1.92253418   -1.18978307   -0.08074854    0.12492011    0.07385645    0.00233635
C   -0.80689070    0.73752609   -0.04550689    0.02235928    0.02172926   -0.01015642
C   -0.85028094   -0.72906907   -0.05495846   -0.14226674   -0.04689773   -0.01748956
C    0.30019797    1.48325068   -0.20923491    0.01245263   -0.03210857   -0.01039808
C    0.39600209   -1.52364795    0.07870982   -0.00434083    0.02282862    0.01611572
C    1.64723829    1.19444521   -0.03766199   -0.02580618   -0.02001774    0.00626643
C    1.78705372   -1.28180007   -0.01022076    0.02422154    0.01310324    0.00361773
H    0.04768740    2.52511971   -0.21080939   -0.00283839   -0.01584846    0.00471314
H    0.09881141   -2.59143105    0.15311937   -0.00660284   -0.00996254    0.00585980
H    2.32875464    2.06590867   -0.08598393    0.01277069    0.00348595   -0.00449538
H    2.38640391   -2.23860650   -0.30287462    0.01171338   -0.03829454   -0.02424747
C    2.34359543    0.04033369    0.13100213   -0.00120725    0.02850439    0.01142150
H    3.38435761    0.23305698    0.32353272   -0.01149394    0.01305111    0.00355157
   15
   -420.49785113
H   -2.59629559    0.28616400    0.21509394   -0.02206116   -0.04024545    0.00462774
O   -2.03836624    1.23104438    0.19149828    0.00943604    0.03040676    0.00974694
O   -1.93022780   -1.21305356   -0.07450445    0.09379944    0.04994450   -0.00206972
C   -0.80860514    0.76120349   -0.05637887    0.02699057    0.04872855   -0.00931492
C   -0.84489620   -0.73193456   -0.06420629   -0.11033093   -0.04253491   -0.01589621
C    0.30879240    1.48448028   -0.22792250    0.01778381   -0.04736499   -0.01499489
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C    1.63914286    1.18900612   -0.02237674   -0.03970897   -0.01700977    0.00817005
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   15
   -420.49415971
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   15
   -420.48967889
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   15
   -420.48151501
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   15
   -420.47268827
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   15
   -420.46733229
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   15
   -420.46387207
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   15
   -420.46291346
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C    1.64734647    1.16366706    0.06614682   -0.01221939   -0.02910257    0.02315981
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   15
   -420.46355852
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   15
   -420.46349990
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O   -1.99908997   -1.40247157   -0.00880608   -0.08795410   -0.06972693    0.00160140
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   15
   -420.46422647
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C   -0.80279800   -0.73234570   -0.10572334    0.05569166    0.03060173   -0.01878708
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   15
   -420.46697970
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C    0.41029554   -1.48090992    0.06542522    0.08142181    0.01902266    0.01628770
C    1.67620430    1.17768854    0.09126027    0.00915016   -0.05487756    0.01980365
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C    2.32155468   -0.03787896    0.22354669    0.00534474   -0.02829590    0.03963496
H    3.39241530   -0.16181062    0.36504524    0.00009172   -0.01476331   -0.00568147
   15
   -420.47061877
H   -2.64492373    0.51035426    0.45106519   -0.02800420   -0.01926950    0.01751807
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O   -1.96197516   -1.41847368    0.01385990   -0.04957252   -0.05478412    0.00576101
C   -0.79254764    0.75440513   -0.17896297    0.01328600   -0.02129003   -0.02055857
C   -0.84320804   -0.74691996   -0.10155305    0.00802204    0.02345333   -0.01692648
C    0.33339524    1.66100317   -0.31002841   -0.01348611    0.05566485   -0.02552848
C    0.40448754   -1.48688913    0.05783879    0.08391693    0.02227182    0.01586862
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   15
   -420.47483530
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   15
   -420.47742459
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   15
   -420.47838585
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O   -1.90768535   -1.41375973    0.03461215    0.07103660    0.00586777   -0.00174769
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C   -0.90131199   -0.77631245   -0.08829694   -0.10722919   -0.03306877   -0.00411650
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C    1.67920614   -1.23255503   -0.15322930   -0.01163347    0.01065496   -0.04379131
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   15
   -420.47823806
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C   -0.91112516   -0.78397372   -0.08295290   -0.14307401   -0.05645654    0.00182139
C    0.34725012    1.66197435   -0.27577696    0.00747184    0.08139749   -0.00618133
C    0.33879198   -1.52496529    0.01705235    0.00089473    0.01574111    0.02406031
C    1.69898959    1.25463001    0.09737280    0.00847146   -0.00742668   -0.00190128
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   15
   -420.47523175
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C   -0.91240047   -0.78827502   -0.07770945   -0.15615220   -0.06908553    0.00584151
C    0.35046038    1.65013214   -0.26558563    0.01523869    0.06557831    0.00091663
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C    1.70072780    1.27268734    0.09741275   -0.00046801   -0.00310260   -0.00948287
C    1.67946346   -1.24205569   -0.13052066    0.00240739    0.03522979   -0.03738790
H    0.19075412    2.66812020   -0.59807139    0.00884285   -0.00443034   -0.01378849
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   15
   -420.47609626
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O   -1.88108446   -1.41069671    0.05617899    0.14047576    0.03648762   -0.00974198
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C   -0.90439786   -0.78848378   -0.07280151   -0.13683618   -0.06508529    0.00639876
C    0.35274163    1.63435782   -0.25545508    0.02436260    0.04303643    0.00901597
C    0.29916038   -1.55060948   -0.01136784   -0.06062881    0.00256500    0.02619873
C    1.70248218    1.29090978    0.09801125   -0.00701035    0.00562541   -0.01411756
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C    2.32008498    0.03289480    0.15789741    0.02425653    0.00368621    0.00997103
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   15
   -420.48357336
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O   -1.88449653   -1.41292362    0.06418668    0.11134230    0.01687813   -0.00642288
C   -0.76796744    0.72095132   -0.19932775    0.01132607   -0.01129729   -0.03596192
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C    1.70463852    1.30876956    0.09944080   -0.00916198    0.01880072   -0.01423633
C    1.67895524   -1.25903534   -0.09895821    0.02822816    0.00613895   -0.02148688
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   15
   -420.49086572
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O   -1.89291314   -1.41589684    0.07247937    0.06948074   -0.00804409   -0.00153710
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C   -0.86672650   -0.77833365   -0.06394663   -0.03184339   -0.02404444   -0.00043593
C    0.35240671    1.59633477   -0.23719223    0.03735180    0.00231127    0.01864496
C    0.27379845   -1.57718246   -0.04600744   -0.10281067    0.00275472    0.02280304
C    1.70732038    1.32547543    0.10170570   -0.00562660    0.03529084   -0.00928270
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   15
   -420.48974580
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O   -1.94137705    1.32232957    0.18146507   -0.01425117   -0.01119450    0.02506217
O   -1.90448451   -1.41851601    0.08084249    0.02788246   -0.03033582    0.00319561
C   -0.77068071    0.72335390   -0.18747970   -0.00928134    0.00825440   -0.03677726
C   -0.84324551   -0.77038078   -0.05960345    0.02229215   -0.00168359   -0.00451549
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C    2.30383878    0.06432707    0.11453759    0.01297369    0.01162924   -0.01814418
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   15
   -420.48428152
H   -2.60614330    0.72015784   -0.02781968    0.04612374    0.03832754    0.00528173
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C   -0.82104411   -0.76231193   -0.05499307    0.06300045    0.01795545   -0.00742989
C    0.34350881    1.55732408   -0.22312031    0.02780179   -0.01857954    0.01332776
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C    1.71309965    1.35144185    0.10733337    0.01438857    0.06607061    0.00915668
C    1.66252678   -1.28043785   -0.04319868    0.05684283   -0.07357760    0.00323617
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C    2.29651240    0.07357145    0.10150084    0.01129159    0.01261411   -0.02612362
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   15
   -420.48476567
H   -2.57876167    0.71054454   -0.08366305    0.04322278    0.03037479    0.00258174
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O   -1.92995586   -1.41895111    0.09697466   -0.03179549   -0.05721601    0.00966989
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C   -0.80257173   -0.75531853   -0.04994178    0.08768506    0.03547819   -0.00864934
C    0.33633636    1.53923628   -0.21740769    0.01344035   -0.02419834    0.00715662
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C    1.71503146    1.35889714    0.10962304    0.02200179    0.06951914    0.01451313
C    1.65041717   -1.28016546   -0.02438579    0.02378515   -0.04937193    0.01364855
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H    2.33964984    2.07028352    0.59062307   -0.00349212   -0.02697504    0.00680873
H    2.29950199   -2.11210546   -0.12751996   -0.01810466    0.01218387   -0.00421943
C    2.28849139    0.08205167    0.09003282    0.01191809    0.01385934   -0.03188495
H    3.27899547    0.14986744    0.56768137   -0.00005413    0.01622558    0.01331282
   15
   -420.48544004
H   -2.58086171    0.68052812   -0.14065834    0.01360130   -0.00105309   -0.01101969
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O   -1.94114945   -1.41554155    0.10444926   -0.04922749   -0.06316621    0.01154007
C   -0.76957627    0.72188509   -0.15335206   -0.02274976    0.03393483   -0.03101836
C   -0.78933147   -0.75046108   -0.04437640    0.09830075    0.05103123   -0.00806552
C    0.32836426    1.52262125   -0.21212869   -0.00349625   -0.03163413    0.00105696
C    0.29650489   -1.63298146   -0.13006342   -0.06764514   -0.00848262    0.00683183
C    1.71566684    1.36221065    0.11106277    0.02303827    0.06083579    0.01455542
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   15
   -420.48124530
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O   -1.95013274   -1.40928018    0.11140292   -0.06038152   -0.06530766    0.01266842
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   15
   -420.47869977
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O   -1.95639551   -1.40006921    0.11778489   -0.06635984   -0.06380662    0.01295388
C   -0.76254856    0.71167922   -0.12105792   -0.00753050    0.03949493   -0.02234088
C   -0.78057704   -0.75071098   -0.03193211    0.09234676    0.07157292   -0.00268744
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C    1.61525212   -1.26710233    0.02465321   -0.07710695   -0.00402219    0.03740398
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   15
   -420.48320415
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O   -1.95966654   -1.38797733    0.12358277   -0.06715028   -0.05847363    0.01225781
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C   -0.78472857   -0.75704625   -0.02537449    0.08084684    0.07369036    0.00131230
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C    0.35759343   -1.66992933   -0.19825861    0.02572235   -0.03646738   -0.00828950
C    1.71001522    1.35433627    0.11049102    0.01594586    0.01021584    0.01404671
C    1.61060862   -1.26166128    0.03695139   -0.08632462   -0.00800534    0.03878321
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   15
   -420.49269742
H   -2.57474280    0.68372391   -0.23060515   -0.00193777   -0.01832665   -0.01841906
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O   -1.95991459   -1.37324815    0.12882834   -0.06149924   -0.04891918    0.01051642
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C   -0.79374372   -0.76780359   -0.01889923    0.06407266    0.06886569    0.00587926
C    0.30595767    1.48399622   -0.18822738   -0.03370607   -0.08098895   -0.02500556
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C    1.70606690    1.34912985    0.10868975    0.01737047    0.00007980    0.01797409
C    1.61109158   -1.25570132    0.04691822   -0.07665202   -0.01904015    0.03731801
H   -0.08214598    2.53426057   -0.11307285   -0.01292435    0.01211488    0.00837902
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C    2.23781125    0.10713415    0.06493927   -0.01321363    0.03716092   -0.04355368
H    3.26505331    0.05082010    0.42781524   -0.00387989    0.00280017    0.00926042
   15
   -420.49802970
H   -2.55615809    0.73030935   -0.21214637    0.02790821    0.01133231   -0.00345431
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O   -1.95740482   -1.35631702    0.13360069   -0.04711026   -0.03464205    0.00771267
C   -0.74937189    0.67986042   -0.06344706    0.00618936    0.01568263   -0.00423569
C   -0.80659891   -0.78268739   -0.01278239    0.04030074    0.05635491    0.01097605
C    0.30500054    1.48510350   -0.17959079   -0.02931450   -0.07481668   -0.03251801
C    0.39414668   -1.68467762   -0.24174250    0.06393944   -0.03606302   -0.01627877
C    1.70105938    1.34388224    0.10579740    0.02050701   -0.00285018    0.02268248
C    1.61609594   -1.24855185    0.05463941   -0.04495566   -0.03716566    0.03374067
H   -0.05012295    2.54599801   -0.04699962   -0.00817680    0.01614667    0.01302477
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C    2.22761549    0.10666699    0.06733481   -0.02772828    0.03968725   -0.04314085
H    3.28115213    0.01259739    0.38069966    0.00419488   -0.00337331    0.00946211
   15
   -420.49560598
H   -2.55759368    0.76879281   -0.19102355    0.05448241    0.03837667    0.00804842
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O   -1.95280003   -1.33783341    0.13802715   -0.02144066   -0.01525600    0.00381737
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C    0.40713776   -1.68874102   -0.26212617    0.07022337   -0.03395547   -0.02071331
C    1.69481013    1.33877009    0.10153677    0.02385949    0.00138773    0.02668030
C    1.62376895   -1.23916772    0.06031738   -0.00479080   -0.05161638    0.03080367
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C    2.21908238    0.10381844    0.07232365   -0.03945567    0.03846688   -0.03963201
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   15
   -420.49644955
H   -2.59558835    0.78194180   -0.17462673    0.03978349    0.03026561    0.00341955
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O   -1.94726854   -1.31867476    0.14228469    0.01628024    0.00859240   -0.00119120
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C   -0.83747981   -0.82135111   -0.00289024   -0.03559543    0.00997672    0.02275374
C    0.30788834    1.49969679   -0.15610722   -0.01172148   -0.03202469   -0.04096532
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C    1.68713214    1.33355741    0.09567329    0.02428350    0.00872364    0.02859459
C    1.63186457   -1.22680565    0.06411457    0.01068391   -0.03877420    0.03101281
H    0.02614674    2.53853768    0.05514610    0.00717318    0.00182198    0.01675585
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C    2.21291264    0.09866839    0.07969460   -0.04665919    0.03230026   -0.03318351
H    3.30080022   -0.05227539    0.26750915    0.01115999   -0.01442764    0.00451929
   15
   -420.49665441
H   -2.66044255    0.77452714   -0.16037011   -0.00362482    0.00188886   -0.00677953
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C   -0.73910428    0.64035593   -0.00363433    0.00831395   -0.02620283    0.01534520
C   -0.85093536   -0.84235450    0.00017612   -0.08342935   -0.01814314    0.02875649
C    0.31068112    1.51063648   -0.14075552   -0.00077062   -0.00388066   -0.04074150
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C    1.67802047    1.32783915    0.08809132    0.01785325    0.01184517    0.02846113
C    1.63946719   -1.21224614    0.06603691   -0.00228930    0.00194971    0.03117470
H    0.05951590    2.52941798    0.08856969    0.01485281   -0.01237644    0.01529068
H    0.09931474   -2.71817664   -0.50664937   -0.01504526   -0.00134201   -0.00369974
H    2.20086789    2.25360035    0.02487220   -0.02220537   -0.00578753   -0.00602789
H    2.46175802   -1.88120181    0.05273256   -0.00881857    0.02572386   -0.00091963
C    2.20954000    0.09159142    0.08906263   -0.04892523    0.02091908   -0.02476854
H    3.29946119   -0.07106326    0.20494126    0.00790737   -0.01763241    0.00022824
   15
   -420.48730053
H   -2.72342116    0.76504986   -0.14164541   -0.03681362   -0.01652238   -0.01075749
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O   -1.94051625   -1.28267080    0.15122370    0.10189799    0.05481128   -0.01190520
C   -0.73663881    0.62924093    0.01495738    0.00833799   -0.03786045    0.02035359
C   -0.85938189   -0.86228305    0.00151117   -0.12369301   -0.04177654    0.03314272
C    0.31351385    1.52184445   -0.12294686    0.01149123    0.01752966   -0.03915671
C    0.42131179   -1.68872398   -0.31456066    0.05319780   -0.03489176   -0.03576268
C    1.66786971    1.32144686    0.07878976    0.00354343    0.00696336    0.02792351
C    1.64719698   -1.19781204    0.06608866   -0.01455463    0.04514994    0.02862141
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H    2.50525126   -1.92027490    0.09185460    0.02191053   -0.00122344    0.00174498
C    2.20910312    0.08326990    0.09992560   -0.04659112    0.00552674   -0.01575543
H    3.29264861   -0.07729099    0.14220205    0.00104217   -0.01853639   -0.00398728
   15
   -420.47770292
H   -2.76109076    0.76663728   -0.11549636   -0.05028639   -0.02110110   -0.00941299
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O   -1.94306908   -1.26787623    0.15637736    0.12090085    0.06526334   -0.01400763
C   -0.73467492    0.62040098    0.03232330    0.00779303   -0.04658405    0.02431940
C   -0.86046943   -0.87973801    0.00086060   -0.13997140   -0.05506021    0.03378868
C    0.31564573    1.53206865   -0.10276625    0.02483844    0.02412770   -0.03821551
C    0.41889809   -1.68459290   -0.32812641    0.04056150   -0.03522742   -0.04009921
C    1.65752600    1.31465440    0.06779615   -0.01498408   -0.00203542    0.02791048
C    1.65573899   -1.18604488    0.06441607   -0.01417716    0.07623398    0.02463545
H    0.09133743    2.54385045    0.12362229    0.01993131   -0.02051806    0.01333539
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H    2.19097602    2.24963843   -0.11770426   -0.01632085    0.00984538   -0.01105308
H    2.53388745   -1.95910900    0.12963881    0.03805320   -0.01820837    0.00572708
C    2.21146863    0.07462172    0.11174459   -0.04123863   -0.01133745   -0.00735036
H    3.28515366   -0.07030526    0.08227715   -0.00683831   -0.01726127   -0.00737312
   15
   -420.47763303
H   -2.76361686    0.78281182   -0.08269769   -0.04552733   -0.01492882   -0.00587247
O   -1.90174147    1.36402934   -0.03385424    0.03185392    0.04690207   -0.00542051
O   -1.95098884   -1.25599589    0.16214995    0.10905432    0.06348224   -0.01167451
C   -0.73317983    0.61435940    0.04822279    0.00672128   -0.05155923    0.02738229
C   -0.85326245   -0.89392052   -0.00180677   -0.12289476   -0.05713030    0.02923536
C    0.31627954    1.54090497   -0.08027159    0.03729383    0.01687066   -0.03772357
C    0.41403768   -1.67834848   -0.33927479    0.02658480   -0.03221631   -0.04286451
C    1.64808174    1.30797395    0.05511572   -0.03224802   -0.00899441    0.02764583
C    1.66509751   -1.17881567    0.06125433   -0.00550411    0.09281027    0.02045475
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H    2.53587532   -1.98541197    0.16331153    0.04147302   -0.02541736    0.00948667
C    2.21632812    0.06664976    0.12401273   -0.03584137   -0.02634308    0.00017770
H    3.28240314   -0.05098182    0.02760404   -0.01174179   -0.01447759   -0.00993222
   15
   -420.48538882
H   -2.73460699    0.80902764   -0.04564737   -0.01979581    0.00314498   -0.00279190
O   -1.90551316    1.35791867   -0.05171819    0.00272998    0.03164203   -0.00973014
O   -1.96376099   -1.24696466    0.16843723    0.07216440    0.05340308   -0.00542322
C   -0.73209038    0.61141681    0.06246997    0.00546364   -0.05271259    0.02966567
C   -0.83876391   -0.90467938   -0.00621842   -0.07813665   -0.05297519    0.01999770
C    0.31467975    1.54874570   -0.05550376    0.04540113    0.00455589   -0.03561664
C    0.40757660   -1.67017851   -0.34784191    0.01119123   -0.02473927   -0.04344301
C    1.64055884    1.30181071    0.04077095   -0.04377516   -0.01076507    0.02588286
C    1.67476910   -1.17712115    0.05685387    0.00743052    0.09356860    0.01664593
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   15
   -420.49079018
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   15
   -420.48960635
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O   -1.99697648   -1.23559713    0.18137703   -0.01616674    0.03014636    0.01012183
C   -0.73084368    0.61490177    0.08550257    0.00384635   -0.04477530    0.03188564
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   15
   -420.48585094
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O   -2.01348688   -1.23222498    0.18733647   -0.04775807    0.02220642    0.01620292
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C    1.63373015    1.28596403   -0.01033243   -0.02555121    0.00977222    0.00382845
C    1.69630138   -1.19967575    0.03800104    0.06776239   -0.01117642    0.01564969
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C    2.25584148    0.05452578    0.16840918   -0.02134029   -0.02818343    0.02980245
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   15
   -420.48049221
H   -2.69110448    0.75388105    0.13368364   -0.01888876   -0.00063258    0.00923310
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O   -2.02787050   -1.22986988    0.19256715   -0.06873180    0.01672901    0.02059103
C   -0.73059001    0.62900664    0.10087348    0.00529440   -0.02676336    0.03152005
C   -0.76661833   -0.91688037   -0.02877151    0.10702259   -0.05572725   -0.02387763
C    0.28355278    1.58072948    0.06085451   -0.00078709    0.00670049    0.00073880
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C    1.63550038    1.28021298   -0.02858038   -0.00943380    0.01547176   -0.00731265
C    1.69704720   -1.20953579    0.02993018    0.05815303   -0.03040803    0.01077703
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C    2.26967114    0.05657166    0.17608860   -0.01086803   -0.01675440    0.03411967
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   15
   -420.47482087
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O   -1.90615317    1.31722881   -0.13401273    0.03223538    0.05189141   -0.03557141
O   -2.03916660   -1.22827929    0.19686904   -0.08140070    0.01272975    0.02350091
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C    0.27309511    1.58871508    0.09150616   -0.02292532    0.01859579    0.01188098
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C    1.69441271   -1.21773549    0.02124778    0.02259142   -0.01621053   -0.00152364
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C    2.28413926    0.05962808    0.18171755    0.00322088   -0.00475303    0.03590717
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   15
   -420.46911354
H   -2.67830154    0.66570503    0.20625362   -0.03961324   -0.02205682    0.02536703
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O   -2.04679118   -1.22726900    0.20010920   -0.08815489    0.00950761    0.02519918
C   -0.73165077    0.64954247    0.10865645    0.00784287   -0.00635824    0.02924338
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C    0.26400182    1.59559992    0.12144345   -0.04072495    0.02583136    0.02226414
C    0.38837211   -1.61195774   -0.35053554   -0.04038935    0.01242747   -0.02311964
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C    1.69040857   -1.22497051    0.01265346   -0.01345042    0.00242675   -0.01338288
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   15
   -420.46666196
H   -2.63088767    0.64277598    0.21760491   -0.02536862   -0.01751865    0.02435842
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O   -2.05043250   -1.22669215    0.20220971   -0.09036512    0.00684327    0.02588309
C   -0.73285418    0.66069854    0.10985706    0.00664872    0.00269855    0.02735737
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C    0.25733222    1.60096945    0.15003181   -0.05087202    0.02408197    0.03309866
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C    1.68716005   -1.23229686    0.00484513   -0.03837536    0.01072695   -0.02079191
H   -0.11057153    2.57607759   -0.10486138   -0.00416418   -0.01373277   -0.00715100
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H    2.40765495    1.99362687   -0.35401832    0.01705743   -0.01381422   -0.00398278
H    2.34112593   -2.18172534    0.20532323    0.01399029   -0.03872777    0.01658738
C    2.31151278    0.06594633    0.18649257    0.03337655    0.01555364    0.03488479
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   15
   -420.46851605
H   -2.56611573    0.63174524    0.21193147    0.00388934   -0.00095009    0.01480508
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O   -2.04999085   -1.22642853    0.20313953   -0.08791720    0.00492068    0.02557619
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C   -0.78046071   -0.87702354   -0.03152157    0.09430188   -0.04154693   -0.03169632
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C    1.64489544    1.25141473   -0.09223058   -0.00725872   -0.01878247   -0.03394973
C    1.68617603   -1.24022633   -0.00172704   -0.05195440    0.00981120   -0.02392948
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H    2.34605958   -2.21084109    0.17859013    0.01736331   -0.04501742    0.01580579
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   15
   -420.47146820
H   -2.50466783    0.62068183    0.19606165    0.04054725    0.02618998   -0.00159868
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O   -2.04558290   -1.22639256    0.20291329   -0.07938029    0.00417754    0.02409238
C   -0.73622571    0.68213692    0.10744452   -0.00140857    0.01381032    0.02212646
C   -0.80037493   -0.85969760   -0.02733507    0.06460343   -0.03065194   -0.02824749
C    0.25328388    1.60788199    0.20048702   -0.05144745    0.00857045    0.05587593
C    0.40708381   -1.59118630   -0.32998391    0.02539643    0.01439177   -0.01485745
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C    1.68827779   -1.24871180   -0.00687082   -0.05407771    0.00114889   -0.02326150
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H    0.34281106   -2.64127764   -0.60195408    0.01396268    0.00075438   -0.00158727
H    2.41629762    2.02008941   -0.35977907    0.02553040   -0.00161469   -0.00619634
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C    2.33134795    0.06873064    0.18281814    0.03877876    0.02531442    0.03343809
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   15
   -420.47578594
H   -2.47117262    0.59160472    0.18079299    0.05666387    0.03899635   -0.00884507
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O   -2.03760344   -1.22655278    0.20159947   -0.06281138    0.00520169    0.02112568
C   -0.73792741    0.69174866    0.10414880   -0.00417533    0.01558604    0.01857024
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C    0.41220781   -1.58574548   -0.32107190    0.04741303    0.01850760   -0.01180805
C    1.65108985    1.24089255   -0.11302837   -0.00734478   -0.02624288   -0.04448817
C    1.69357926   -1.25721517   -0.01062608   -0.04201763   -0.01787432   -0.01899478
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H    2.39407859    2.03708552   -0.35627409    0.02094079   -0.00042094   -0.00549612
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C    2.33774673    0.06794822    0.17793100    0.02992413    0.02715798    0.03147248
H    3.42804233    0.16465193    0.12733878    0.00545513    0.01129638   -0.00181463
   15
   -420.48071160
H   -2.47620199    0.53668828    0.17062820    0.03737030    0.01764549    0.00315784
O   -1.91865063    1.22465946   -0.19316932    0.01033717   -0.02189465   -0.01390035
O   -2.02680872   -1.22695844    0.19933334   -0.03713080    0.00865668    0.01652385
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C    0.26151756    1.61232688    0.23763996   -0.04286293    0.01002630    0.06867969
C    0.41449746   -1.58140382   -0.31143674    0.06286506    0.01870172   -0.01051635
C    1.65488555    1.23793555   -0.11955320   -0.00130381   -0.02309486   -0.04968283
C    1.70134145   -1.26457568   -0.01324331   -0.01452817   -0.04835099   -0.01269996
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H    0.21187365   -2.63745907   -0.61567200   -0.00261488   -0.01542165   -0.00773374
H    2.35707703    2.05460251   -0.34887329    0.01145540   -0.00281163   -0.00378029
H    2.30681055   -2.13302122    0.04060820   -0.02163068    0.01150023    0.00364442
C    2.34234289    0.06552763    0.17114945    0.01957780    0.02808284    0.02775090
H    3.45222160    0.13438092    0.18232402    0.01611971    0.00771989    0.00218464
   15
   -420.47959554
H   -2.50760397    0.46951779    0.15810543    0.00808319   -0.01222220    0.01739669
O   -1.92187213    1.21015506   -0.20026480    0.03916141   -0.00261612   -0.02605717
O   -2.01435807   -1.22776659    0.19632187   -0.00401044    0.01465811    0.01078337
C   -0.74071486    0.70814255    0.09445351    0.00199702    0.01534014    0.00983914
C   -0.87376268   -0.79904234   -0.00571863   -0.06756922   -0.00511382   -0.01216398
C    0.26965756    1.61371322    0.25015098   -0.03803717    0.01969115    0.06919780
C    0.41303088   -1.57816558   -0.30115363    0.06929544    0.01340647   -0.01156695
C    1.65875236    1.23636048   -0.12307716    0.00618832   -0.01713137   -0.05407153
C    1.70996070   -1.26903196   -0.01508528    0.01627224   -0.07353849   -0.00759041
H   -0.11954490    2.57482626   -0.13308656   -0.01375469   -0.00151927   -0.01731389
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   15
   -420.47725759
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O   -2.00173131   -1.22924578    0.19282077    0.03047897    0.02216054    0.00515916
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C    0.28009316    1.61389197    0.25849200   -0.03217209    0.03252566    0.06678608
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   15
   -420.47714040
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O   -1.99045658   -1.23172526    0.18907891    0.05675729    0.02820767    0.00129065
C   -0.74404356    0.72089928    0.08235482    0.01134625    0.01141634    0.00210815
C   -0.90728012   -0.75618733    0.01298777   -0.14694637    0.00454599   -0.00274037
C    0.29246141    1.61211481    0.26279801   -0.02367100    0.04298920    0.06355036
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   15
   -420.47676093
H   -2.58933664    0.35821237    0.03766988   -0.02308429   -0.03187740    0.01530969
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O   -1.98169338   -1.23546377    0.18526788    0.06636249    0.02883398    0.00018667
C   -0.74660383    0.72617423    0.07600108    0.01249982    0.00832797   -0.00059397
C   -0.91185228   -0.73503570    0.02272355   -0.15853394    0.01585781   -0.00134844
C    0.30624011    1.60778656    0.26325534   -0.01107812    0.04390961    0.06123718
C    0.38497259   -1.57027150   -0.26522971    0.03738068   -0.02978948   -0.02353239
C    1.66741675    1.23708596   -0.11367708    0.00401964   -0.01698677   -0.05315164
C    1.72916771   -1.26068284   -0.01934040    0.00889679    0.01024894    0.01761709
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C    2.35160251    0.03986804    0.13028694    0.02027132    0.01292906    0.01006654
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   15
   -420.47735533
H   -2.58757986    0.36689485   -0.02865768   -0.01375694   -0.01732656    0.00689380
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O   -1.97587031   -1.24048177    0.18143918    0.05747304    0.02198246    0.00147702
C   -0.74990949    0.73094725    0.06967809    0.01160786    0.00488793   -0.00226343
C   -0.90695581   -0.71487988    0.03255152   -0.14666467    0.03426064   -0.00201824
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C    0.36985211   -1.56537938   -0.25077423    0.01798177   -0.04193273   -0.02577858
C    1.66947293    1.23913019   -0.10394752   -0.00470987   -0.02099965   -0.04848944
C    1.73379290   -1.25618166   -0.02203088    0.01000376    0.03140531    0.02687063
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C    2.35158462    0.03060773    0.11798330    0.02811178    0.00430227    0.00820502
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   15
   -420.47936314
H   -2.57664933    0.38716047   -0.09992469    0.00713956    0.01148391   -0.00175788
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O   -1.97260715   -1.24647496    0.17753970    0.03597925    0.00931084    0.00376743
C   -0.75391496    0.73542424    0.06348613    0.01029246    0.00154627   -0.00276662
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C    1.73778180   -1.25351658   -0.02632756    0.01749131    0.03974376    0.03237439
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C    2.34989366    0.02109040    0.10518574    0.03061750   -0.00493878    0.00585930
H    3.37341291   -0.05731655    0.39168393   -0.02024290   -0.01204169    0.01198166
   15
   -420.48253360
H   -2.57087526    0.39902257   -0.17021638    0.02703311    0.04092555   -0.00584652
O   -1.98785946    1.13204064   -0.22046084   -0.01284277   -0.09995029   -0.00206434
O   -1.97096371   -1.25288416    0.17347046    0.01091915   -0.00508584    0.00579891
C   -0.75854894    0.73980324    0.05745557    0.01010071   -0.00087910   -0.00210378
C   -0.87257421   -0.68214366    0.05265568   -0.07820550    0.07559692   -0.00403346
C    0.34762387    1.58243733    0.24309822    0.03592142   -0.00781324    0.04660858
C    0.33736564   -1.54808473   -0.21737000   -0.01436817   -0.03257290   -0.01761197
C    1.67498358    1.24689238   -0.07602751   -0.02143021   -0.01254532   -0.03742301
C    1.74069115   -1.25319614   -0.03255940    0.02956454    0.03604284    0.03327033
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H    2.52522206   -2.07845071   -0.30484222    0.03403265   -0.02243444   -0.01853638
C    2.34639729    0.01186883    0.09204419    0.02424489   -0.01362594    0.00154381
H    3.36905867   -0.06828235    0.39570311   -0.01819867   -0.01263332    0.01324802
   15
   -420.48881985
H   -2.58284727    0.38340009   -0.23657013    0.02027078    0.03944155   -0.00598811
O   -2.00298632    1.12746322   -0.22208479   -0.01840947   -0.09642095   -0.00467183
O   -1.96982882   -1.25907058    0.16914095   -0.01086029   -0.01742831    0.00712420
C   -0.76380101    0.74422617    0.05154751    0.01129707   -0.00147714   -0.00049614
C   -0.84714967   -0.67199878    0.06304595   -0.03718407    0.08591897   -0.00381260
C    0.35830183    1.57329118    0.23019434    0.04563342   -0.02387397    0.03581426
C    0.32196876   -1.53622935   -0.19890461   -0.02961356   -0.01456695   -0.00918188
C    1.67943285    1.25209186   -0.05850183   -0.02612005    0.00137719   -0.03195285
C    1.74177888   -1.25498342   -0.04077335    0.04840834    0.01792627    0.02813412
H    0.16199331    2.69162986    0.23898005    0.00242107    0.02811283    0.00058509
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H    2.19751609    2.21375501   -0.22203069   -0.01521325    0.01767783   -0.00728491
H    2.50254657   -2.02555366   -0.31847657    0.01964755   -0.00112517   -0.01391908
C    2.34146712    0.00346408    0.07881701    0.01154703   -0.02089592   -0.00421096
H    3.37735601   -0.07020570    0.39008128   -0.00874636   -0.01231525    0.01613686
   15
   -420.49211172
H   -2.60812995    0.34101406   -0.29835275   -0.00690490    0.01186295   -0.00978033
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O   -1.96822482   -1.26448034    0.16449036   -0.02650133   -0.02606452    0.00786437
C   -0.76973912    0.74872789    0.04566677    0.01303803    0.00000345    0.00163806
C   -0.81947383   -0.66698708    0.07366369    0.00347200    0.08375973   -0.00296043
C    0.36624783    1.56555307    0.21512824    0.04981301   -0.03281562    0.02421531
C    0.30837762   -1.52350398   -0.17988400   -0.04769957    0.00575660   -0.00067623
C    1.68544119    1.25718823   -0.03904254   -0.02674536    0.01915872   -0.02667924
C    1.73989426   -1.25777843   -0.05065377    0.07533284   -0.01460636    0.01632487
H    0.20549057    2.68262749    0.30672897    0.00676283    0.02605028    0.00581712
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C    2.33584029   -0.00368654    0.06584143   -0.00159703   -0.02625547   -0.00934725
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   15
   -420.48863371
H   -2.62888572    0.28972493   -0.35289471   -0.02795605   -0.01140959   -0.01675523
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O   -1.96544085   -1.26872114    0.15948448   -0.03623188   -0.03108560    0.00817531
C   -0.77646191    0.75322173    0.03968723    0.01398504    0.00299838    0.00370972
C   -0.79200416   -0.66697710    0.08445913    0.04333186    0.06898755   -0.00181413
C    0.37120871    1.55975855    0.19859171    0.04853813   -0.03361141    0.01373841
C    0.29768661   -1.51112101   -0.16081612   -0.06869932    0.02494319    0.00656465
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C    1.73348182   -1.25969583   -0.06151603    0.09536207   -0.04485520    0.00390519
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C    2.33029041   -0.00926027    0.05341942   -0.01097167   -0.02943536   -0.01220240
H    3.40502331   -0.04892073    0.34223152    0.00984605   -0.00748926    0.01956024
   15
   -420.48801727
H   -2.63035970    0.24588335   -0.39545324   -0.03523888   -0.02226263   -0.02256105
O   -2.04570416    1.13385248   -0.22591598    0.00003950   -0.01268588    0.00115501
O   -1.96102873   -1.27156243    0.15410989   -0.04173974   -0.03320523    0.00787790
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C   -0.76714667   -0.67109322    0.09536305    0.08135069    0.04509200   -0.00040558
C    0.37325507    1.55596041    0.18121207    0.04305143   -0.02735460    0.00564577
C    0.29115147   -1.50022710   -0.14213451   -0.08978706    0.04016923    0.01164453
C    1.70209871    1.26294724    0.00437594   -0.02018899    0.04508177   -0.01488995
C    1.72148784   -1.25906564   -0.07267151    0.08056619   -0.04428666    0.00194860
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H    2.42564396   -1.95181366   -0.32865456   -0.02604953    0.05430623    0.00500249
C    2.32537771   -0.01306476    0.04172128   -0.01513007   -0.03041070   -0.01228164
H    3.41140999   -0.02916331    0.29765909    0.01219693   -0.00335510    0.01803806
   15
   -420.49119293
H   -2.60709654    0.21759578   -0.42195605   -0.03163136   -0.02494862   -0.02524868
O   -2.05990888    1.13857551   -0.22713355   -0.00908454   -0.00064774    0.00205548
O   -1.95473229   -1.27290533    0.14838112   -0.04464571   -0.03310575    0.00669459
C   -0.79231730    0.76144840    0.02697776    0.00765449    0.00947906    0.00570104
C   -0.74718298   -0.67792147    0.10628846    0.11401731    0.01824516    0.00163474
C    0.37270880    1.55380427    0.16348045    0.03531803   -0.01876828   -0.00043036
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C    1.71237612    1.26208838    0.02762145   -0.01765789    0.04437161   -0.00831387
C    1.70477000   -1.25589500   -0.08398677    0.03729980   -0.01746956    0.00797408
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H    2.43293565   -1.99907175   -0.33670390    0.00312237    0.02240796   -0.00409688
C    2.32135440   -0.01504195    0.03075405   -0.01414515   -0.02901184   -0.01000338
H    3.40934850   -0.00701619    0.24020983    0.00893662    0.00121473    0.01463068
   15
   -420.49198234
H   -2.56155089    0.20694743   -0.43050310   -0.01956438   -0.02196654   -0.02414331
O   -2.07369257    1.14335112   -0.22843801   -0.02070047    0.00497673    0.00121434
O   -1.94641730   -1.27275289    0.14235263   -0.04555787   -0.03115870    0.00444010
C   -0.80106007    0.76480089    0.02012955   -0.00099955    0.01067923    0.00518523
C   -0.73405955   -0.68587380    0.11710803    0.13560970   -0.00458609    0.00506599
C    0.37002867    1.55280698    0.14577729    0.02715224   -0.01469951   -0.00697603
C    0.29522903   -1.48613087   -0.10697282   -0.10962491    0.04954297    0.01312526
C    1.72372205    1.25858234    0.05137445   -0.01513972    0.03644460   -0.00265739
C    1.68578884   -1.25165404   -0.09577097   -0.00596225    0.00790249    0.01192306
H    0.29879152    2.55042535    0.51562563    0.01976538   -0.02331372    0.01154469
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   15
   -420.49160592
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O   -1.93604528   -1.27119374    0.13612649   -0.04369231   -0.02729098    0.00117748
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   15
   -420.49262006
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   15
   -420.49467198
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   15
   -420.49571086
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O   -1.89477586   -1.26040279    0.11779903    0.00274174    0.00046891   -0.00832547
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C    1.77341156    1.22889383    0.14627753    0.03301768   -0.00063071    0.00454249
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   15
   -420.49188012
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O   -1.87998843   -1.25617019    0.11228110    0.03823406    0.01646655   -0.00899404
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C   -0.77896381   -0.71179642    0.15882622   -0.01222831   -0.02772622    0.03584902
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   15
   -420.48432561
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O   -1.86695772   -1.25269212    0.10716621    0.07921626    0.03431534   -0.00837452
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C    0.33303324    1.57302384    0.06847036   -0.00495434   -0.00592384   -0.04325219
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   15
   -420.48248083
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O   -1.85750004   -1.25076122    0.10243007    0.11435531    0.04945570   -0.00744225
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C    2.31647287   -0.00073978   -0.05603812   -0.04016974    0.02254670    0.02618501
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   15
   -420.48594812
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O   -1.85315713   -1.25103976    0.09803464    0.13013113    0.05553219   -0.00728497
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C    0.39825920   -1.54460808    0.02419613    0.08137733   -0.00962856   -0.01917138
C    1.79131473    1.19764572    0.23637552    0.06670679   -0.02369448    0.01010820
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C    2.32340679   -0.00177712   -0.07105622   -0.03140286    0.01515415    0.02414432
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   15
   -420.48887306
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O   -1.85461884   -1.25378905    0.09397433    0.11993464    0.04886019   -0.00829514
C   -0.82023914    0.78486096   -0.04434339   -0.00364266    0.01102755   -0.00603542
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C    1.78582797    1.19229388    0.25754668    0.05636873   -0.03075473    0.01119229
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H    2.14950399   -2.24114331   -0.28665417   -0.01647890   -0.03464502    0.00979279
C    2.33220512   -0.00370598   -0.08751121   -0.01583113    0.00283898    0.01755807
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   15
   -420.49114716
H   -2.68103699    0.31887274   -0.11128599   -0.02441394   -0.02333460    0.00536448
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O   -1.86144385   -1.25871575    0.09029264    0.08914429    0.03182732   -0.00987416
C   -0.81604499    0.78641416   -0.05061271    0.00092051    0.01689100   -0.00876230
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C    0.30982906    1.59668266    0.06355727   -0.00846741    0.01560794   -0.02401185
C    0.38242213   -1.57224864    0.06496711    0.00861038   -0.05118392   -0.00379967
C    1.77693736    1.18877459    0.27803022    0.04486999   -0.03245419    0.01435791
C    1.67187421   -1.21602672   -0.23008775    0.01363348    0.08548388   -0.01391357
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H    2.20590129   -2.26078236   -0.31199375   -0.00213180   -0.04946132    0.00724187
C    2.34194708   -0.00579893   -0.10501400    0.00235689   -0.01097860    0.00825849
H    3.34399059   -0.09497038   -0.46583281   -0.02202845   -0.01041955   -0.01424093
   15
   -420.49296560
H   -2.71172033    0.40532542   -0.07871840   -0.01552837    0.00148423    0.00359987
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O   -1.87228343   -1.26507183    0.08705747    0.05015454    0.01083989   -0.01105413
C   -0.81190082    0.78695258   -0.05635131    0.00434171    0.02141482   -0.01165538
C   -0.79935831   -0.68366763    0.14737874   -0.04001949    0.02166111    0.02264800
C    0.30547164    1.60000406    0.06667360   -0.00558479    0.00588445   -0.01713600
C    0.37260677   -1.58200963    0.08595737   -0.01894911   -0.05131718    0.00417005
C    1.76532549    1.18718512    0.29763055    0.03484178   -0.02762777    0.02043458
C    1.68198595   -1.21741592   -0.24158781    0.02586658    0.09087919   -0.01738340
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H    2.26409367   -2.24564225   -0.34256207    0.00776511   -0.05003988    0.00492535
C    2.35156542   -0.00723871   -0.12301820    0.01691470   -0.02271959   -0.00073243
H    3.34962702   -0.10576784   -0.47818671   -0.02505447   -0.01231235   -0.01298483
   15
   -420.49184927
H   -2.73192603    0.49031494   -0.04846964    0.00407637    0.03180356   -0.00231282
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O   -1.88540940   -1.27192771    0.08432033    0.01370248   -0.00820089   -0.01131627
C   -0.80801856    0.78620672   -0.06138617    0.00757372    0.02378071   -0.01432967
C   -0.78457514   -0.67643809    0.13954489    0.00188426    0.04381906    0.01792571
C    0.30145970    1.60295679    0.07081787   -0.00416345   -0.00138525   -0.00865115
C    0.36389880   -1.58872559    0.10670443   -0.03885902   -0.03993730    0.01045538
C    1.75159323    1.18723697    0.31598126    0.02741297   -0.01691706    0.02924221
C    1.69056128   -1.22420634   -0.25203985    0.03277238    0.07717314   -0.02025764
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   15
   -420.48739306
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   15
   -420.48030391
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   15
   -420.47064149
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   15
   -420.46374923
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   15
   -420.46132266
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   15
   -420.46149739
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   15
   -420.46369228
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   15
   -420.46771652
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   15
   -420.47385660
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   15
   -420.47816527
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C    2.30777065    0.08886703   -0.22287440    0.03726627    0.02373615   -0.04522472
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   15
   -420.47597726
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O   -1.93261692   -1.27186612    0.07696078    0.03357339    0.02509989   -0.00044656
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C   -0.81832404   -0.79659179    0.05142670   -0.06635327   -0.05091885   -0.02629574
C    0.28847198    1.57288883    0.09259466    0.00275812    0.00119928    0.01072721
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C    1.60053235    1.15579214    0.33305570   -0.02701822   -0.00694685    0.03234048
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C    2.28338280    0.10146231   -0.21513257    0.00576333    0.04596263   -0.03483137
H    3.36535844    0.22524260   -0.04055462    0.00484718    0.01414523    0.01374739
   15
   -420.47123203
H   -2.51776557    0.46503511    0.05776239    0.00530516   -0.03539233    0.01980787
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O   -1.93003283   -1.26894498    0.07701140    0.06034718    0.03760667   -0.00057867
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C   -0.82911113   -0.81064188    0.04978809   -0.09944071   -0.06792124   -0.02633074
C    0.28869158    1.56295536    0.08979787    0.00323089   -0.00035193    0.00407753
C    0.48037957   -1.57584059    0.23832858    0.06193805    0.01798546    0.02311977
C    1.59870526    1.15062951    0.31880991   -0.00907719   -0.02300072    0.02388956
C    1.71383668   -1.28960855   -0.29218254    0.01921047   -0.06291688   -0.02041352
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   15
   -420.46942312
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   15
   -420.47055916
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   15
   -420.47351320
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   15
   -420.47805912
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O   -1.94807214   -1.27506334    0.07729033    0.01267875    0.01980864    0.00115519
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   15
   -420.48428856
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O   -1.95692075   -1.28001505    0.07727723   -0.01688516    0.00678797    0.00079798
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   15
   -420.48973842
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   15
   -420.48975845
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   15
   -420.48605720
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C   -0.75027734    0.68333813   -0.04705881    0.02784874    0.03922213    0.01406288
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   15
   -420.48444049
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   15
   -420.48314345
H   -2.69630695    0.82772600   -0.50472613   -0.02295960    0.00588898   -0.01584139
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C    1.60986646    1.27371432    0.15950145   -0.02811418    0.04338423    0.00681712
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H    2.49937616   -1.94142835   -0.34253857    0.01709750    0.01163275    0.00282824
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   15
   -420.47828729
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O   -1.96948552   -1.30373186    0.07826957   -0.05595862   -0.01792168   -0.00684356
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C   -0.75282429   -0.78007541    0.10332406    0.08955508    0.04671231    0.01667510
C    0.26008255    1.55682330    0.12202656   -0.01016461    0.03341344   -0.02079775
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C    1.61916383    1.28878848    0.14207490   -0.02838301    0.03723572   -0.00029653
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H    2.58619077   -1.90398274   -0.32797095    0.04432286    0.00674046   -0.00011914
C    2.23690591   -0.01571685   -0.09912849   -0.02034804   -0.11658441    0.00797295
H    3.32387389   -0.01556323   -0.26563346    0.00634820   -0.00876611   -0.00573746
   15
   -420.47383722
H   -2.63080615    0.88867554   -0.54392678    0.03352348    0.03731029    0.00804912
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C   -0.76473493    0.62046886   -0.06101498   -0.01467874   -0.05919066   -0.00189847
C   -0.76308314   -0.77999999    0.10799010    0.07824071    0.05066773    0.02016085
C    0.25506635    1.56390557    0.13548217   -0.01566334    0.04242494   -0.01797913
C    0.39953283   -1.59396557    0.12413491   -0.00373651    0.00208705    0.01182363
C    1.63016419    1.30161724    0.12466639   -0.02607133    0.02961589   -0.00748543
C    1.65685163   -1.22897049   -0.20830055   -0.07464738    0.01943839   -0.01129892
H   -0.19193116    2.41053634    0.60480387   -0.00683814   -0.02838066    0.00954509
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C    2.25628779   -0.01061141   -0.09099599    0.00939222   -0.10261585    0.01149035
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   15
   -420.47684582
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O   -1.95292754   -1.30561222    0.08041923   -0.02333878   -0.00649407   -0.00841547
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   15
   -420.48441201
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O   -1.94265510   -1.30596540    0.08205060    0.00441225    0.00403910   -0.00857503
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   15
   -420.48887586
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O   -1.89330754    1.33039584   -0.17773535    0.04780251    0.02114186    0.02305657
O   -1.93261190   -1.30651408    0.08406937    0.03975498    0.01772565   -0.00828759
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C   -0.81636052   -0.79691092    0.11397166   -0.01272464    0.01972501    0.02800013
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C    2.30571716    0.03729175   -0.07136938    0.04970428   -0.04233161    0.02052005
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   15
   -420.48886598
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O   -1.89468168    1.32778187   -0.17713409    0.05791743    0.02697068    0.02874000
O   -1.92438720   -1.30787217    0.08646302    0.07872308    0.03270557   -0.00770093
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C   -0.83552611   -0.80618405    0.11276693   -0.05660246   -0.00444383    0.02959104
C    0.24701752    1.56907003    0.19970752   -0.03687314    0.02442838   -0.00485919
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C    1.68454947    1.33655027    0.06255417    0.02101588    0.03301646   -0.02219447
C    1.65675173   -1.25769054   -0.14670639    0.00598329   -0.06377643   -0.01923521
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C    2.31659710    0.06007942   -0.06702743    0.04044260   -0.01827913    0.02475301
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   15
   -420.49045518
H   -2.62768793    0.76023534   -0.60783214   -0.02109655   -0.01064132   -0.02285273
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O   -1.91971486   -1.31070397    0.08920607    0.11224932    0.04487796   -0.00712021
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C    0.24962402    1.56594896    0.21737605   -0.04323793    0.02377892    0.00513518
C    0.33116715   -1.64547227    0.03239311   -0.01765733    0.01213548   -0.01031097
C    1.69717766    1.34093223    0.05001538    0.03419036    0.03510480   -0.02444104
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C    2.32504582    0.08396398   -0.06417574    0.02811418    0.00738616    0.02766310
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   15
   -420.49568107
H   -2.59377059    0.73998025   -0.57929259   -0.00145500    0.00063266   -0.01194264
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O   -1.92006944   -1.31554074    0.09227310    0.12831778    0.04879387   -0.00676311
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C    0.31957053   -1.65977386    0.01507905   -0.02580975   -0.01294590   -0.01237046
C    1.70776938    1.34323854    0.03895908    0.04126168    0.02801162   -0.02744753
C    1.66486488   -1.25564503   -0.10991355    0.02425382   -0.03694435   -0.01085010
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H    2.37590012   -2.02885052   -0.22925186   -0.01422343    0.01879319    0.00211334
C    2.33178440    0.10740597   -0.06298406    0.01764455    0.03227497    0.02800870
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   15
   -420.49494795
H   -2.55919527    0.71874393   -0.54234556    0.02387414    0.01968649    0.00167192
O   -1.91265821    1.31389564   -0.18213496    0.00515330   -0.01098523    0.00197679
O   -1.92614976   -1.32254736    0.09564696    0.11924796    0.04120691   -0.00637097
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C   -0.86471827   -0.82708465    0.09821105   -0.10888146   -0.05112555    0.03074359
C    0.26296143    1.55529950    0.25114387   -0.05097444    0.02471253    0.02476215
C    0.30954861   -1.67326820   -0.00149116   -0.03648110   -0.04268133   -0.01364808
C    1.71590066    1.34389825    0.02956049    0.04151875    0.01179617   -0.02998573
C    1.66659217   -1.25048275   -0.09033575    0.01209592    0.00599399   -0.00100329
H    0.04123616    2.60091851    0.42824774    0.01231886    0.00000230    0.00422222
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H    2.30088075    2.25049806    0.10051144   -0.00563354   -0.00183120    0.00425059
H    2.33950408   -2.14241334   -0.22316210    0.00415222   -0.02332476   -0.00357656
C    2.33743091    0.12891023   -0.06347115    0.01206570    0.05436972    0.02536468
H    3.40069103    0.07797317   -0.37557283    0.01117970   -0.00224066   -0.01160823
   15
   -420.48858061
H   -2.54089586    0.68389641   -0.50603962    0.03420744    0.02913551    0.00625509
O   -1.92068643    1.30910738   -0.18476775   -0.01043673   -0.02190175   -0.00321831
O   -1.93755654   -1.33138620    0.09930698    0.08815145    0.02382259   -0.00521829
C   -0.74666633    0.67438235   -0.06176693   -0.00508834   -0.01712368   -0.03213451
C   -0.86155191   -0.82864349    0.08963805   -0.07968343   -0.04497895    0.02870563
C    0.27414934    1.54776482    0.26607443   -0.05019029    0.01654122    0.03094455
C    0.30173174   -1.68420024   -0.01723675   -0.04665624   -0.06835467   -0.01477053
C    1.72154262    1.34385619    0.02196429    0.03742334   -0.00670396   -0.03039257
C    1.66753258   -1.24561018   -0.07068926    0.00999536    0.03565475    0.00742764
H    0.06809500    2.59665363    0.36241858    0.01477766   -0.00729015   -0.00032023
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C    2.34231695    0.14714653   -0.06547882    0.01250988    0.07241077    0.02006510
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   15
   -420.48454484
H   -2.54556594    0.62961514   -0.47342070    0.01863231    0.01466396   -0.00178475
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O   -1.95292404   -1.34128952    0.10319871    0.04659324    0.00207796   -0.00275503
C   -0.73939089    0.69675801   -0.05426257    0.00705815    0.00712683   -0.02964161
C   -0.85362330   -0.82751625    0.07933949   -0.03908798   -0.03201653    0.02460614
C    0.28835019    1.53928678    0.27914457   -0.04491574   -0.00257468    0.03500052
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C    1.72493069    1.34419125    0.01619243    0.03134906   -0.01973229   -0.02810863
C    1.66784388   -1.24280940   -0.05148292    0.01297807    0.04858044    0.01404301
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H    2.34072445    2.27665495   -0.01608038    0.01052208    0.01594482    0.00012991
H    2.25614733   -2.30171475   -0.20095999    0.00558996   -0.06366970   -0.00891367
C    2.34642378    0.16102887   -0.06869260    0.01729528    0.08538844    0.01331141
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   15
   -420.48319791
H   -2.56322043    0.56531196   -0.43947730   -0.00462399   -0.00900323   -0.01092440
O   -1.93587951    1.30169139   -0.18998886    0.01068303    0.01356418    0.01021445
O   -1.97041135   -1.35129130    0.10721094    0.00623073   -0.01866676    0.00089904
C   -0.73254567    0.71870922   -0.04497231    0.01978758    0.03007030   -0.02581345
C   -0.84332739   -0.82445985    0.06756173    0.00111148   -0.01750734    0.01873283
C    0.30524226    1.53099633    0.29009887   -0.03459032   -0.02780818    0.03877067
C    0.29467760   -1.69330565   -0.04595288   -0.04569198   -0.06950370   -0.01755433
C    1.72642877    1.34566919    0.01210956    0.02404279   -0.02283760   -0.02365821
C    1.66736861   -1.24287672   -0.03311827    0.01654305    0.04724150    0.01908833
H    0.09102338    2.60116263    0.23395973    0.01061834    0.00248902   -0.00799761
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H    2.35218597    2.27563550   -0.07543662    0.01414542    0.01766247   -0.00335632
H    2.20759282   -2.31820705   -0.18096433   -0.00306434   -0.06346047   -0.00899385
C    2.34948872    0.16977597   -0.07271330    0.02123603    0.09257879    0.00689974
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   15
   -420.48223142
H   -2.57810436    0.50695127   -0.39805515   -0.01925164   -0.02465112   -0.01408304
O   -1.94387079    1.29758356   -0.19311341    0.01507222    0.02844328    0.01070446
O   -1.98821098   -1.36046175    0.11118023   -0.02646595   -0.03544575    0.00511910
C   -0.72688544    0.73886137   -0.03412285    0.03017757    0.04916561   -0.02157951
C   -0.83306148   -0.82033486    0.05465608    0.03403627   -0.00483237    0.01182026
C    0.32419911    1.52437281    0.29870671   -0.01888947   -0.05016888    0.04282690
C    0.29539730   -1.69138208   -0.05876415   -0.03741945   -0.05020438   -0.01747826
C    1.72647875    1.34847296    0.00945147    0.01554263   -0.01495696   -0.01802129
C    1.66588832   -1.24572290   -0.01589810    0.02116714    0.02993812    0.02210202
H    0.08995915    2.60346678    0.17696469    0.00608195    0.01038810   -0.01271191
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H    2.35372704    2.26227562   -0.13240358    0.01331634    0.01308849   -0.00638896
H    2.16150580   -2.28981280   -0.15458673   -0.01626592   -0.04924833   -0.00744097
C    2.35129941    0.17295512   -0.07715798    0.01941499    0.09358259    0.00177301
H    3.40144426    0.19110584   -0.26742859   -0.01371220    0.00871864    0.00215879
   15
   -420.47960230
H   -2.57978090    0.46566852   -0.34680122   -0.02288657   -0.02928448   -0.01213637
O   -1.95250931    1.29222607   -0.19670487    0.00981420    0.03255891    0.00611681
O   -2.00484386   -1.36804159    0.11491802   -0.05016191   -0.04752587    0.00914969
C   -0.72302506    0.75606650   -0.02196652    0.03559123    0.06302950   -0.01767616
C   -0.82480571   -0.81590256    0.04103724    0.05735786    0.00487495    0.00456362
C    0.34427194    1.52073682    0.30472687    0.00198101   -0.06341400    0.04639116
C    0.29838699   -1.68641803   -0.07052600   -0.03036122   -0.03134828   -0.01590379
C    1.72559361    1.35213373    0.00788289    0.00605002    0.00230918   -0.01228889
C    1.66310247   -1.25026587    0.00000064    0.03077904   -0.00981985    0.02211660
H    0.08450057    2.59859636    0.12909059    0.00171433    0.01330045   -0.01687671
H   -0.05288929   -2.76293265   -0.11738411   -0.02141713   -0.02309858   -0.00132034
H    2.34593638    2.23981448   -0.18486175    0.00821701    0.00319622   -0.00793014
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C    2.35196166    0.17050530   -0.08171298    0.01269435    0.08847695   -0.00275079
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   15
   -420.47314573
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O   -1.96156828    1.28542688   -0.20056512   -0.00214571    0.02712090   -0.00090384
O   -2.01922966   -1.37348136    0.11824293   -0.06615449   -0.05521579    0.01255985
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   15
   -420.47095406
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O   -2.03063610   -1.37642949    0.12100095   -0.07613840   -0.05921581    0.01520398
C   -0.72163682    0.77860365    0.00535551    0.02921801    0.07519732   -0.01110077
C   -0.81940137   -0.80831148    0.01339856    0.07657013    0.01699395   -0.00925537
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C    1.72338177    1.35767939    0.00666947   -0.01689181    0.04293317   -0.00193971
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   15
   -420.47794859
H   -2.51122230    0.44551030   -0.15473212    0.01367082    0.00664747    0.00056920
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O   -2.03860669   -1.37670166    0.12307150   -0.08106190   -0.06030391    0.01720728
C   -0.72374048    0.78319476    0.02011825    0.02075957    0.07448252   -0.00739249
C   -0.82342471   -0.80589261    0.00021251    0.07440731    0.02076148   -0.01540683
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C    1.72344790    1.35718394    0.00638844   -0.03111013    0.05149935    0.00456926
C    1.64143672   -1.24877200    0.03996854   -0.00089004   -0.06197458    0.02567058
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H    2.23841551   -2.09854390   -0.02355084   -0.03628852    0.02174801   -0.00150706
C    2.35034420    0.13398269   -0.09309983    0.01179881    0.04582381   -0.01920849
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   15
   -420.48042591
H   -2.49241945    0.44537844   -0.08795694    0.02442002    0.01677161    0.00149369
O   -1.98508921    1.26055244   -0.21073388   -0.04551043   -0.01703498   -0.01597316
O   -2.04291752   -1.37424628    0.12436327   -0.08106703   -0.05906171    0.01867254
C   -0.72710072    0.78330111    0.03532253    0.01247363    0.06980312   -0.00260279
C   -0.83191318   -0.80472322   -0.01204510    0.06522065    0.02326666   -0.02088740
C    0.40871562    1.54251184    0.30038840    0.08478470   -0.02346893    0.04105543
C    0.32651992   -1.65318869   -0.10940660   -0.01288897   -0.02329690   -0.00898823
C    1.72538559    1.35363008    0.00582496   -0.04320119    0.04904509    0.01216788
C    1.63188874   -1.23971771    0.05048299   -0.05568460   -0.02529697    0.02713229
H    0.06676277    2.53128380    0.06751900   -0.00134909   -0.02478278   -0.01428159
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C    2.34865082    0.11493287   -0.09503420    0.02189888    0.02814285   -0.02400848
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   15
   -420.47696406
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O   -1.98956344    1.25293680   -0.21288592   -0.04159439   -0.01024309   -0.02112711
O   -2.04357001   -1.36911946    0.12481020   -0.07572697   -0.05555093    0.01948382
C   -0.73122718    0.77920367    0.05067819    0.00646219    0.06156962    0.00336587
C   -0.84431200   -0.80495200   -0.02304382    0.04922417    0.02397699   -0.02549649
C    0.41456555    1.55399822    0.29260520    0.08875748   -0.00870262    0.03784104
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C    1.72989515    1.34714283    0.00453228   -0.04727895    0.04000643    0.01847792
C    1.62561311   -1.22902248    0.05937620   -0.09291510   -0.00901981    0.02478225
H    0.06612460    2.53696139    0.08223290   -0.00083728   -0.02899770   -0.01180934
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C    2.34562484    0.09417613   -0.09552409    0.03354359    0.01133294   -0.02729189
H    3.43508123    0.15212266   -0.13219346    0.00314359    0.01411812    0.00595865
   15
   -420.47545450
H   -2.50370815    0.41713172    0.03972683    0.01140165   -0.00780513    0.01113271
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O   -2.04080903   -1.36148238    0.12437651   -0.06439098   -0.04922202    0.01938261
C   -0.73575829    0.77139776    0.06582658    0.00313549    0.05031492    0.01006883
C   -0.85965586   -0.80661663   -0.03250628    0.02682934    0.02186384   -0.02894552
C    0.41508606    1.56605274    0.28252512    0.08501322   -0.00190011    0.03617743
C    0.34627399   -1.62910530   -0.12522529    0.00735803   -0.03549774   -0.01018955
C    1.73720767    1.33824437    0.00214038   -0.04027589    0.02918679    0.02122265
C    1.62484832   -1.21772831    0.06677783   -0.10854099   -0.00361274    0.02091521
H    0.06623855    2.56280704    0.10553291   -0.00263511   -0.02160350   -0.01063002
H    0.35503783   -2.65927340   -0.31884133    0.02381229    0.03006515   -0.00015341
H    2.30056389    2.22001412   -0.37521392    0.00098878    0.01069819   -0.01773650
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C    2.34058728    0.07273380   -0.09437312    0.04159252   -0.00547059   -0.02863467
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   15
   -420.47948976
H   -2.52527238    0.40536414    0.09379525    0.00079367   -0.02153982    0.01838636
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O   -2.03515059   -1.35162608    0.12306767   -0.04661683   -0.03911264    0.01814809
C   -0.74048699    0.76056035    0.08036576    0.00136206    0.03681723    0.01682562
C   -0.87659353   -0.80958473   -0.04022552   -0.00130444    0.01601071   -0.03091464
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C    1.74690609    1.32757492   -0.00151353   -0.02337938    0.01945940    0.01972727
C    1.63055048   -1.20621514    0.07291513   -0.10440233    0.00123388    0.01690137
H    0.06833212    2.60372020    0.13649005   -0.00566571   -0.00608480   -0.00948841
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H    2.29907493    2.22396460   -0.37473064   -0.00036305    0.01485035   -0.01787849
H    2.56229730   -2.01581073    0.11628963    0.05889512   -0.02576520    0.00324758
C    2.33308943    0.05163134   -0.09150137    0.03871625   -0.02402492   -0.02777997
H    3.39784154    0.05770625   -0.11371570   -0.01537249    0.00788946    0.00637538
   15
   -420.48632654
H   -2.54764718    0.40864091    0.13477873   -0.00588516   -0.02758789    0.02311570
O   -1.99390004    1.23005970   -0.21196902   -0.00880918    0.02220855   -0.04448206
O   -2.02740080   -1.34001144    0.12093992   -0.02254655   -0.02471035    0.01574228
C   -0.74529777    0.74750242    0.09389037   -0.00043009    0.02210050    0.02299521
C   -0.89342864   -0.81350145   -0.04608417   -0.03412629    0.00624768   -0.03110237
C    0.40141640    1.59048146    0.25589809    0.05919449    0.00115357    0.03160109
C    0.36445864   -1.59776012   -0.13877878    0.01854870    0.00581888   -0.00392937
C    1.75798694    1.31571562   -0.00634269   -0.00020191    0.01227866    0.01468860
C    1.64246083   -1.19478681    0.07802726   -0.07875875    0.00763481    0.01352586
H    0.07443814    2.64897930    0.17419658   -0.00763986    0.01015870   -0.00700528
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H    2.29802194    2.21755859   -0.36153606   -0.00462760    0.01338791   -0.01532290
H    2.55780400   -1.94405571    0.14964027    0.05155727   -0.00838695    0.00476908
C    2.32332864    0.03199583   -0.08696125    0.02058774   -0.04527884   -0.02459060
H    3.39272723    0.00077905   -0.11133417   -0.01182683    0.00285995    0.00587658
   15
   -420.48869612
H   -2.56610196    0.43130930    0.15936863   -0.00716968   -0.02554037    0.02359544
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O   -2.01864634   -1.32728921    0.11810152    0.00628947   -0.00678457    0.01239178
C   -0.75007776    0.73310866    0.10602944   -0.00310532    0.00720541    0.02815671
C   -0.90818674   -0.81778000   -0.05007116   -0.06944952   -0.00666904   -0.02946379
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C    1.76906978    1.30309949   -0.01204976    0.02503101    0.00781499    0.00759752
C    1.65899459   -1.18379659    0.08231105   -0.02523221    0.00909307    0.01233209
H    0.08589909    2.68722166    0.21686264   -0.00726378    0.02150316   -0.00310279
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C    2.31238062    0.01510736   -0.08094520   -0.00887137   -0.06815158   -0.01917652
H    3.39571889   -0.05811204   -0.11315575   -0.00158789   -0.00375229    0.00489946
   15
   -420.47952428
H   -2.57982501    0.47180535    0.16730988   -0.00119501   -0.01400272    0.01833975
O   -1.99376408    1.21088840   -0.20208733   -0.00597591    0.00165979   -0.04028805
O   -2.01018059   -1.31426308    0.11470244    0.03586574    0.01211380    0.00866986
C   -0.75466665    0.71827543    0.11647139   -0.00638630   -0.00697189    0.03217930
C   -0.91875417   -0.82164837   -0.05228328   -0.10272630   -0.02087892   -0.02646377
C    0.37368076    1.61428781    0.22177978    0.02093150    0.01887538    0.02028982
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C    1.77864996    1.29000812   -0.01821657    0.04801097    0.00371357    0.00057389
C    1.67690882   -1.17329148    0.08582376    0.05472902   -0.00065145    0.01587844
H    0.10244879    2.71041913    0.26173307   -0.00454895    0.02554513    0.00131748
H    0.38908993   -2.67230320   -0.40217815    0.01862760   -0.02230877   -0.01180165
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H    2.46081788   -1.80737077    0.20745851   -0.02543887    0.06822354   -0.00258531
C    2.30198071    0.00233078   -0.07377708   -0.04074518   -0.08898084   -0.01227190
H    3.39988800   -0.11425970   -0.11847828    0.00821856   -0.01112130    0.00346581
   15
   -420.46776894
H   -2.59319749    0.52179266    0.16241711    0.01290626    0.00686166    0.00717781
O   -1.99328543    1.20089874   -0.19432301   -0.01680872   -0.02268210   -0.02880350
O   -2.00331960   -1.30177531    0.11090770    0.05935117    0.02801149    0.00557411
C   -0.75887196    0.70385649    0.12497258   -0.00913199   -0.01968870    0.03514119
C   -0.92315466   -0.82426299   -0.05289646   -0.12678346   -0.03326135   -0.02316159
C    0.35732033    1.62479101    0.20269406    0.00229101    0.03501983    0.01387616
C    0.38380060   -1.55520455   -0.15741839    0.01746745    0.03618711   -0.00274146
C    1.78535976    1.27671603   -0.02442957    0.06437921   -0.00510871   -0.00426024
C    1.69161359   -1.16281370    0.08837013    0.11306546    0.00475448    0.01972734
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H    2.33255254    2.16093841   -0.26898360   -0.01879196   -0.00569169   -0.00329909
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C    2.29401824   -0.00510261   -0.06586668   -0.06739986   -0.10220354   -0.00538153
H    3.39845919   -0.16243106   -0.12627917    0.01282621   -0.01797720    0.00178270
   15
   -420.46995275
H   -2.61589292    0.56690056    0.15236279    0.02662191    0.02604211   -0.00374958
O   -1.99203532    1.19193266   -0.18525403   -0.02904602   -0.04493405   -0.01713136
O   -1.99909920   -1.29053276    0.10685353    0.06905791    0.03717968    0.00419222
C   -0.76253358    0.69061764    0.13135281   -0.01020986   -0.03026431    0.03722682
C   -0.91997286   -0.82489251   -0.05210375   -0.13392042   -0.04045518   -0.02084640
C    0.34081134    1.63316235    0.18276414   -0.01434128    0.05375930    0.00839200
C    0.38810622   -1.54507557   -0.16337501    0.01980270    0.02770461   -0.00592330
C    1.78822427    1.26377704   -0.03039887    0.07128574   -0.02237740   -0.00641900
C    1.69986911   -1.15290339    0.08979061    0.10139379    0.05962783    0.01182239
H    0.14198608    2.70547629    0.34607556    0.00489503    0.01219635    0.00726740
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H    2.36764603    2.14444112   -0.22996007   -0.01440487   -0.00325306   -0.00255088
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C    2.29007887   -0.00642020   -0.05762190   -0.08339564   -0.10237675   -0.00022954
H    3.38819722   -0.19775913   -0.13537327    0.01078091   -0.02313473    0.00022390
   15
   -420.47469779
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O   -1.99794371   -1.28094643    0.10260074    0.06091141    0.03830542    0.00497752
C   -0.76558656    0.67919520    0.13548524   -0.00957137   -0.03806081    0.03858185
C   -0.90879824   -0.82310879   -0.05004174   -0.12009124   -0.04110590   -0.02017410
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C    1.78682174    1.25222074   -0.03598583    0.06948988   -0.04525155   -0.00738946
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H    2.43465778   -1.94374027    0.30903113    0.01519640    0.00553673    0.01034576
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   15
   -420.47386386
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O   -1.99949440   -1.27307405    0.09811649    0.03766919    0.03308416    0.00722685
C   -0.76806421    0.67005906    0.13728725   -0.00821139   -0.04276284    0.03935042
C   -0.89045419   -0.81886462   -0.04675424   -0.08783010   -0.03670064   -0.02054184
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C    1.78124275    1.24338948   -0.04112364    0.06242281   -0.06583397   -0.00874297
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H    2.44095798   -2.04429542    0.33853886    0.03362593   -0.03101395    0.01858552
C    2.29712155    0.00823053   -0.04117457   -0.06768661   -0.05253120    0.00109243
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   15
   -420.47206029
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O   -2.00272732   -1.26669110    0.09330390    0.00720704    0.02471839    0.00958638
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C   -0.86685170   -0.81241137   -0.04222630   -0.04489470   -0.03014738   -0.02055996
C    0.29952610    1.63534630    0.12093634   -0.04475912    0.07512171   -0.00584308
C    0.39345874   -1.52158567   -0.17809999    0.02276684    0.00503116   -0.01506993
C    1.77189868    1.23849044   -0.04572889    0.05322852   -0.07673488   -0.01085072
C    1.69594221   -1.15604739    0.09225667    0.01894014    0.12511057   -0.00586160
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H    3.34073409   -0.20079773   -0.16074457   -0.02452383   -0.02101851   -0.00196142
   15
   -420.47509056
H   -2.79217232    0.60575033    0.11813087   -0.04241274   -0.00455628    0.00953589
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O   -2.00629105   -1.26142889    0.08806024   -0.02240348    0.01602614    0.01093897
C   -0.77159215    0.65960375    0.13374277   -0.00657321   -0.04342716    0.03943401
C   -0.84054394   -0.80413378   -0.03646238    0.00018949   -0.02373567   -0.01913700
C    0.29055301    1.62702014    0.10061237   -0.04736170    0.05997019   -0.01377286
C    0.39251997   -1.51458461   -0.18135401    0.02487820    0.02163357   -0.01384101
C    1.75933790    1.23816378   -0.04967625    0.04344718   -0.07410849   -0.01328616
C    1.69048274   -1.17233725    0.09363175   -0.00237206    0.09612687   -0.00326750
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H    2.53248126    2.05624997   -0.06013008    0.02459539    0.00621862    0.00378538
H    2.38143413   -2.16875147    0.35589012    0.03063546   -0.05362090    0.02163737
C    2.31971721    0.03502961   -0.02487554   -0.01547423    0.02393810   -0.00273291
H    3.34700707   -0.16908928   -0.16677092   -0.02927059   -0.01755246   -0.00291408
   15
   -420.48346681
H   -2.79271504    0.60941965    0.09803447   -0.03912190    0.00031149    0.00612180
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O   -2.00886088   -1.25689829    0.08232545   -0.04615019    0.00844961    0.01090925
C   -0.77274018    0.65832858    0.12839089   -0.00658006   -0.04016871    0.03878456
C   -0.81422657   -0.79441582   -0.02954964    0.04128546   -0.01826178   -0.01602540
C    0.28442742    1.61508933    0.08112267   -0.04663900    0.04027642   -0.02199256
C    0.39007657   -1.50891601   -0.18377225    0.02683032    0.04303164   -0.01236404
C    1.74414964    1.24225004   -0.05282159    0.03358868   -0.05780504   -0.01542464
C    1.68514197   -1.19439691    0.09519369   -0.01841866    0.05764226    0.00162474
H    0.14465265    2.63880479    0.46122898    0.00984860    0.00667416    0.01718802
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H    2.54442971    2.01996243   -0.02001148    0.02538342   -0.00411128    0.00628646
H    2.31725727   -2.17597034    0.34142602    0.01785194   -0.04580011    0.01812813
C    2.33324411    0.04742626   -0.01653859    0.00034450    0.05053384   -0.00182309
H    3.37353048   -0.12468895   -0.17060565   -0.02062760   -0.01477072   -0.00530913
   15
   -420.48992560
H   -2.76606132    0.61232715    0.07368158   -0.01982588    0.01409807    0.00017725
O   -1.98055532    1.17402596   -0.11141239    0.01709487   -0.04084319   -0.01637751
O   -2.00936539   -1.25275678    0.07610013   -0.06234192    0.00239135    0.00968418
C   -0.77348971    0.65947463    0.12069559   -0.00669960   -0.03528819    0.03767792
C   -0.79036891   -0.78358999   -0.02167451    0.07500579   -0.01343765   -0.01157739
C    0.28110702    1.60071658    0.06295343   -0.04283879    0.02164709   -0.02831439
C    0.38602763   -1.50582119   -0.18543488    0.02547478    0.05895730   -0.01238737
C    1.72693013    1.24977929   -0.05503806    0.02364581   -0.03104702   -0.01677140
C    1.68083866   -1.21986767    0.09663499   -0.01923526    0.00375740    0.01099088
H    0.12113074    2.62709543    0.45724855    0.00743636    0.01107716    0.02027362
H    0.05925307   -2.57080854   -0.29685498   -0.01641277   -0.01025537   -0.00316958
H    2.53841530    1.98681316    0.01564792    0.02096024   -0.01737140    0.00769988
H    2.24093678   -2.15149780    0.31421387   -0.00692457   -0.01610595    0.00948296
C    2.34679332    0.05683407   -0.00810226    0.00776913    0.06384114    0.00120146
H    3.41436948   -0.06968454   -0.17056054   -0.00312390   -0.01140343   -0.00858268
   15
   -420.48466829
H   -2.72570297    0.60469733    0.04917769    0.00790508    0.03350620   -0.00522368
O   -1.98219561    1.17619469   -0.09568511   -0.00921303   -0.05833693   -0.01079297
O   -2.00706924   -1.24872962    0.06943832   -0.07110425   -0.00215046    0.00766001
C   -0.77383543    0.66274957    0.11072448   -0.00652797   -0.02934603    0.03597553
C   -0.77099987   -0.77195295   -0.01310321    0.09921102   -0.00829920   -0.00631882
C    0.28036275    1.58501491    0.04648037   -0.03613706    0.00691807   -0.03142230
C    0.38045989   -1.50624085   -0.18633825    0.01990493    0.06475545   -0.01439449
C    1.70828686    1.25916509   -0.05624432    0.01237475   -0.00014964   -0.01727203
C    1.67758927   -1.24544259    0.09738265    0.00013656   -0.07217151    0.02547361
H    0.09225958    2.60774796    0.43881369    0.00496894    0.00986707    0.02093000
H    0.03976963   -2.57882313   -0.27117868   -0.01697487   -0.01522289   -0.00153795
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H    2.17051053   -2.11728228    0.28052036   -0.04542518    0.04217380   -0.00431771
C    2.35988277    0.06244501    0.00025898    0.01300770    0.06442254    0.00474092
H    3.45747874   -0.00658380   -0.16437034    0.01424602   -0.00618039   -0.01130798
   15
   -420.47745780
H   -2.69005494    0.57359649    0.02811992    0.01967387    0.04177459   -0.00564221
O   -1.98348117    1.18096589   -0.07944899   -0.01920825   -0.06389211   -0.00994262
O   -2.00157264   -1.24461052    0.06243038   -0.07297607   -0.00522031    0.00523102
C   -0.77378992    0.66779663    0.09858202   -0.00560422   -0.02285711    0.03338882
C   -0.75757504   -0.75982195   -0.00415194    0.11223654   -0.00158907   -0.00061111
C    0.28179156    1.56887134    0.03188997   -0.02698199   -0.00317680   -0.03102085
C    0.37369981   -1.51052048   -0.18636274    0.01202462    0.05935528   -0.01804547
C    1.68891716    1.26858014   -0.05640748   -0.00329869    0.02676060   -0.01752411
C    1.67435669   -1.26674041    0.09661677    0.01300006   -0.12720861    0.03431852
H    0.05978913    2.58162350    0.40546048    0.00280905    0.00323756    0.01905952
H    0.03232155   -2.57635755   -0.24443799   -0.01438170   -0.01210841    0.00080068
H    2.48666220    1.96651639    0.07043640    0.00791925   -0.03636609    0.00748184
H    2.13210750   -2.11272485    0.24962323   -0.07099534    0.08517550   -0.01247541
C    2.37217372    0.06420801    0.00833759    0.02045685    0.05536202    0.00748134
H    3.49071433    0.06086457   -0.15013274    0.02536250    0.00072499   -0.01252327
   15
   -420.48837922
H   -2.66677563    0.51402104    0.01088127    0.00377543    0.02510732   -0.00225471
O   -1.98400782    1.18853096   -0.06274814   -0.00170698   -0.04353920   -0.01241247
O   -1.99278978   -1.24025926    0.05518555   -0.06818615   -0.00703230    0.00268192
C   -0.77341370    0.67422631    0.08442611   -0.00300315   -0.01643721    0.02963913
C   -0.75087696   -0.74760747    0.00483448    0.11303942    0.00750443    0.00542205
C    0.28484281    1.55290261    0.01916133   -0.01592465   -0.00988876   -0.02777938
C    0.36621214   -1.51833515   -0.18529217    0.00403850    0.04315033   -0.02246179
C    1.66978242    1.27643103   -0.05550697   -0.02577584    0.04308679   -0.01851857
C    1.67056914   -1.28081163    0.09385928   -0.01515132   -0.09855520    0.02823990
H    0.02527862    2.55336015    0.35847615    0.00094978   -0.00654261    0.01563594
H    0.03505146   -2.56563470   -0.21827797   -0.00886153   -0.00133961    0.00317614
H    2.44978864    1.99251648    0.08959086    0.00775495   -0.03339288    0.00783064
H    2.14179899   -2.16421342    0.22672740   -0.05071334    0.04890772   -0.00594593
C    2.38320816    0.06265073    0.01597059    0.03169472    0.04075322    0.00886484
H    3.50619041    0.12775589   -0.12697471    0.02810697    0.00821656   -0.01211340
   15
   -420.49845094
H   -2.64600329    0.43693304   -0.00461377   -0.01641452   -0.00128355   -0.00055546
O   -1.98446680    1.19802951   -0.04549374    0.01927770   -0.01187344   -0.01264857
O   -1.98093835   -1.23559215    0.04781853   -0.05665502   -0.00790110    0.00025366
C   -0.77286931    0.68165385    0.06848430    0.00218069   -0.01074867    0.02455248
C   -0.75095387   -0.73585598    0.01349214    0.10157507    0.01834916    0.01161504
C    0.28884919    1.53753203    0.00810647   -0.00325409   -0.01662932   -0.02322446
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C    1.65222812    1.28173688   -0.05348151   -0.05232792    0.04749995   -0.02043764
C    1.66774772   -1.28905843    0.08939978   -0.05427828   -0.04071784    0.02018227
H   -0.00989945    2.52973045    0.30022519   -0.00120612   -0.01501286    0.01229559
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H    2.40705575    2.04200177    0.10303693    0.01198052   -0.02120634    0.00926482
H    2.18710015   -2.24944120    0.20806433   -0.01409517   -0.01403158    0.00223969
C    2.39230630    0.05863276    0.02307496    0.04673564    0.02524923    0.00878204
H    3.50194096    0.18878581   -0.09517285    0.02230245    0.01481519   -0.01038896
   15
   -420.49625933
H   -2.61424876    0.36023614   -0.01953831   -0.02347418   -0.01973356   -0.00161760
O   -1.98574711    1.20809305   -0.02767864    0.02711285    0.01361745   -0.00945447
O   -1.96654205   -1.23057046    0.04043886   -0.03826856   -0.00766492   -0.00188396
C   -0.77246645    0.68973627    0.05106526    0.00923163   -0.00601730    0.01794462
C   -0.75711697   -0.72521335    0.02144816    0.07875647    0.02897854    0.01763713
C    0.29304530    1.52318772   -0.00154412    0.01072838   -0.02726198   -0.01849786
C    0.35098974   -1.54029623   -0.17881768   -0.01161782   -0.00248949   -0.03040135
C    1.63782353    1.28421191   -0.05022048   -0.07589988    0.04356911   -0.02226062
C    1.66810593   -1.29470133    0.08369280   -0.07454308   -0.00780619    0.01706401
H   -0.04411759    2.51652804    0.23304036   -0.00487099   -0.01724394    0.01017697
H    0.05440404   -2.55265582   -0.17388938    0.00408541    0.02544334    0.00554756
H    2.35574461    2.10647504    0.10979649    0.01548784   -0.00428979    0.01091309
H    2.24340628   -2.32633664    0.18811976    0.00985767   -0.05039739    0.00526608
C    2.39856529    0.05307485    0.02965386    0.06417728    0.01222276    0.00759639
H    3.48206790    0.23928728   -0.05592842    0.00927990    0.01913029   -0.00802302
   15
   -420.49110803
H   -2.56635665    0.29714683   -0.03323107   -0.01778043   -0.02827381   -0.00384285
O   -1.98821778    1.21757439   -0.00944182    0.02439700    0.02981611   -0.00427839
O   -1.95043442   -1.22520893    0.03314321   -0.01322355   -0.00529568   -0.00362489
C   -0.77262048    0.69818641    0.03256845    0.01600327   -0.00205085    0.00985598
C   -0.76799394   -0.71630907    0.02834090    0.04611169    0.03678161    0.02298481
C    0.29659452    1.51051414   -0.01007874    0.02424023   -0.04203688   -0.01317871
C    0.34419165   -1.55178403   -0.17293846   -0.01747281   -0.01245612   -0.03296007
C    1.62796068    1.28406941   -0.04561963   -0.08990427    0.03609972   -0.02280710
C    1.67288213   -1.29976639    0.07694099   -0.07680810    0.00391659    0.01659147
H   -0.07470864    2.51528165    0.15849016   -0.01038371   -0.01199017    0.00862456
H    0.06205549   -2.56858153   -0.15737085    0.00582705    0.02376509    0.00557152
H    2.29357438    2.17408399    0.10875591    0.01422149    0.01198008    0.01162311
H    2.29334679   -2.36831980    0.16455817    0.02151766   -0.06352802    0.00525732
C    2.40095065    0.04676060    0.03577510    0.07988799    0.00257765    0.00606869
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   15
   -420.48923717
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   15
   -420.49042670
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C    0.29880393    1.49365141   -0.02520910    0.03576327   -0.06616768    0.00262846
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   15
   -420.49057674
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O   -1.90436989   -1.20902193    0.01243732    0.08518158    0.02352242   -0.00590650
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C   -0.80726064   -0.70309403    0.03981975   -0.07826708    0.02877449    0.03047644
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   15
   -420.48373775
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O   -1.89469147   -1.20503378    0.00604454    0.10908537    0.03548763   -0.00589138
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C   -0.81427179   -0.70266242    0.04007669   -0.10539794    0.01974937    0.02993141
C    0.29298472    1.49219318   -0.04101414    0.01831650   -0.06240503    0.02007014
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C    1.63907943    1.26534530   -0.01487354   -0.02818138    0.02198158   -0.00783336
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   15
   -420.47699024
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O   -1.88989924   -1.20263470   -0.00008092    0.11634475    0.04190562   -0.00587581
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C   -0.81501451   -0.70343803    0.03852774   -0.11167571    0.01321696    0.02851869
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   15
   -420.48783173
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C   -0.80911481   -0.70503801    0.03525645   -0.09599893    0.01153627    0.02660098
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   15
   -420.50208957
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C    1.75295507   -1.29789246    0.00258450    0.04424109   -0.00902128    0.00620051
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   15
   -420.50615081
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O   -1.90398215   -1.20611774   -0.01681851    0.04308583    0.02189855   -0.00653805
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C    0.27549212    1.52769675   -0.08874301   -0.03246674   -0.01774167    0.02928625
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C    2.29771004    0.02189410    0.08513858   -0.03301846    0.00446835   -0.01911712
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   15
   -420.50268073
H   -2.66715407    0.44367720    0.05501445   -0.01950256   -0.01230287   -0.00317898
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O   -1.91451444   -1.20985016   -0.02181927    0.00894833    0.01248267   -0.00638061
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C    2.28486352    0.02236726    0.09461341   -0.03193747    0.01866395   -0.01756105
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   15
   -420.49710764
H   -2.75600693    0.48663710    0.08511573   -0.04110363   -0.01755770   -0.00097704
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C    0.27547408    1.55469857   -0.12308532   -0.03507631   -0.01502969    0.02861018
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C    1.68188946    1.21159564    0.03849350    0.03792219   -0.06292747    0.02266960
C    1.75138403   -1.26678144   -0.03809106    0.00013297    0.06147440    0.00012586
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   15
   -420.49403560
H   -2.81605920    0.54169598    0.11588968   -0.04935582   -0.01367232    0.00178202
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O   -1.93552012   -1.21872930   -0.03098746   -0.04346055    0.00111614   -0.00460762
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C   -0.73443174   -0.72728555   -0.00151547    0.06370269    0.02104627    0.00664356
C    0.27864844    1.56957161   -0.14285944   -0.02981397   -0.01237439    0.02600775
C    0.41712708   -1.63503666   -0.00359477    0.00358231   -0.00671776    0.02058093
C    1.68076938    1.20905698    0.04422256    0.02323966   -0.06662683    0.02410691
C    1.75018490   -1.26280847   -0.05186429   -0.00078647    0.05718830   -0.00338824
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C    2.26470221    0.01937542    0.11657606   -0.02549416    0.03353745   -0.01245244
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   15
   -420.49232960
H   -2.84156853    0.60601589    0.14538556   -0.04073932    0.00016347    0.00442708
O   -2.05016838    1.24125528    0.17038296    0.01296180   -0.01519260    0.01665285
O   -1.94362350   -1.22335800   -0.03523453   -0.05951250   -0.00135927   -0.00319720
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C   -0.72423292   -0.73545422   -0.01125945    0.07758942    0.01777457    0.00081615
C    0.28361139    1.58517181   -0.16419177   -0.02168241   -0.00558859    0.02051879
C    0.43712779   -1.63469789    0.01325764    0.02952199    0.00529696    0.02720669
C    1.67825056    1.21048234    0.04850610    0.00722930   -0.05732725    0.02309820
C    1.74896840   -1.26220259   -0.06542296    0.01155605    0.03436617   -0.00884841
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H    2.58590944   -1.98969896   -0.16188025    0.02191001    0.00237541   -0.00152020
C    2.25702810    0.01501878    0.12876419   -0.02600089    0.03259171   -0.01067345
H    3.27187203   -0.19081805    0.41639070   -0.01968976   -0.02928514    0.00396025
   15
   -420.48227258
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   15
   -420.46590804
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   15
   -420.46583699
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O   -1.95043861   -1.23682137   -0.04736593   -0.06913747    0.00070925    0.00073131
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C   -0.72271107   -0.76516624   -0.03935095    0.07709352    0.00113115   -0.01625139
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   15
   -420.47046194
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O   -1.94639350   -1.24127237   -0.05140354   -0.05940814    0.00458243    0.00152707
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   15
   -420.46634665
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C    0.31740057    1.65383427   -0.27819152    0.01638781    0.04228080   -0.02595279
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C    2.24305490   -0.02489640    0.19543117   -0.01989757   -0.03035007    0.01327137
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   15
   -420.46357745
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O   -1.93106314   -1.25105894   -0.05970453   -0.01831730    0.01671449    0.00220620
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   15
   -420.46861976
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O   -1.92163922   -1.25694294   -0.06399947    0.01206477    0.02442240    0.00228957
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C    2.24703188   -0.03467757    0.21906792   -0.00674396   -0.05048249    0.02767879
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   15
   -420.47833720
H   -2.74552206    0.53505006    0.23296370   -0.02505464   -0.01258990    0.00250470
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O   -1.91277148   -1.26393466   -0.06839836    0.04462741    0.03193814    0.00239052
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   15
   -420.48412515
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   15
   -420.47761727
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O   -1.90228569   -1.28245665   -0.07752955    0.08741636    0.03666345    0.00258398
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C    1.66691654    1.24040447    0.04430487   -0.00212334   -0.02357255    0.00144023
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H    2.33685596   -2.10733625   -0.31960772   -0.04085959    0.03636857    0.00325090
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   15
   -420.46731365
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O   -1.90256144   -1.29418135   -0.08226792    0.08534044    0.02872251    0.00198147
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C   -0.81826836   -0.81237726   -0.06077737   -0.08588994   -0.05043401   -0.02474498
C    0.32288512    1.66261944   -0.36175094    0.03086768    0.05836333   -0.05705537
C    0.38130502   -1.63443113    0.07257111   -0.04169613    0.00470037    0.03319343
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C    1.75267305   -1.30029108   -0.14320226    0.10843348   -0.09765545   -0.05986930
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C    2.25947859   -0.01865210    0.24393560   -0.01136753   -0.03528477    0.04375533
H    3.32455734    0.20468096    0.32750437   -0.00350898    0.02046680   -0.00603138
   15
   -420.47184731
H   -2.44784439    0.40989680    0.21576863    0.02993607   -0.00631225   -0.00395682
O   -2.03625591    1.31293928    0.23399554   -0.05270196    0.03984590    0.01737235
O   -1.90665039   -1.30718166   -0.08709254    0.06778740    0.01350470    0.00038729
C   -0.75604882    0.78395360   -0.01777299    0.00414188   -0.01084455    0.02065942
C   -0.81652208   -0.80712427   -0.05639516   -0.06813129   -0.04189173   -0.02164263
C    0.31683855    1.65387518   -0.36474176    0.02154374    0.06073815   -0.05481368
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C    1.66720230    1.24117165    0.03945506    0.02125615   -0.04014058    0.00321726
C    1.75260116   -1.30417082   -0.13906868    0.09484824   -0.07504099   -0.05348114
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H    2.20738723    2.22513271    0.26974523   -0.00197784    0.03624123    0.00575835
H    2.32492912   -2.11071188   -0.31815829   -0.05082108    0.05101327    0.00541213
C    2.26367208   -0.00818398    0.24396009   -0.01540617   -0.02594556    0.04391675
H    3.33843439    0.20278129    0.32785064    0.00137618    0.01940363   -0.00631973
   15
   -420.47636945
H   -2.42323308    0.36758892    0.21643745    0.02307605   -0.02680878   -0.00394741
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O   -1.91378009   -1.32077881   -0.09193101    0.04091090   -0.00592990   -0.00218479
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   15
   -420.47133913
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O   -1.92275711   -1.33410670   -0.09666840    0.01154501   -0.02546119   -0.00526893
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C    0.33698958   -1.63849235    0.04633125   -0.07916285   -0.03030214    0.02226677
C    1.66244129    1.25081711    0.03375178    0.03982557   -0.01715790    0.00852967
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H    2.43777597   -2.23307209   -0.32629688    0.02345427   -0.04306799   -0.01539265
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   15
   -420.46574012
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O   -1.93226783   -1.34629127   -0.10116703   -0.01529761   -0.04190878   -0.00827805
C   -0.72064301    0.81892089   -0.00837564    0.06774596    0.05907061    0.00747532
C   -0.79339440   -0.77909003   -0.03654223    0.01624243   -0.00692160   -0.00644246
C    0.29404331    1.60867231   -0.35531949   -0.02129369    0.00186588   -0.03221938
C    0.33114060   -1.63675495    0.03455075   -0.07595774   -0.01688929    0.01513148
C    1.65671075    1.25764949    0.03021686    0.03954639    0.00392274    0.01055196
C    1.72746957   -1.30040193   -0.11062344    0.00593127    0.01973972   -0.02168124
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H    1.95735590    2.24580631    0.28794643   -0.04560423   -0.00466987   -0.00774220
H    2.48092415   -2.26246055   -0.31697350    0.03716799   -0.05527207   -0.01782249
C    2.28155772    0.03033455    0.22843082   -0.00349124    0.00264363    0.03884990
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   15
   -420.46620303
H   -2.43368602    0.37535409    0.23296008    0.00977724   -0.02983010   -0.00117067
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O   -1.94110423   -1.35659097   -0.10529173   -0.03693632   -0.05398549   -0.01085040
C   -0.71523727    0.82550748   -0.00661791    0.08395372    0.08449247    0.00105337
C   -0.78534375   -0.76798942   -0.02870588    0.03841118    0.00312771   -0.00113508
C    0.28775964    1.59120852   -0.34755710   -0.03735849   -0.02919405   -0.02198112
C    0.32984191   -1.63402122    0.02186092   -0.06415812    0.00160606    0.00687542
C    1.64863573    1.26428127    0.02606165    0.02990108    0.01787759    0.00901600
C    1.71660584   -1.30016705   -0.09788114   -0.00606284    0.01740902   -0.01699046
H   -0.00683142    2.65342445   -0.28125232   -0.01003853    0.00485993    0.01049969
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H    1.92740064    2.24260732    0.30036620   -0.04879949   -0.01335579   -0.00918234
H    2.49785793   -2.25277707   -0.29497762    0.04134579   -0.05471409   -0.01741038
C    2.28849127    0.04362548    0.21839182    0.00716973    0.01152285    0.03609275
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   15
   -420.47380010
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O   -1.94828820   -1.36445680   -0.10892599   -0.05235119   -0.06191116   -0.01293011
C   -0.71485201    0.82701144   -0.00493487    0.08881994    0.10444845   -0.00317434
C   -0.77957797   -0.75707704   -0.02079921    0.05302136    0.01298168    0.00385342
C    0.28371084    1.57547410   -0.33845885   -0.04847005   -0.05309684   -0.01303055
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C    1.63879938    1.26990750    0.02138962    0.01095551    0.01747907    0.00199317
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H    0.01426422    2.65360192   -0.29568124   -0.00739760    0.01062697    0.00972047
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H    1.93206930    2.24807326    0.31905547   -0.04345017   -0.00680826   -0.00507610
H    2.48552845   -2.20432224   -0.26057247    0.03658881   -0.04316508   -0.01477360
C    2.29499193    0.05622257    0.20617477    0.01780030    0.01982732    0.03242990
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   15
   -420.48295730
H   -2.48397522    0.48423326    0.24960042    0.01600767    0.00827227    0.00004986
O   -1.93326888    1.28823634    0.22585632    0.01027792   -0.01676159    0.00212681
O   -1.95312044   -1.36952646   -0.11197438   -0.06147147   -0.06638658   -0.01470103
C   -0.71975902    0.82224554   -0.00307953    0.07798677    0.11511579   -0.00354874
C   -0.77697778   -0.74695103   -0.01312492    0.05949082    0.02306315    0.00870480
C    0.28254256    1.56288426   -0.32855758   -0.04951637   -0.06386188   -0.00699001
C    0.33770414   -1.62947056   -0.00433861   -0.02446896    0.01589460   -0.00592702
C    1.62833451    1.27452226    0.01661706   -0.01468840    0.00817289   -0.00891360
C    1.69625191   -1.30194752   -0.06947987   -0.00598451   -0.02301474   -0.01318705
H    0.04060013    2.64645061   -0.31705684   -0.00316653    0.01104565    0.00807454
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H    1.96762424    2.25790306    0.34114658   -0.03142340    0.00859263    0.00315572
H    2.44776034   -2.12578809   -0.21570341    0.01625214   -0.01450284   -0.00921556
C    2.30042573    0.06762328    0.19200298    0.02659820    0.02759844    0.02745763
H    3.36495161   -0.00397860    0.42046278    0.00360898   -0.00943823   -0.00206053
   15
   -420.48408893
H   -2.52447071    0.53782142    0.25803529    0.01641308    0.01948794    0.00067315
O   -1.91504404    1.28001191    0.22335953    0.02807183   -0.04199511   -0.00165513
O   -1.95518582   -1.37159478   -0.11435659   -0.06463907   -0.06792475   -0.01622187
C   -0.72930165    0.81057367   -0.00103008    0.05120660    0.11472219    0.00005850
C   -0.77793827   -0.73822085   -0.00597748    0.05856285    0.03332141    0.01361376
C    0.28431046    1.55408038   -0.31821639   -0.03911895   -0.05965907   -0.00428826
C    0.34449695   -1.62850198   -0.01708130   -0.00296113    0.00806562   -0.00904538
C    1.61876766    1.27863508    0.01238282   -0.04229025    0.00005859   -0.01971008
C    1.68666436   -1.30144655   -0.05404274    0.02265133   -0.07326559   -0.01525865
H    0.06915446    2.63169011   -0.34421656    0.00209342    0.00585534    0.00597274
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C    2.30426241    0.07735858    0.17617687    0.03306142    0.03466241    0.02106775
H    3.35940241   -0.03783132    0.44645964    0.00531992   -0.01420824    0.00049477
   15
   -420.47883501
H   -2.57591368    0.57845949    0.26592657    0.00327417    0.01371041    0.00219872
O   -1.89815400    1.27362322    0.22094217    0.06096426   -0.04984214   -0.00650106
O   -1.95433879   -1.37059202   -0.11600395   -0.06231179   -0.06655238   -0.01740859
C   -0.74188672    0.79201709    0.00100374    0.01374070    0.10364378    0.00604428
C   -0.78241219   -0.73150560    0.00034663    0.05195427    0.04351661    0.01848854
C    0.28840502    1.54882494   -0.30760256   -0.02097990   -0.04377492   -0.00418865
C    0.35148303   -1.62798067   -0.02928793    0.01580880   -0.00785683   -0.00999937
C    1.61174182    1.28271251    0.00932356   -0.06660143   -0.00195825   -0.02716257
C    1.67570637   -1.29653975   -0.03769914    0.04766681   -0.11533096   -0.01404730
H    0.09619144    2.61295383   -0.37568199    0.00758426   -0.00311717    0.00398014
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C    2.30610902    0.08500345    0.15908294    0.03762529    0.04052192    0.01338717
H    3.35004256   -0.06153695    0.47207054    0.00674504   -0.01764414    0.00340747
   15
   -420.48372418
H   -2.62928897    0.60955717    0.27220290   -0.01670649    0.00213633    0.00422607
O   -1.88404759    1.26946542    0.21882014    0.09814176   -0.04929831   -0.01136766
O   -1.95068397   -1.36658173   -0.11686357   -0.05474828   -0.06194729   -0.01801161
C   -0.75529718    0.76724056    0.00267235   -0.02481809    0.08284279    0.01197100
C   -0.79000901   -0.72742083    0.00555510    0.04143469    0.05342936    0.02284747
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C    0.35753413   -1.62695948   -0.04089756    0.03034200   -0.02846260   -0.00943973
C    1.60870459    1.28687873    0.00788202   -0.08302245    0.00194381   -0.02966482
C    1.66221598   -1.28501237   -0.02054418    0.00993275   -0.09351428   -0.00627448
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H    2.16715485    2.21976421    0.37121616    0.00860177    0.02382312    0.02053886
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C    2.30568664    0.09020674    0.14118319    0.04085093    0.04457365    0.00490447
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   15
   -420.49005162
H   -2.67101934    0.63878926    0.27547490   -0.03066591   -0.00440857    0.00563896
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O   -1.94456518   -1.35977484   -0.11690933   -0.04178558   -0.05356306   -0.01773109
C   -0.76725202    0.73750000    0.00362861   -0.05450748    0.05277333    0.01563021
C   -0.80009602   -0.72656343    0.00938760    0.02771158    0.06252785    0.02605973
C    0.29919905    1.54503909   -0.28552783    0.01536664   -0.00852575   -0.00651157
C    0.36177540   -1.62423370   -0.05193688    0.03995761   -0.04547649   -0.00869643
C    1.61062912    1.29090576    0.00820616   -0.08763807    0.01020135   -0.02655438
C    1.64827407   -1.26798719   -0.00299425   -0.05722766   -0.03987916   -0.00081485
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C    2.30280197    0.09272333    0.12298805    0.04242848    0.04679850   -0.00389353
H    3.31716771   -0.06992418    0.51412083    0.00429458   -0.01906641    0.00795259
   15
   -420.48990085
H   -2.69140057    0.67075807    0.27475949   -0.03241790   -0.00360857    0.00583618
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O   -1.93657380   -1.35055407   -0.11615463   -0.02259559   -0.04079226   -0.01637079
C   -0.77598453    0.70461147    0.00365677   -0.06966072    0.01406056    0.01591148
C   -0.81184021   -0.72947748    0.01165214    0.01024260    0.06956056    0.02766837
C    0.30374102    1.54443832   -0.27393959    0.02552307   -0.00106023   -0.00638596
C    0.36361718   -1.61883400   -0.06244707    0.04601751   -0.04767417   -0.00848266
C    1.61778140    1.29430294    0.01010856   -0.07789878    0.02098147   -0.01800296
C    1.63763475   -1.24845909    0.01462431   -0.09619660   -0.00143717    0.00091011
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H   -0.10435991   -2.55902180   -0.05149819   -0.01105518    0.03731039    0.00276223
H    2.28905447    2.11642860    0.32585003    0.01265991   -0.00375426    0.01510072
H    2.49051110   -2.05256711    0.03989306    0.03752817   -0.02025798    0.00108690
C    2.29736413    0.09242049    0.10502847    0.04141363    0.04682402   -0.01278182
H    3.29544610   -0.05359984    0.52731707   -0.00002842   -0.01674541    0.00903528
   15
   -420.48934763
H   -2.68928522    0.70488852    0.26992153   -0.02001455    0.00456324    0.00474445
O   -1.87112321    1.27023656    0.21582408    0.09522886   -0.04566029   -0.00920958
O   -1.92758506   -1.33950018   -0.11466157    0.00397918   -0.02327482   -0.01384038
C   -0.78057467    0.67090265    0.00273875   -0.07089359   -0.03049664    0.01300013
C   -0.82418039   -0.73657658    0.01225232   -0.01188515    0.07214841    0.02749998
C    0.30677523    1.54392636   -0.26197150    0.02858184    0.00150170   -0.00504872
C    0.36269499   -1.61064317   -0.07244653    0.04793133   -0.03220027   -0.00783390
C    1.62957729    1.29643525    0.01308179   -0.05496524    0.03075510   -0.00592036
C    1.63265274   -1.22877095    0.03218997   -0.10331490    0.02243921    0.00207335
H    0.12322016    2.59130286   -0.51611184    0.01435613    0.00444875   -0.00738474
H   -0.08171361   -2.58136463   -0.10643239   -0.01528806    0.02240786    0.00077287
H    2.33641082    2.06310109    0.28548530    0.00570859   -0.02231185    0.00926947
H    2.51424109   -2.08541757    0.09002525    0.04936770   -0.03513649    0.00402833
C    2.28944187    0.08930250    0.08784241    0.03635214    0.04352189   -0.02177766
H    3.27379897   -0.02531625    0.53404070   -0.00517781   -0.01271231    0.00960204
   15
   -420.48957793
H   -2.67351794    0.73533525    0.26171415    0.00448852    0.01902399    0.00291847
O   -1.87645407    1.27472948    0.21584000    0.05163241   -0.04499362   -0.00306103
O   -1.91880571   -1.32740696   -0.11254452    0.03812782   -0.00140245   -0.01026337
C   -0.78092290    0.63903767    0.00104533   -0.06301311   -0.07483197    0.00792986
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   15
   -420.49033011
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O   -1.91177503   -1.31525868   -0.10996407    0.07708658    0.02263866   -0.00610768
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   15
   -420.49158711
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O   -1.90823299   -1.30412867   -0.10710526    0.11342151    0.04427512   -0.00228929
C   -0.77094193    0.59092876   -0.00340250   -0.03846896   -0.13323927   -0.00441119
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C    0.34516323   -1.57997084   -0.10010665   -0.00221794    0.02692219   -0.00173869
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H    2.38405385   -2.02937047    0.21723969    0.01487976   -0.01490155    0.00618212
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H    3.24019824    0.09801008    0.50970310   -0.00920591    0.00590069    0.01397690
   15
   -420.48616320
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O   -1.90978415   -1.29497659   -0.10413703    0.13566583    0.05775221    0.00007261
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C   -0.84995083   -0.80225557   -0.00045682   -0.09968298    0.00242058    0.01592143
C    0.30483163    1.53864586   -0.21186972   -0.00209061    0.02557928   -0.00288846
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C    1.69477248    1.28943667    0.02223450    0.02123776   -0.02391694    0.02934492
C    1.66056186   -1.17214842    0.09963265    0.05253970    0.02689145    0.02117145
H    0.00414856    2.53311192   -0.57264090    0.00285615    0.00593480   -0.01464437
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C    2.24460676    0.05695769    0.03775618   -0.03985003   -0.01465939   -0.05347107
H    3.24266415    0.13711061    0.48329164   -0.00666250    0.01275892    0.01531465
   15
   -420.47412418
H   -2.70589686    0.69155848    0.21190025   -0.02167443   -0.00627018    0.00215090
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O   -1.91740065   -1.28839984   -0.10116427    0.13430728    0.05949132    0.00040775
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C   -0.84378432   -0.82269380   -0.00652691   -0.08335734   -0.02183085    0.01416131
C    0.30315155    1.53469184   -0.19895387   -0.01296312    0.03266003   -0.00420275
C    0.33216720   -1.56537921   -0.11773056   -0.05686153    0.03620881   -0.00148398
C    1.70985862    1.28801590    0.02120602    0.03270825   -0.04086722    0.03633857
C    1.66785834   -1.16410446    0.11437790    0.10604638   -0.00531726    0.03216091
H   -0.03562699    2.49869271   -0.56037088    0.00110982   -0.00548911   -0.01180684
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C    2.23589433    0.04831138    0.03230926   -0.06138548   -0.03432645   -0.05478983
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   15
   -420.47398260
H   -2.71126728    0.66378348    0.19563085   -0.03060820   -0.01491983    0.00120950
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O   -1.93101913   -1.28448362   -0.09820449    0.10889064    0.05104205   -0.00069248
C   -0.74052781    0.57703880   -0.00720337    0.00151534   -0.10735932   -0.02112423
C   -0.83269805   -0.84183614   -0.01345731   -0.04325953   -0.04132531    0.01314339
C    0.30224776    1.52879705   -0.18578965   -0.02225249    0.03289976   -0.00435213
C    0.32999392   -1.56127908   -0.12641329   -0.07791239    0.03051310   -0.00367538
C    1.72296048    1.28901546    0.01798758    0.04534097   -0.04765292    0.04178975
C    1.66904329   -1.15604931    0.12725191    0.10415145    0.01811069    0.02955733
H   -0.07617333    2.46811537   -0.53958232   -0.00115981   -0.01503787   -0.00925085
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H    2.50725132    2.11322162   -0.04116247    0.03096104    0.01359356   -0.00348153
H    2.21926884   -1.96310082    0.32613560   -0.05590602    0.06043563   -0.00924867
C    2.23086111    0.04172927    0.03015594   -0.07632050   -0.05151282   -0.05216245
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   15
   -420.48092689
H   -2.69536493    0.64622223    0.17849860   -0.02660386   -0.01432013    0.00018072
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O   -1.94952148   -1.28286471   -0.09521257    0.06844209    0.03753353   -0.00198094
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C   -0.81905855   -0.85850150   -0.02118187    0.00919270   -0.05633858    0.01196389
C    0.30267186    1.52096762   -0.17237530   -0.02800100    0.02239637   -0.00198733
C    0.33248808   -1.55900587   -0.13486710   -0.08999606    0.02162608   -0.00699827
C    1.73332091    1.29283942    0.01225684    0.05786566   -0.04297620    0.04424910
C    1.66411228   -1.14925858    0.13840432    0.06597190    0.07370255    0.01457892
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H    0.35031870   -2.59517607   -0.37173464    0.01856937    0.02065342   -0.00482541
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C    2.23039809    0.03823106    0.03114329   -0.08216847   -0.06237594   -0.04670884
H    3.27451451    0.18512390    0.34068703   -0.00520498    0.02288094    0.00938180
   15
   -420.48188874
H   -2.66100264    0.63838499    0.16120190   -0.01099334   -0.00410741   -0.00031821
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O   -1.97111787   -1.28294868   -0.09213363    0.02476078    0.02386108   -0.00252406
C   -0.71937988    0.60125716   -0.00397043    0.03015957   -0.04536891   -0.02727290
C   -0.80595930   -0.87178071   -0.02962741    0.05866764   -0.06702849    0.01028158
C    0.30476784    1.51183265   -0.15885035   -0.02951701    0.00233867    0.00224983
C    0.34036501   -1.55807390   -0.14290455   -0.09007944    0.01932127   -0.00893309
C    1.74019040    1.29920487    0.00387062    0.06860951   -0.02693902    0.04262700
C    1.65517731   -1.14676227    0.14865746    0.02837103    0.10055308    0.00217492
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C    2.23485371    0.03845379    0.03494977   -0.07800086   -0.06317991   -0.04003245
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   15
   -420.48033793
H   -2.61914166    0.63305769    0.14407270    0.01107729    0.01304704    0.00014228
O   -1.94233930    1.32291755    0.20570979   -0.04622363    0.03149250    0.01720741
O   -1.99385812   -1.28412457   -0.08894386   -0.01373630    0.01252648   -0.00210600
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C   -0.79633266   -0.88103380   -0.03869394    0.09339966   -0.07221219    0.00845655
C    0.30863309    1.50257349   -0.14545963   -0.02783262   -0.02119746    0.00616351
C    0.35361857   -1.55838162   -0.15042256   -0.07591538    0.03045723   -0.00693697
C    1.74293514    1.30715897   -0.00707223    0.07426763   -0.00314898    0.03684506
C    1.64450824   -1.15017673    0.15875029   -0.00558891    0.09386074   -0.00465847
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H    2.30221653   -2.12712941    0.45131053    0.02023834   -0.05117665    0.02121034
C    2.24398732    0.04244953    0.04117728   -0.06604276   -0.05451833   -0.03327412
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   15
   -420.48204556
H   -2.58480700    0.61863615    0.12682349    0.02556964    0.02489230    0.00078900
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O   -2.01600882   -1.28587879   -0.08566125   -0.04339470    0.00382068   -0.00097400
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C   -0.79225432   -0.88595244   -0.04827361    0.10836687   -0.07092675    0.00694098
C    0.31417084    1.49457950   -0.13243072   -0.02390377   -0.04150184    0.00794665
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C    1.74124326    1.31531231   -0.02023299    0.06897026    0.01875209    0.02908093
C    1.63417642   -1.15917426    0.16910953   -0.03896915    0.06804666   -0.00830673
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H    2.31750330   -2.13121359    0.46964320    0.02438596   -0.05248171    0.02256670
C    2.25709952    0.04971454    0.04941762   -0.05087021   -0.04023124   -0.02657880
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   15
   -420.48956518
H   -2.56766633    0.58749250    0.10911216    0.02092103    0.01785825   -0.00026476
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O   -2.03622551   -1.28781402   -0.08233595   -0.06377969   -0.00284777    0.00055326
C   -0.70324922    0.65374870    0.01298369    0.06475766    0.03522235   -0.02307872
C   -0.79463760   -0.88661076   -0.05827455    0.10506405   -0.06387839    0.00570581
C    0.32114103    1.48905643   -0.11986893   -0.01730439   -0.05411415    0.00706637
C    0.39189331   -1.56571212   -0.16455631   -0.00416140    0.06382191    0.00422610
C    1.73545823    1.32239664   -0.03516203    0.04852031    0.02823624    0.02308311
C    1.62618052   -1.17223668    0.17995986   -0.06773651    0.03163499   -0.00954065
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H    0.45987209   -2.63818644   -0.40904425    0.02463356   -0.00389441   -0.00843199
H    2.29860235    2.18138104   -0.28200460   -0.01897533   -0.01497131   -0.00233537
H    2.31566486   -2.09819347    0.47193517    0.02092437   -0.04182294    0.02026799
C    2.27329112    0.05940415    0.05926265   -0.03607827   -0.02417874   -0.01935910
H    3.37017841    0.04562262    0.07091724    0.00420236    0.00529563   -0.00410923
   15
   -420.49702765
H   -2.56493499    0.54425939    0.09169140    0.00542847   -0.00161652   -0.00293177
O   -1.95150483    1.31684453    0.19073583   -0.03611148    0.03915346    0.01471300
O   -2.05357963   -1.28962494   -0.07903653   -0.07582378   -0.00816826    0.00227799
C   -0.70489983    0.66889068    0.02163724    0.06743478    0.04855628   -0.01791628
C   -0.80331169   -0.88342357   -0.06861992    0.08911348   -0.05327045    0.00434414
C    0.32913920    1.48675812   -0.10772296   -0.00705088   -0.05724073    0.00388714
C    0.41263475   -1.57466026   -0.17182118    0.04150348    0.06805910    0.00827091
C    1.72679676    1.32783785   -0.05150373    0.01673821    0.02532813    0.02021353
C    1.62219874   -1.18715837    0.19136340   -0.07971876   -0.01576371   -0.00591696
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H    0.44298130   -2.67129311   -0.40903700    0.02049038   -0.01611008   -0.01052739
H    2.27581804    2.21351201   -0.32166494   -0.01251599   -0.00192499   -0.00524758
H    2.29949566   -2.03603394    0.45994764    0.00491639   -0.01457413    0.01265223
C    2.29167002    0.07056080    0.07027358   -0.02226168   -0.00903569   -0.01120397
H    3.39592525   -0.00947779    0.00535118    0.01205768   -0.00241332   -0.00749357
   15
   -420.49523017
H   -2.56633389    0.50196767    0.07636312   -0.00692621   -0.01803212   -0.00538220
O   -1.95041868    1.31202164    0.18440440   -0.01915651    0.05072847    0.01409477
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C   -0.71058981    0.68113616    0.03136653    0.06236737    0.05391722   -0.01119274
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   15
   -420.48757101
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   15
   -420.48997421
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   15
   -420.49416873
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   15
   -420.48750254
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   15
   -420.47516124
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   15
   -420.46652630
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O   -2.08255602   -1.28539477   -0.06289785   -0.01719520   -0.00799997    0.01017675
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   15
   -420.46482828
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O   -2.07818383   -1.28238706   -0.06221584    0.00014722   -0.00354890    0.01012590
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   15
   -420.46508249
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   15
   -420.46061255
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   15
   -420.45416578
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   15
   -420.46052805
H   -2.69816476    0.52054154    0.11285278   -0.01943926   -0.00282391   -0.00039850
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C   -0.94207505   -0.77718465   -0.17091962   -0.08788567    0.04283432   -0.02348176
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C    1.75945204    1.25753716   -0.25519573    0.03820686   -0.04674034   -0.03721208
C    1.76901652   -1.19158422    0.24444582    0.11515673   -0.03240916    0.05073842
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C    2.40820261    0.13273592    0.14214845   -0.00415780    0.04358377    0.03979876
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   15
   -420.47262673
H   -2.68960401    0.54201497    0.12464004   -0.00057668    0.01682358   -0.00027053
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C   -0.76571931    0.67923296    0.09222613   -0.00468693   -0.02608590    0.02585517
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   15
   -420.47632615
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O   -2.06069304   -1.26368645   -0.06842919   -0.02045643   -0.00644679    0.01509340
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C   -0.90479904   -0.78001136   -0.17431794   -0.04122825    0.03826423   -0.02878878
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   15
   -420.47708017
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O   -2.05759007   -1.26019102   -0.07155042   -0.03351298   -0.00784414    0.01570766
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   15
   -420.48112129
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O   -2.05297825   -1.25634641   -0.07538153   -0.04347005   -0.00753938    0.01559164
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   15
   -420.48787489
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O   -2.04640796   -1.25216517   -0.07991727   -0.04974375   -0.00583051    0.01472229
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C    0.32540666    1.58234360    0.13215847   -0.01655607    0.00966691    0.03136653
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   15
   -420.49386036
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O   -2.03759386   -1.24772288   -0.08511834   -0.05248996   -0.00315156    0.01317599
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   15
   -420.49298165
H   -2.65789659    0.37634863    0.18412418   -0.02566343   -0.01965803    0.00822430
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O   -2.02640981   -1.24314076   -0.09091548   -0.05207375    0.00031889    0.01117444
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C    0.33611218    1.56869385    0.14431515   -0.00410890    0.01658945    0.03726810
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C    1.71530551    1.23463404   -0.24814480    0.00493685   -0.02146878   -0.03187750
C    1.71606281   -1.22345761    0.13510360    0.01838605   -0.04765762    0.00176648
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C    2.38349470    0.04177133    0.06006214    0.02157655   -0.00607085    0.00145336
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   15
   -420.48632486
H   -2.60871309    0.35820761    0.18114190   -0.01249442   -0.01402363    0.00780094
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O   -2.01287496   -1.23857583   -0.09721875   -0.04843718    0.00451918    0.00895480
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C    1.69948951    1.23634776   -0.23699234   -0.01518819   -0.01659387   -0.02596123
C    1.70377583   -1.23187395    0.11752340    0.02209147   -0.09709365    0.00711932
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   15
   -420.48696439
H   -2.55088134    0.34977202    0.17260960    0.00604667   -0.00187345    0.00623191
O   -2.06503443    1.22558418    0.10221921   -0.06328574    0.02055059   -0.00503006
O   -1.99715706   -1.23421898   -0.10392814   -0.04087806    0.00952030    0.00671806
C   -0.74660545    0.70570198    0.02229145    0.03808904    0.00873366   -0.00554242
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C    1.68456748    1.23903192   -0.22426106   -0.03039015   -0.00511127   -0.02177363
C    1.69039763   -1.23472639    0.09959966   -0.01890438   -0.08988533   -0.00338853
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   15
   -420.48953771
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C    1.67829125   -1.23235074    0.08194531   -0.08439565   -0.04241558   -0.02589756
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   15
   -420.48497377
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O   -1.96078724   -1.22707186   -0.11816778   -0.01015243    0.02150527    0.00279589
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C   -0.77755156   -0.79512481   -0.10859581    0.03640588   -0.06670487   -0.00678852
C    0.35398023    1.52927390    0.14170611    0.05562078   -0.00984444    0.03337857
C    0.41660457   -1.48403747    0.03683333    0.09858369    0.06364483    0.02414509
C    1.66070308    1.24422084   -0.19496373   -0.04284755    0.03185511   -0.01847898
C    1.67116493   -1.22736573    0.06581429   -0.12727204   -0.00089945   -0.04098723
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H    2.30585342   -2.11315670    0.43034414    0.01246757   -0.02417394    0.01921934
C    2.34362427   -0.01197320    0.00268663    0.01746016   -0.03936002   -0.00686321
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   15
   -420.47996388
H   -2.44664371    0.30458993    0.12427591    0.03226761    0.00410804    0.00354556
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O   -1.94152765   -1.22482109   -0.12552136    0.01244781    0.02733590    0.00142652
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C   -0.78134522   -0.78112464   -0.09615492    0.00598719   -0.06011720   -0.00385749
C    0.35269580    1.51873149    0.13567085    0.06620737   -0.02752426    0.03149734
C    0.42361618   -1.47903355    0.05686172    0.12291909    0.06732829    0.02469100
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C    1.67154407   -1.22226469    0.05210748   -0.13252294    0.02864736   -0.04546069
H    0.01259667    2.57684252    0.16817252   -0.01378607    0.00782510   -0.00181469
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H    2.24807715    2.08765157   -0.41707140   -0.01709606   -0.01724429   -0.00576367
H    2.31832395   -2.15982991    0.43538739    0.02068792   -0.04159378    0.02579787
C    2.33089924   -0.02076678   -0.01061954    0.01222074   -0.04898595   -0.00520831
H    3.29639678   -0.04299677    0.46865127   -0.01804209   -0.00910356    0.01962256
   15
   -420.48154673
H   -2.45571117    0.27824508    0.10272831    0.02418003   -0.01028079    0.00313853
O   -2.04649972    1.21802323    0.10727787   -0.03402917    0.02740332    0.00382731
O   -1.92283684   -1.22380542   -0.13294200    0.03600885    0.03171659    0.00067213
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C   -0.78550853   -0.76350787   -0.08347850   -0.02291464   -0.04962827   -0.00137235
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   15
   -420.48956816
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   15
   -420.49760764
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   15
   -420.49759112
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   15
   -420.49352542
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   15
   -420.49894224
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   15
   -420.50458644
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   15
   -420.50060101
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O   -1.85609220   -1.24917347   -0.18488636    0.01016821   -0.01483911   -0.00630165
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C   -0.75760884   -0.62829227   -0.00126031    0.02450497    0.10431527    0.01925036
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C    2.28480792    0.01508860   -0.09788517   -0.05378885    0.03283670    0.00111240
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   15
   -420.49410741
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O   -1.85301418   -1.25349209   -0.19176932    0.00080638   -0.02050270   -0.00800832
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   15
   -420.49279144
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O   -1.84998885   -1.25689279   -0.19829077   -0.00426072   -0.02290635   -0.00921550
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C   -0.74778482   -0.62669396    0.01469168    0.04019592    0.10168898    0.02231484
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   15
   -420.49475198
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O   -1.84678596   -1.25926690   -0.20439664   -0.00511936   -0.02193137   -0.00973981
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C    1.66266781    1.19298987    0.03924834    0.01892440   -0.02799040    0.00030796
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   15
   -420.49476798
H   -2.73787101    0.49563596   -0.14557297   -0.03278390   -0.00654162   -0.00860072
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O   -1.84336562   -1.26065776   -0.21006386   -0.00203092   -0.01778000   -0.00940391
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C    0.26491141    1.56874970   -0.04286694   -0.03969206   -0.04291293   -0.02771377
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C    1.65813799    1.19426744    0.06038740   -0.00447748   -0.03316559    0.00169769
C    1.69356362   -1.32991841    0.01364188   -0.02902609   -0.02931024    0.01836745
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H    2.50589133   -2.10412633   -0.11449609    0.02876650   -0.00370602   -0.01080476
C    2.33243318    0.02755799   -0.13606634    0.02913878    0.03950694    0.00984172
H    3.34040774    0.22453410   -0.55639891    0.00373651    0.02049612   -0.02012253
   15
   -420.48756465
H   -2.73714875    0.48681722   -0.16239157   -0.03398271   -0.01109655   -0.01055681
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O   -1.83986667   -1.26125246   -0.21530808    0.00466127   -0.01084324   -0.00809968
C   -0.79068467    0.76962434   -0.00340927    0.02458512    0.01887171   -0.00410978
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C    0.27446244    1.59084558   -0.05713251   -0.01755168   -0.01815452   -0.03315978
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   15
   -420.47482942
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   15
   -420.47119503
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   15
   -420.47137964
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O   -1.83255229   -1.26179458   -0.22930263    0.03803035    0.01760371    0.00051165
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C   -0.76389326   -0.73174405    0.03338018   -0.02371042   -0.02320250    0.00259202
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C    1.65152289    1.21665581    0.14071294   -0.02730280    0.00217318    0.03135942
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   15
   -420.46581230
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O   -1.83284295   -1.26298431   -0.23381839    0.04718658    0.02462276    0.00318762
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C    0.39237145   -1.60075609    0.28529240    0.04412260   -0.00592580   -0.00895697
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C    2.34972385   -0.00192184   -0.19150039    0.08623905    0.00092488   -0.02211719
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   15
   -420.46124174
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C    1.66734095   -1.34409932   -0.01577092   -0.10237205   -0.00542674    0.04445451
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   15
   -420.46271280
H   -2.56717973    0.40682121   -0.18469363    0.00718876   -0.01501132   -0.00810676
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O   -1.83994282   -1.26880260   -0.24331939    0.04708028    0.02582755    0.00357300
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C   -0.76609130   -0.78575658    0.03644209   -0.04019849   -0.05159307   -0.00905764
C    0.31812144    1.70000114   -0.09262940    0.04485973    0.06044935   -0.05029994
C    0.40711394   -1.61177163    0.31663828    0.04405333    0.00765889   -0.00228444
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C    1.67708437   -1.33516954   -0.02817897   -0.08021633    0.01111235    0.03427897
H   -0.10398139    2.72243079   -0.03927051   -0.02306121    0.00450319    0.00051115
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H    2.35675825   -2.33500034   -0.28050916    0.02870372   -0.05425573   -0.01866216
C    2.32442917   -0.01627960   -0.20801204    0.06689947   -0.00979644   -0.02545494
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   15
   -420.46899941
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O   -1.84673967   -1.27348538   -0.24831999    0.03585231    0.01992063    0.00071901
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C   -0.76203649   -0.79795929    0.03832937   -0.02944718   -0.04929369   -0.00907566
C    0.31717103    1.70701000   -0.08855867    0.03737031    0.05973398   -0.04992567
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C    1.69160435   -1.32688541   -0.04262980   -0.04288078    0.02187667    0.01797818
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C    2.30532753   -0.02274911   -0.21395962    0.04119008   -0.01770589   -0.01965522
H    3.25176275    0.09791054   -0.74549689   -0.00535604    0.00605325   -0.01761761
   15
   -420.47530051
H   -2.56314936    0.37954783   -0.17038762    0.00126689   -0.02811942   -0.01004173
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O   -1.85514182   -1.27906305   -0.25334764    0.01896754    0.01158470   -0.00360506
C   -0.77167506    0.77072258    0.03705707    0.01237279   -0.02883085    0.00564606
C   -0.75623395   -0.80719900    0.04075702   -0.01210081   -0.04334742   -0.00741545
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C    1.70866165   -1.31986321   -0.05814549    0.00581897    0.02001363   -0.00279771
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C    2.28375810   -0.02814578   -0.21872165    0.01081528   -0.02606604   -0.01314688
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   15
   -420.47490812
H   -2.56320146    0.39482539   -0.15239907    0.00408583   -0.02107715   -0.00691856
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O   -1.86439473   -1.28516436   -0.25820938   -0.00054688    0.00267181   -0.00856193
C   -0.77240735    0.77702853    0.04098908    0.01354019   -0.02387832    0.00543507
C   -0.74971510   -0.81382514    0.04362825    0.00832817   -0.03576496   -0.00477681
C    0.30924308    1.71028428   -0.07147208    0.01190994    0.05580345   -0.04560467
C    0.41248083   -1.63057103    0.36292258   -0.00297993   -0.01051463    0.02689921
C    1.67724411    1.24847167    0.19653665   -0.00547689   -0.01474258    0.06164477
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C    2.26152533   -0.03196738   -0.22267563   -0.01780956   -0.03418996   -0.00912330
H    3.29395163   -0.03711403   -0.67001970    0.01449625   -0.00882938   -0.02096248
   15
   -420.46629162
H   -2.56641117    0.42477654   -0.12952292    0.01041255   -0.00581001   -0.00222593
O   -2.11439555    1.29592900    0.05855583   -0.06299859    0.04134322    0.01011477
O   -1.87362518   -1.29138995   -0.26268319   -0.01947642   -0.00544866   -0.01338407
C   -0.77395655    0.78476298    0.04459396    0.01433994   -0.01580476    0.00490995
C   -0.74369557   -0.81828751    0.04678694    0.02791596   -0.02827390   -0.00185513
C    0.30378767    1.70679677   -0.05871720   -0.00255361    0.05070860   -0.04173037
C    0.41328408   -1.63632525    0.37594454   -0.01594201   -0.02211220    0.03654093
C    1.68304400    1.25420232    0.19376695    0.00332499   -0.00767691    0.06277980
C    1.73816522   -1.30756622   -0.08727582    0.11654415   -0.04240141   -0.04471106
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H    2.16424697   -2.20206061   -0.18979396   -0.06388334    0.05825149    0.01730477
C    2.24033846   -0.03372190   -0.22605913   -0.04030200   -0.04223609   -0.00874758
H    3.30282764   -0.09796161   -0.60997485    0.01724792   -0.01681188   -0.01750544
   15
   -420.46350843
H   -2.57717949    0.45870590   -0.10502344    0.01748243    0.01231760    0.00209817
O   -2.10537369    1.29526694    0.05044304   -0.06643376    0.01910225    0.00480116
O   -1.88198393   -1.29737394   -0.26655215   -0.03528020   -0.01207809   -0.01757721
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C   -0.73934363   -0.82103403    0.05005933    0.04346186   -0.02191501    0.00079156
C    0.29848385    1.70026174   -0.04344460   -0.01648223    0.04185806   -0.03668055
C    0.41502793   -1.64075913    0.38676557   -0.02427390   -0.03032116    0.04441258
C    1.68862224    1.26035059    0.18720780    0.01622449    0.00868794    0.06243409
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H    0.18574671    2.78630762   -0.11171221    0.01014143    0.00680832   -0.00321705
H    0.29146388   -2.70907000    0.49369297    0.01384823    0.00236395   -0.00411686
H    2.33380599    2.16681749    0.22388392   -0.00341095    0.02181561    0.00064921
H    2.17650476   -2.18975576   -0.17969749   -0.06586545    0.06000598    0.01758697
C    2.22154810   -0.03291858   -0.22889814   -0.05467451   -0.05082010   -0.01146890
H    3.29964176   -0.14679583   -0.53747746    0.01408097   -0.02322297   -0.01150863
   15
   -420.46909402
H   -2.60012320    0.48438343   -0.08186061    0.01770991    0.02032638    0.00364300
O   -2.09336663    1.29370582    0.04210125   -0.06205070    0.00512375    0.00230582
O   -1.88875880   -1.30281638   -0.26962660   -0.04664097   -0.01698024   -0.02096125
C   -0.77970965    0.80239055    0.05096059    0.01588182    0.00860485    0.00325029
C   -0.73759065   -0.82244726    0.05328672    0.05318781   -0.01711943    0.00287607
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   15
   -420.47112231
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   15
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   15
   -420.47495584
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   15
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   15
   -420.48977108
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   15
   -420.49120702
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   15
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   15
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   15
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   15
   -420.48373065
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   15
   -420.48929016
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   15
   -420.49482060
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   15
   -420.49835606
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O   -1.85141414   -1.32554982   -0.23278264    0.04061602   -0.00331214   -0.00493396
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   15
   -420.49747296
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O   -1.85460909   -1.32796271   -0.22758925    0.03070172   -0.01254449   -0.00826238
C   -0.71523635    0.66753976    0.11266770    0.04510474   -0.05154631    0.00384202
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   15
   -420.49179589
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O   -1.85920052   -1.32981376   -0.22202391    0.02164635   -0.01988277   -0.01085202
C   -0.70423745    0.64992579    0.11896681    0.05745480   -0.06878846    0.00686169
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C    1.62666415    1.29592609   -0.15081259   -0.02440057   -0.02750667   -0.05526228
C    1.66587508   -1.22095646   -0.07352857    0.02905831    0.07039734   -0.03005156
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   15
   -420.48306118
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O   -1.86478255   -1.33077246   -0.21596955    0.01483154   -0.02464791   -0.01252704
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C   -0.78423242   -0.73023898    0.10079949    0.03152452    0.08711747    0.02815071
C    0.28351916    1.55608186    0.24764198   -0.02985716    0.00346912    0.02214493
C    0.28324809   -1.62845923    0.23588852   -0.09374374   -0.04145917    0.00054539
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C    2.26679909    0.03783239   -0.11407918   -0.01554040   -0.04198367    0.02750223
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   15
   -420.47255091
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O   -1.87104741   -1.33062250   -0.20934985    0.01063364   -0.02683884   -0.01337905
C   -0.69324833    0.62768382    0.13014242    0.07552787   -0.08050148    0.01273690
C   -0.77416662   -0.73490211    0.10078212    0.05618993    0.07980082    0.03224427
C    0.27584445    1.54900960    0.25373021   -0.04286087   -0.00935080    0.01707321
C    0.26960350   -1.61894668    0.21967711   -0.11318927   -0.03194785   -0.00419323
C    1.62071812    1.32456372   -0.17072418   -0.00720777    0.01570997   -0.05749578
C    1.69256836   -1.21241888   -0.05775368    0.10488075    0.03065260   -0.03676568
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C    2.27636899    0.03626857   -0.10653186   -0.01512308   -0.04306727    0.03453800
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   15
   -420.46392518
H   -2.60374990    0.55611586   -0.12531587   -0.00991735   -0.01001013    0.00210402
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O   -1.87780352   -1.32926383   -0.20212597    0.00877689   -0.02660701   -0.01348549
C   -0.69434291    0.62375789    0.13466398    0.07959398   -0.07374331    0.01549768
C   -0.76748183   -0.74432987    0.09882212    0.07728844    0.06035409    0.03480567
C    0.27074259    1.54250030    0.25879166   -0.05198622   -0.02169858    0.01086461
C    0.26278320   -1.60753230    0.20371996   -0.12826984   -0.01645138   -0.00907317
C    1.61871435    1.33820078   -0.17547278    0.00442385    0.04681550   -0.05588963
C    1.69752112   -1.21175364   -0.04660742    0.11403113    0.01920833   -0.03614014
H   -0.12838929    2.53507396    0.53425233   -0.01160064    0.00465721    0.01311090
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H    2.17033019    2.24841870   -0.15363141   -0.01949753   -0.00804602    0.00782643
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C    2.28681776    0.03728357   -0.10106172   -0.00763014   -0.03898572    0.03925887
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   15
   -420.46219802
H   -2.62426677    0.54965574   -0.16015785   -0.02324930   -0.01831615   -0.00080356
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O   -1.88496482   -1.32670715   -0.19429315    0.00879922   -0.02393093   -0.01281788
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C   -0.76543799   -0.75737224    0.09476684    0.09161510    0.03391229    0.03539030
C    0.26876150    1.53727830    0.26319499   -0.05641345   -0.02914937    0.00486218
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C    1.61648366    1.34904965   -0.17684436    0.00796243    0.06920612   -0.05348426
C    1.69568054   -1.21236657   -0.03327877    0.10282481    0.02928138   -0.03470038
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H    2.07506011   -2.20467610    0.00207589   -0.04625487    0.00277912    0.00564630
C    2.29769956    0.04064196   -0.09794997    0.00551435   -0.03197996    0.04082537
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   15
   -420.46853121
H   -2.62866149    0.55585126   -0.19443785   -0.02622783   -0.01764504   -0.00345393
O   -1.90881720    1.29418555   -0.11163102    0.01196274    0.04817976   -0.01520136
O   -1.89253161   -1.32307407   -0.18588201    0.01052565   -0.01875191   -0.01127806
C   -0.71074544    0.62847171    0.14077496    0.06713695   -0.04671239    0.01868444
C   -0.76887852   -0.77246464    0.08858371    0.09467098    0.00719369    0.03348409
C    0.27016230    1.53378154    0.26729710   -0.05489619   -0.02918910    0.00025662
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C    1.68767786   -1.21475292   -0.01785698    0.07985063    0.04057216   -0.03211289
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C    2.30823527    0.04592701   -0.09729174    0.02115297   -0.02350641    0.03931126
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   15
   -420.47965874
H   -2.61483078    0.57426149   -0.22632253   -0.01810669   -0.00862956   -0.00456001
O   -1.90038390    1.28619846   -0.11369940    0.01583370    0.03104905   -0.01300458
O   -1.90058393   -1.31859928   -0.17696296    0.01438826   -0.01113045   -0.00873089
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C   -0.77796867   -0.78801646    0.08038916    0.08272261   -0.01486013    0.02887078
C    0.27485058    1.53201223    0.27137329   -0.04694295   -0.02177710   -0.00230196
C    0.28988865   -1.57161820    0.15999698   -0.11159017    0.02972828   -0.01639679
C    1.61145301    1.35840368   -0.17026346   -0.02404360    0.05739089   -0.03768289
C    1.67489161   -1.21952575   -0.00050574    0.04754333    0.03913871   -0.02705101
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C    2.31750063    0.05263211   -0.09900139    0.03508662   -0.01473469    0.03587627
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   15
   -420.48952622
H   -2.58859804    0.59841432   -0.25509157    0.00033540    0.00796722   -0.00294300
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O   -1.90929979   -1.31362783   -0.16765163    0.02111352   -0.00133703   -0.00518150
C   -0.74262511    0.64446678    0.14250680    0.01798644   -0.01737599    0.01503033
C   -0.79198549   -0.80269857    0.07046043    0.05574712   -0.03123612    0.02188723
C    0.28234993    1.53153578    0.27557919   -0.03345709   -0.00966949   -0.00301206
C    0.31361287   -1.56217183    0.14729536   -0.06837692    0.03681960   -0.01557826
C    1.61050909    1.35750839   -0.16326804   -0.04463838    0.04444941   -0.02406541
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H    2.15381921   -2.27300630    0.07186913   -0.01204339   -0.04686248    0.00642871
C    2.32466889    0.06023224   -0.10287860    0.04419041   -0.00673584    0.03195779
H    3.30255064   -0.12204565   -0.52936578   -0.01016218   -0.01816096   -0.00480147
   15
   -420.49355951
H   -2.56275798    0.61676154   -0.28187171    0.02061699    0.02512448    0.00062490
O   -1.88565069    1.26737473   -0.11610904    0.01940528   -0.02877721   -0.01092175
O   -1.91898496   -1.30860049   -0.15810807    0.03079780    0.00972142   -0.00091138
C   -0.76102150    0.65447902    0.14193721   -0.01790239   -0.00270640    0.01009989
C   -0.80932197   -0.81551133    0.05921558    0.01853285   -0.04364634    0.01340983
C    0.29185568    1.53164671    0.27996390   -0.01655179    0.00185935   -0.00307883
C    0.34137559   -1.55494698    0.13553008   -0.00613543    0.04285058   -0.01352894
C    1.61223199    1.35389019   -0.15481469   -0.05881611    0.03808261   -0.01086333
C    1.64344570   -1.23505973    0.03859370   -0.04848936   -0.00255816   -0.00957615
H    0.05399916    2.51491196    0.63403352    0.01047982   -0.01467270    0.01058915
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H    2.15952335    2.32282366   -0.46088270    0.01119919    0.03382725   -0.01474865
H    2.20828996   -2.23751079    0.08561183   -0.00344290   -0.04108850    0.00506841
C    2.32919114    0.06824760   -0.10868911    0.04807465   -0.00026673    0.02809010
H    3.29944342   -0.11620731   -0.56853276   -0.00517410   -0.01713068   -0.00706460
   15
   -420.49187201
H   -2.55080765    0.61788837   -0.30894328    0.02555550    0.02830488    0.00153163
O   -1.87959924    1.25916221   -0.11656351    0.04097343   -0.04824081   -0.00620537
O   -1.93007261   -1.30401239   -0.14852341    0.04169999    0.02028147    0.00340715
C   -0.77832476    0.66465275    0.14076295   -0.05577383    0.01231721    0.00397235
C   -0.82776865   -0.82569690    0.04716071   -0.02078884   -0.05343606    0.00471644
C    0.30235925    1.53167584    0.28453873    0.00094738    0.00742382   -0.00382841
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   15
   -420.48674499
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   15
   -420.48096333
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   15
   -420.48002995
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   15
   -420.48657076
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   15
   -420.49591550
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   15
   -420.49858250
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   15
   -420.49073173
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   15
   -420.47815517
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   15
   -420.46689439
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   15
   -420.45761559
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   15
   -420.45009105
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   15
   -420.44649135
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   15
   -420.45022426
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   15
   -420.46022204
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   15
   -420.47070444
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   15
   -420.47948084
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   15
   -420.48811060
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   15
   -420.49564928
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   15
   -420.49801136
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   15
   -420.49304264
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O   -2.02901193   -1.21163811   -0.03678803    0.01865628    0.04907972    0.00063006
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   15
   -420.48357243
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   15
   -420.47656098
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   15
   -420.47612058
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C    2.41286316    0.08984264   -0.19327210    0.05761084    0.02579852   -0.03180879
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   15
   -420.48096248
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O   -1.98115440   -1.20649340   -0.02734333    0.01410407    0.05020915   -0.00571762
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   15
   -420.48872538
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   15
   -420.49576061
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   15
   -420.49908664
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   15
   -420.49908842
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   15
   -420.49701614
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   15
   -420.49444873
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   15
   -420.49301074
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O   -1.90925797   -1.26019679   -0.00176893    0.00666831   -0.01561959    0.00058043
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   15
   -420.49246250
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O   -1.89828632   -1.26755532    0.00244390    0.01892608   -0.01564681    0.00263689
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C    0.28024821    1.53698550   -0.00374064   -0.03181342   -0.03037848   -0.03051557
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   15
   -420.49194224
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O   -1.88818168   -1.27421601    0.00653881    0.03334251   -0.01246103    0.00424112
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   15
   -420.49087350
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O   -1.87959341   -1.28032030    0.01044362    0.04861072   -0.00682267    0.00523911
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   15
   -420.48966290
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C    2.31282606    0.00522143    0.05382454    0.00179758   -0.04723326    0.01332873
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   15
   -420.48992074
H   -2.53055278    0.29346149   -0.02390601    0.00251849   -0.02658716   -0.00683378
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O   -1.86961087   -1.29191877    0.01752465    0.06991882    0.00632504    0.00590013
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C   -0.80081482   -0.71351135   -0.07371529   -0.06374457    0.02195722   -0.02286000
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C    0.35998019   -1.58315680    0.14865458   -0.01229711   -0.02963555    0.03986743
C    1.62725392    1.23659992    0.07719329   -0.14332366    0.01020044   -0.00159148
C    1.69503517   -1.20340980   -0.16820476    0.01138984    0.06741266   -0.03194897
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   15
   -420.49157452
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O   -1.86915483   -1.29799521    0.02066817    0.06850907    0.01005519    0.00628100
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   15
   -420.49229106
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   15
   -420.49033798
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O   -1.87691520   -1.31146684    0.02605401    0.03638349    0.00593434    0.00853971
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C    1.65696292    1.22500963    0.10344560   -0.03645911    0.01854244    0.00482517
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   15
   -420.48492728
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O   -1.88370137   -1.31867958    0.02819549    0.01278732   -0.00070275    0.00997928
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C    1.67495181    1.21850750    0.11190251   -0.00047613   -0.01427376    0.01083517
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C    2.25613483    0.00918643    0.12565533   -0.01258404    0.03032184    0.02169613
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   15
   -420.47641847
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O   -1.89107428   -1.32585660    0.02988593   -0.00915876   -0.00837817    0.01095157
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   15
   -420.46808357
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O   -1.89805088   -1.33265465    0.03108255   -0.02605724   -0.01576471    0.01111023
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   15
   -420.46211754
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O   -1.90386927   -1.33874139    0.03177836   -0.03660291   -0.02211780    0.01040278
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C    2.22987936   -0.00133251    0.15416770   -0.05731611    0.04844776    0.02178223
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   15
   -420.45885810
H   -2.66098512    0.40450614    0.07789277   -0.02428088   -0.00883025    0.00242121
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O   -1.90804992   -1.34382956    0.03200497   -0.04103411   -0.02716061    0.00897431
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C    1.73343255    1.21909046    0.13695775    0.07052111   -0.06480778    0.01727383
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   15
   -420.45876927
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C   -0.75001313   -0.78300289   -0.02507342    0.07898683   -0.04596223   -0.02504498
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C    1.69085717   -1.28048325   -0.19829450    0.00251611   -0.03202594   -0.00993508
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   15
   -420.46194116
H   -2.66923194    0.42097619    0.10315903   -0.02432686   -0.00607105    0.00364321
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O   -1.91091341   -1.35015564    0.03133030   -0.03537445   -0.03318791    0.00470400
C   -0.80927196    0.82688537   -0.13987237   -0.02983852    0.05903051   -0.02634567
C   -0.75613779   -0.77517665   -0.01002294    0.06983751   -0.03411422   -0.02025546
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H    2.23668221   -2.09827885   -0.73720307   -0.00606368   -0.01590025   -0.02403107
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   15
   -420.46782590
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O   -1.90984686   -1.35112067    0.03062196   -0.02693297   -0.03401542    0.00208385
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C   -0.76643612   -0.76530675    0.00625118    0.05075024   -0.01843823   -0.01516835
C    0.25548403    1.70050370   -0.17957574   -0.08879890    0.04774262   -0.00823467
C    0.37760668   -1.54718286    0.09093734   -0.05499481    0.03010487    0.04644089
C    1.73647761    1.25455405    0.14477274    0.08461727    0.03459183    0.01734179
C    1.72527186   -1.26488468   -0.19969517    0.06066358    0.02172172   -0.00802455
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H    2.41288404    2.03725294    0.35749481   -0.01179468   -0.01868394   -0.00250989
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C    2.24106617   -0.04417226    0.17448110   -0.05165541   -0.04736953    0.01434739
H    3.32521834   -0.06567771    0.29603166   -0.00356274   -0.00332708   -0.00195666
   15
   -420.47510860
H   -2.61619895    0.44804306    0.11884589    0.00836219    0.02209329    0.00144168
O   -2.02382140    1.20861520    0.06942991    0.02433262   -0.04374267    0.01372974
O   -1.90756989   -1.35054853    0.02981996   -0.01540556   -0.03319322   -0.00077279
C   -0.80488186    0.80617519   -0.11807901   -0.03219037    0.03043636   -0.02233118
C   -0.77976914   -0.75433191    0.02343890    0.02476817   -0.00075045   -0.00934289
C    0.25860240    1.70687038   -0.19490293   -0.08051594    0.04083191   -0.00739675
C    0.37131687   -1.56727830    0.07251098   -0.05702949   -0.00269185    0.04243065
C    1.72747820    1.26485869    0.14535283    0.06965168    0.04427588    0.01504443
C    1.73781888   -1.25824294   -0.19963921    0.07963898    0.03904605   -0.00953977
H    0.31334505    2.71242948   -0.61033795    0.02246804   -0.00265856   -0.01192193
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   15
   -420.48197563
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O   -1.90460339   -1.34847653    0.02905362   -0.00138610   -0.03072069   -0.00379124
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C   -0.79458369   -0.74330914    0.04118670   -0.00450117    0.01645010   -0.00255231
C    0.26655423    1.71076409   -0.20977948   -0.06507827    0.03443703   -0.00710301
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C    1.71433228    1.27256209    0.14504715    0.04195671    0.03898868    0.00820639
C    1.74559195   -1.25390639   -0.19899471    0.09008434    0.04534363   -0.01327684
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   15
   -420.48701825
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O   -2.03218382    1.22060530    0.06263003    0.00273991   -0.02476654    0.01419540
O   -1.90157882   -1.34501581    0.02845935    0.01387097   -0.02687856   -0.00682206
C   -0.79296858    0.77836485   -0.09095534   -0.02209726   -0.01061158   -0.01489416
C   -0.80912688   -0.73326787    0.05908483   -0.03359630    0.03102749    0.00503796
C    0.27841212    1.71254911   -0.22421298   -0.04370405    0.03305110   -0.00938412
C    0.36861694   -1.60566761    0.02832063   -0.03925325   -0.03783055    0.03035767
C    1.69865973    1.27792204    0.14425121    0.01180592    0.03042686    0.00008300
C    1.74796822   -1.25226373   -0.19754339    0.09018671    0.04223968   -0.01773205
H    0.16912438    2.76913353   -0.63077766    0.00640308    0.02723636   -0.02170868
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C    2.28195131   -0.05452547    0.17989288   -0.00756408   -0.07906848    0.01323345
H    3.35842648   -0.03435600    0.32178313   -0.00285583   -0.00146805   -0.00250681
   15
   -420.48903741
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O   -2.03670298    1.22864959    0.05825756    0.00205576    0.00263649    0.01186807
O   -1.89918048   -1.34033824    0.02817397    0.02825096   -0.02231986   -0.00967899
C   -0.78482636    0.76478051   -0.07592205   -0.01388995   -0.03022500   -0.00992472
C   -0.82165621   -0.72508407    0.07667644   -0.05908459    0.04185461    0.01300421
C    0.29289513    1.71230624   -0.23806539   -0.01870613    0.03740897   -0.01432829
C    0.37115161   -1.62184326    0.00328419   -0.02353123   -0.03869125    0.02288011
C    1.68224957    1.28142624    0.14343998   -0.01386581    0.02477264   -0.00610384
C    1.74495423   -1.25316214   -0.19502847    0.07751370    0.03634161   -0.02054898
H    0.08684881    2.77307143   -0.61910616   -0.00390069    0.03133508   -0.02168561
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C    2.29780060   -0.04877393    0.18014017    0.01066199   -0.07221575    0.01552941
H    3.37479028   -0.02110544    0.33399436    0.00033255   -0.00060785   -0.00211758
   15
   -420.48867883
H   -2.57545150    0.35984738    0.13726856   -0.00420788   -0.02256845    0.00450878
O   -2.04130168    1.23659701    0.05334784   -0.00185462    0.02452278    0.00914427
O   -1.89805068   -1.33464723    0.02832659    0.03907567   -0.01796485   -0.01222287
C   -0.77584325    0.75300454   -0.06029113   -0.00580934   -0.04592351   -0.00443459
C   -0.83064678   -0.71941209    0.09348189   -0.07767480    0.04882338    0.02094191
C    0.30850439    1.70977674   -0.25104186    0.00734339    0.04661230   -0.02112033
C    0.37510308   -1.63569444   -0.02312909   -0.00653739   -0.03630724    0.01405065
C    1.66664445    1.28341127    0.14298148   -0.03282208    0.02333216   -0.00900625
C    1.73732143   -1.25627283   -0.19128103    0.05136219    0.03287035   -0.02138575
H    0.00731659    2.75493521   -0.59200964   -0.01306940    0.02720522   -0.01846399
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H    2.47214584    1.96989256    0.57645968    0.03278179   -0.00152092    0.02327924
H    2.34908219   -2.11706188   -0.42135273   -0.01216854    0.00006434   -0.00116573
C    2.31300281   -0.03868021    0.17944583    0.02924985   -0.06026672    0.01827925
H    3.39090167   -0.00741319    0.34772396    0.00383263    0.00017819   -0.00162393
   15
   -420.48702084
H   -2.57193405    0.34719412    0.13671284   -0.00577225   -0.02942543    0.00534627
O   -2.04580056    1.24347110    0.04802204   -0.00987800    0.03607560    0.00671407
O   -1.89867123   -1.32813669    0.02903270    0.04391600   -0.01476565   -0.01445909
C   -0.76650092    0.74397621   -0.04439294    0.00075550   -0.05569752    0.00123643
C   -0.83498737   -0.71667621    0.10902229   -0.08680966    0.05244515    0.02862308
C    0.32367750    1.70441079   -0.26273745    0.03184060    0.05924095   -0.02859157
C    0.37945619   -1.64734244   -0.05038710    0.00923378   -0.03529548    0.00423358
C    1.65298482    1.28396235    0.14304790   -0.04383643    0.02647554   -0.00793867
C    1.72662674   -1.26137550   -0.18624054    0.01650251    0.03007714   -0.02209699
H   -0.06297550    2.71765506   -0.55175760   -0.01936406    0.01567916   -0.01292510
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H    2.41072090   -2.11206637   -0.35274033    0.00267571   -0.00808866   -0.00027190
C    2.32644163   -0.02495358    0.17764786    0.04669291   -0.04588916    0.02065958
H    3.40429023    0.00616369    0.36262368    0.00671614    0.00073931   -0.00116120
   15
   -420.48416737
H   -2.56455393    0.35518336    0.13237364   -0.00230804   -0.02700194    0.00504076
O   -2.04983962    1.24874876    0.04238911   -0.02108021    0.03673500    0.00492962
O   -1.90125695   -1.32094972    0.03039384    0.04154168   -0.01326793   -0.01649653
C   -0.75719466    0.73828076   -0.02856827    0.00547379   -0.05839543    0.00666532
C   -0.83413029   -0.71709762    0.12283327   -0.08549551    0.05316994    0.03598564
C    0.33694385    1.69545748   -0.27270764    0.05263981    0.07265049   -0.03528994
C    0.38326778   -1.65683787   -0.07790064    0.02160504   -0.03784273   -0.00572773
C    1.64193294    1.28288930    0.14357285   -0.04639083    0.03400507   -0.00270940
C    1.71493508   -1.26827747   -0.17985778   -0.01861371    0.02356223   -0.02387793
H   -0.11955795    2.66937546   -0.50224986   -0.02183944   -0.00059785   -0.00653033
H   -0.02969166   -2.70016949   -0.14502473   -0.01980321   -0.01849456    0.00257089
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H    2.47044683   -2.10140172   -0.28403689    0.01743314   -0.01379111    0.00229245
C    2.33707177   -0.00845313    0.17460606    0.06114204   -0.03116460    0.02192943
H    3.41291170    0.01922466    0.37836694    0.00839130    0.00100700   -0.00081545
   15
   -420.48049826
H   -2.55579390    0.38201732    0.12447986    0.00589151   -0.01455593    0.00348623
O   -2.05290972    1.25240304    0.03652887   -0.03560691    0.02586936    0.00407392
O   -1.90570213   -1.31315436    0.03250295    0.03248693   -0.01344673   -0.01844520
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C   -0.82815091   -0.72072086    0.13446976   -0.07457999    0.05110535    0.04295858
C    0.34704865    1.68212996   -0.28055506    0.06914653    0.08205723   -0.03973091
C    0.38580008   -1.66402216   -0.10507156    0.02857076   -0.04480655   -0.01495745
C    1.63366305    1.27975783    0.14425284   -0.04456050    0.04143658    0.00402275
C    1.70433256   -1.27657771   -0.17202792   -0.04652716    0.01183233   -0.02622915
H   -0.16057147    2.62150468   -0.44798721   -0.02175079   -0.01641816   -0.00097775
H   -0.04978892   -2.67934717   -0.15341311   -0.01893836   -0.00680247    0.00456705
H    2.30577334    1.98237244    0.55656049   -0.01032819   -0.03236823    0.00264777
H    2.51790614   -2.08114953   -0.21705800    0.02751540   -0.01386804    0.00610011
C    2.34402803    0.00993605    0.17024623    0.07081745   -0.01716852    0.02156079
H    3.41557583    0.03157220    0.39470667    0.00867512    0.00105562   -0.00059349
   15
   -420.47820941
H   -2.55149221    0.41879826    0.11413209    0.01733519    0.00629191    0.00103489
O   -2.05435290    1.25492124    0.03048060   -0.05283019    0.00555399    0.00399090
O   -1.91160358   -1.30474482    0.03544851    0.01876565   -0.01470501   -0.02028654
C   -0.73979500    0.73711177    0.00159140    0.01366092   -0.04314817    0.01536072
C   -0.81769684   -0.72741996    0.14351128   -0.05652440    0.04606720    0.04929364
C    0.35298863    1.66388863   -0.28601361    0.08218618    0.08177154   -0.04145774
C    0.38663745   -1.66847991   -0.13134522    0.02911294   -0.05487298   -0.02272635
C    1.62811197    1.27417967    0.14471303   -0.04704194    0.03710449    0.00626673
C    1.69648410   -1.28557217   -0.16261432   -0.06253174   -0.00419073   -0.02806507
H   -0.18588266    2.58504932   -0.39290841   -0.02221737   -0.02549550    0.00279860
H   -0.05647646   -2.65392566   -0.16507098   -0.01431422    0.00970486    0.00622664
H    2.24813026    2.02131574    0.53730173   -0.01837254   -0.03323086   -0.00137621
H    2.54596632   -2.05125062   -0.15447552    0.03064606   -0.00825052    0.00996837
C    2.34673314    0.02936602    0.16459181    0.07418506   -0.00360600    0.01932643
H    3.41205306    0.04316510    0.41147247    0.00792893    0.00100388   -0.00036433
   15
   -420.47952471
H   -2.55945818    0.45123496    0.10301182    0.02482546    0.02359008   -0.00093392
O   -2.05341219    1.25717842    0.02425294   -0.06616668   -0.01193419    0.00342394
O   -1.91834906   -1.29566747    0.03931342    0.00304592   -0.01611257   -0.02183707
C   -0.73221436    0.74072697    0.01540345    0.02057605   -0.02734925    0.01803656
C   -0.80384416   -0.73689023    0.14957715   -0.03443305    0.03805364    0.05450147
C    0.35397965    1.64076567   -0.28897242    0.09070119    0.06893441   -0.04170272
C    0.38573896   -1.66963170   -0.15625390    0.02481196   -0.06219600   -0.02861266
C    1.62543412    1.26646096    0.14482739   -0.05438721    0.01311981    0.00240902
C    1.69234378   -1.29429716   -0.15151130   -0.06386109   -0.02346396   -0.02831016
H   -0.19503930    2.56634393   -0.33977910   -0.02507261   -0.02459457    0.00548161
H   -0.05291322   -2.63538476   -0.18117199   -0.00880753    0.02422239    0.00721859
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H    2.55244709   -2.01570957   -0.09900481    0.02558752    0.00238282    0.01273560
C    2.34498874    0.04900901    0.15777764    0.07022071    0.01097667    0.01530114
H    3.40285244    0.05403764    0.42849087    0.00661152    0.00091030    0.00000835
   15
   -420.48345131
H   -2.58440889    0.46791656    0.09243830    0.01805996    0.02152574   -0.00092910
O   -2.04952659    1.25990166    0.01787796   -0.06493942   -0.01063109    0.00086585
O   -1.92523435   -1.28586241    0.04416691   -0.01229354   -0.01663435   -0.02279038
C   -0.72589580    0.74597784    0.02813202    0.03099269   -0.00788447    0.01924479
C   -0.78791626   -0.74864867    0.15235585   -0.01081644    0.02739063    0.05790619
C    0.34953210    1.61352809   -0.28940831    0.08987221    0.04526836   -0.04205552
C    0.38334610   -1.66708143   -0.17944207    0.01912746   -0.05795813   -0.03251947
C    1.62601163    1.25800625    0.14479420   -0.05529110   -0.02218017   -0.00123933
C    1.69198842   -1.30159051   -0.13870920   -0.05001762   -0.04509451   -0.02597201
H   -0.18609531    2.56486608   -0.29061386   -0.02853564   -0.01567978    0.00835120
H   -0.04278728   -2.63359804   -0.20242472   -0.00676549    0.02750425    0.00742955
H    2.16732491    2.15625526    0.49804936   -0.00544343    0.00858300    0.00782829
H    2.54101196   -1.98212749   -0.05258064    0.01220500    0.01688329    0.01345832
C    2.33903555    0.06797504    0.15004560    0.05872282    0.02812542    0.00977432
H    3.38890073    0.06425506    0.44548732    0.00510544    0.00081305    0.00064124
   15
   -420.48603641
H   -2.62158525    0.47004493    0.08245424   -0.00117163    0.00428840    0.00035527
O   -2.04274923    1.26304922    0.01146885   -0.04975598    0.00543525   -0.00300206
O   -1.93156967   -1.27530837    0.05005109   -0.02556015   -0.01557920   -0.02284758
C   -0.72146931    0.75169344    0.03970518    0.04487472    0.01400202    0.01876018
C   -0.77133477   -0.76205320    0.15164525    0.01293984    0.01461214    0.05876425
C    0.33972104    1.58358664   -0.28729923    0.07487818    0.01479738   -0.04264202
C    0.37979763   -1.66110109   -0.20067337    0.01295783   -0.03928407   -0.03446421
C    1.62986165    1.25088098    0.14480918   -0.04246514   -0.05547223    0.00016533
C    1.69460630   -1.30616076   -0.12435087   -0.02627855   -0.06556617   -0.02083217
H   -0.15677970    2.57448128   -0.24749842   -0.02912664   -0.00341238    0.01177708
H   -0.02750934   -2.65073699   -0.22898008   -0.00914679    0.01659626    0.00684573
H    2.13592819    2.22353483    0.47211452   -0.00134460    0.02932375    0.01030880
H    2.52104887   -1.96071140   -0.01571561   -0.00511161    0.03124982    0.01207015
C    2.32956322    0.08522474    0.14172801    0.04082084    0.04823392    0.00313079
H    3.37127721    0.07388389    0.46200259    0.00350623    0.00077100    0.00159586
   15
   -420.48548670
H   -2.65794808    0.46893779    0.07224977   -0.02021650   -0.01125538    0.00114708
O   -2.03372322    1.26595916    0.00519392   -0.03182391    0.01977025   -0.00639480
O   -1.93675678   -1.26405465    0.05696786   -0.03572503   -0.01263864   -0.02183041
C   -0.71976818    0.75655692    0.05015243    0.06094136    0.03691335    0.01656461
C   -0.75553272   -0.77633404    0.14739618    0.03601821    0.00036948    0.05654070
C    0.32545671    1.55276398   -0.28261631    0.04507847   -0.01843293   -0.04223279
C    0.37548213   -1.65278117   -0.21983012    0.00352902   -0.01342881   -0.03447348
C    1.63622331    1.24706165    0.14479033   -0.01849177   -0.07903998    0.00627795
C    1.69883056   -1.30681307   -0.10873833   -0.00582489   -0.07654943   -0.01452828
H   -0.10678958    2.58661852   -0.21286650   -0.02479285    0.00785374    0.01524225
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   15
   -420.48461100
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O   -1.94033689   -1.25223475    0.06487105   -0.04210966   -0.00784187   -0.01975186
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   15
   -420.48474738
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O   -1.94202312   -1.24006512    0.07366711   -0.04400667   -0.00144727   -0.01680215
C   -0.72829872    0.75830649    0.06825289    0.08476041    0.07565313    0.01024312
C   -0.73170909   -0.80406630    0.12900638    0.07459560   -0.02853408    0.04339243
C    0.29128672    1.49634521   -0.26576845   -0.03700598   -0.07583455   -0.03552468
C    0.36714744   -1.63504750   -0.25200422   -0.02854049    0.02496955   -0.03049900
C    1.65056109    1.25400101    0.14305602    0.03622848   -0.07338346    0.02472124
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   15
   -420.48395992
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O   -2.00003737    1.26901466   -0.01157030   -0.01023423    0.00702675   -0.00955366
O   -1.94173244   -1.22783492    0.08322328   -0.04060919    0.00637187   -0.01324300
C   -0.73990796    0.75288886    0.07627102    0.08012691    0.08379385    0.00951886
C   -0.72599739   -0.81578266    0.11565191    0.08546888   -0.04059943    0.03423142
C    0.27625351    1.47417040   -0.25399891   -0.07116324   -0.09012421   -0.03120387
C    0.36504048   -1.62791462   -0.26525280   -0.04593183    0.02899665   -0.02836857
C    1.65527406    1.26436042    0.14024004    0.05767194   -0.03367956    0.03392448
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H    2.49250969   -2.08436197    0.05185508    0.01731986   -0.01287909    0.01097201
C    2.27954050    0.11382015    0.11101114   -0.02806250    0.09134700   -0.02575850
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   15
   -420.48104215
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C   -0.75627168    0.74246131    0.08369551    0.05751834    0.08053075    0.01229130
C   -0.72540827   -0.82506101    0.10022721    0.08703204   -0.04918969    0.02504543
C    0.26544536    1.45737652   -0.24033425   -0.08987511   -0.09079207   -0.02840822
C    0.36568892   -1.62247362   -0.27677833   -0.05883684    0.02075975   -0.02769902
C    1.65653965    1.27668741    0.13539080    0.07060366    0.01848290    0.03937107
C    1.71764438   -1.27048775   -0.04068039    0.00383473   -0.01055262    0.00885030
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H    0.16163963   -2.70412235   -0.41304975    0.00182724   -0.01450981    0.00008571
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C    2.26923591    0.10755785    0.10615496   -0.03313478    0.07519991   -0.03193813
H    3.27699903    0.11018916    0.50957288   -0.00850811    0.00302564    0.00722204
   15
   -420.48070841
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O   -1.97474926    1.26912105   -0.02066213   -0.00986175   -0.02767079   -0.00763270
O   -1.93612897   -1.20467768    0.10396160   -0.01470732    0.02629044   -0.00561369
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C   -0.73002551   -0.83138701    0.08328219    0.07719121   -0.05331672    0.01693325
C    0.25998211    1.44601784   -0.22494293   -0.09076373   -0.08065738   -0.02723947
C    0.36985405   -1.61823425   -0.28661763   -0.06345764    0.00207524   -0.02915839
C    1.65362284    1.28800635    0.12819934    0.06610884    0.04984030    0.03733479
C    1.72218400   -1.25675027   -0.02401659    0.01435299    0.00437003    0.01661329
H    0.24554393    2.52589452   -0.22752224    0.03501251   -0.01012901    0.01557814
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C    2.26092305    0.09678431    0.10322495   -0.03570966    0.05162212   -0.03701941
H    3.26926821    0.11277559    0.50636998   -0.00929063    0.00358153    0.00801422
   15
   -420.48574066
H   -2.59590428    0.55684772    0.01534226    0.02306046    0.02534693   -0.00334493
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O   -1.93199263   -1.19465342    0.11480055    0.00800588    0.03810374   -0.00234707
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C   -0.73925298   -0.83451156    0.06530479    0.05585189   -0.05287787    0.01045374
C    0.25993434    1.43952186   -0.20790424   -0.07699438   -0.06748080   -0.02604711
C    0.37780350   -1.61410805   -0.29468699   -0.05748487   -0.01877816   -0.03179013
C    1.64682335    1.29649028    0.11878257    0.03959727    0.04771178    0.02897339
C    1.72584004   -1.24324869   -0.00835528    0.02800571    0.01358390    0.02392505
H    0.27472398    2.50833393   -0.26819353    0.04050927   -0.01735103    0.01284111
H    0.25352751   -2.64897833   -0.49377881    0.01277978    0.01713857    0.00295892
H    2.14782483    2.22416032    0.21714694   -0.01999612   -0.01059645   -0.00397083
H    2.40199794   -2.15044359    0.02690988    0.00635508   -0.02831599    0.00286929
C    2.25476657    0.08290512    0.10252640   -0.03756513    0.02464023   -0.04061770
H    3.26812882    0.11279662    0.49740525   -0.00844414    0.00390720    0.00863841
   15
   -420.48853634
H   -2.60232457    0.53171204    0.01272331    0.00669929    0.00399875   -0.00176847
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O   -1.92823510   -1.18635953    0.12574933    0.03473895    0.05030840    0.00008151
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C   -0.75181532   -0.83445724    0.04668690    0.02606556   -0.04861305    0.00561639
C    0.26449689    1.43713299   -0.18930265   -0.05383810   -0.05918096   -0.02240332
C    0.38917738   -1.60889980   -0.30084314   -0.04119454   -0.02932747   -0.03256041
C    1.63768259    1.30213597    0.10762056    0.00233497    0.03524717    0.01900336
C    1.72779410   -1.23053256    0.00586691    0.04319674    0.01574659    0.02967808
H    0.27502362    2.50268500   -0.31803169    0.04114162   -0.01506829    0.00873695
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H    2.35466231   -2.13120338    0.01128702   -0.00994495   -0.01417818   -0.00030052
C    2.25088009    0.06754133    0.10427558   -0.03901460   -0.00347672   -0.04245818
H    3.27299802    0.11001601    0.48224269   -0.00640814    0.00401482    0.00887814
   15
   -420.48463340
H   -2.61371591    0.50344304    0.01138989   -0.00790505   -0.01393667   -0.00036306
O   -1.93842387    1.27557778   -0.03161617    0.07451979    0.01660364   -0.00873372
O   -1.92605084   -1.18034390    0.13670010    0.06054338    0.06144191    0.00140861
C   -0.83083636    0.66253745    0.10218497   -0.10506959   -0.00303238    0.03598226
C   -0.76594229   -0.83147846    0.02772315   -0.00599925   -0.04117677    0.00200298
C    0.27228831    1.43835964   -0.16936792   -0.02509600   -0.05780410   -0.01454781
C    0.40300586   -1.60199801   -0.30505386   -0.01757842   -0.02455321   -0.02879312
C    1.62838966    1.30561462    0.09530383   -0.03319641    0.02891641    0.00998065
C    1.72714585   -1.21874213    0.01830724    0.05608500    0.01305576    0.03284638
H    0.24599652    2.50732566   -0.37400933    0.03682687   -0.00367017    0.00215884
H    0.31131974   -2.63252125   -0.58151770    0.01347270    0.01038240   -0.00015763
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H    2.31459524   -2.10214916   -0.00419596   -0.02773562    0.00611225   -0.00224727
C    2.24934841    0.05238370    0.10858249   -0.03949122   -0.03075178   -0.04229887
H    3.28245940    0.10435532    0.46072513   -0.00400191    0.00392437    0.00848528
   15
   -420.47861979
H   -2.61990925    0.48467617    0.01034766   -0.01450053   -0.02317546    0.00055364
O   -1.93133496    1.27735588   -0.03451374    0.08347635    0.02808934   -0.00958102
O   -1.92658479   -1.17710557    0.14758916    0.07864617    0.06964329    0.00223825
C   -0.83937884    0.63933744    0.10220506   -0.12319316   -0.02985989    0.03901253
C   -0.77973482   -0.82602615    0.00863680   -0.03253191   -0.03032622   -0.00124769
C    0.28158288    1.44309479   -0.14857219    0.00646113   -0.05885374   -0.00307175
C    0.41788143   -1.59365383   -0.30754342    0.00926647   -0.01127796   -0.02109777
C    1.62106996    1.30731158    0.08237570   -0.06187195    0.02915161    0.00251634
C    1.72315851   -1.20776708    0.02877498    0.05838942    0.01558999    0.03332542
H    0.19073536    2.51442690   -0.43140058    0.02777580    0.01076646   -0.00674119
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H    2.29407774   -2.07712824   -0.01813976   -0.03833318    0.02016777   -0.00294936
C    2.25019569    0.03906898    0.11543723   -0.03811389   -0.05460963   -0.04006420
H    3.29483410    0.09588529    0.43314345   -0.00205817    0.00358471    0.00732207
   15
   -420.47725933
H   -2.61611270    0.48215973    0.00893193   -0.01337967   -0.02500687    0.00101960
O   -1.92797962    1.27787929   -0.03697644    0.07801103    0.03410678   -0.01045173
O   -1.93063552   -1.17700813    0.15837477    0.08317970    0.07282062    0.00357975
C   -0.84054138    0.61794529    0.09987504   -0.12724585   -0.05700497    0.04016613
C   -0.79162122   -0.81876031   -0.01037001   -0.04703525   -0.01539423   -0.00525480
C    0.29049376    1.45137174   -0.12759579    0.03647763   -0.05649745    0.00934684
C    0.43219868   -1.58462507   -0.30876385    0.03572777    0.00179363   -0.01202547
C    1.61743966    1.30722353    0.06928567   -0.07984650    0.03398389   -0.00303131
C    1.71573266   -1.19780943    0.03723436    0.04279074    0.03197718    0.03232409
H    0.11568341    2.51399922   -0.48391303    0.01524495    0.02155066   -0.01608966
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H    2.38034841    2.19661744    0.11604473    0.03711230    0.02885777    0.00594629
H    2.30025146   -2.06549587   -0.02995570   -0.03416841    0.01627036   -0.00368866
C    2.25333482    0.02902428    0.12470540   -0.03411372   -0.07192439   -0.03591578
H    3.30874547    0.08485008    0.40033062   -0.00098643    0.00295318    0.00545944
   15
   -420.48113983
H   -2.60310960    0.49722412    0.00681211   -0.00497402   -0.01956310    0.00095636
O   -1.92812027    1.27687926   -0.03896635    0.06079235    0.03353454   -0.01093361
O   -1.93840209   -1.18019159    0.16899197    0.07240702    0.06988710    0.00650459
C   -0.83406757    0.59999088    0.09512599   -0.11939414   -0.08210250    0.03927068
C   -0.80073594   -0.81058236   -0.02905040   -0.04720569    0.00320896   -0.01095127
C    0.29723687    1.46303207   -0.10717404    0.05891513   -0.04752334    0.01970800
C    0.44437119   -1.57568140   -0.30925292    0.05901186    0.01031345   -0.00377612
C    1.61855224    1.30505219    0.05636804   -0.08053390    0.04449856   -0.00647145
C    1.70579308   -1.18981463    0.04374321    0.01274469    0.05377592    0.03037239
H    0.02972949    2.49850263   -0.52495319    0.00155314    0.02490818   -0.02353682
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H    2.33031037   -2.06480825   -0.03907208   -0.01823107   -0.00013266   -0.00506550
C    2.25852252    0.02328143    0.13613836   -0.02719485   -0.07967433   -0.03026028
H    3.32340934    0.07171228    0.36361197   -0.00065903    0.00196155    0.00316943
   15
   -420.48444367
H   -2.58695469    0.52582561    0.00404570    0.01050284   -0.00512975    0.00019143
O   -1.93098082    1.27439385   -0.04046362    0.03344889    0.02347299   -0.01051166
O   -1.94940885   -1.18652449    0.17930650    0.04973982    0.06127809    0.01141360
C   -0.82042171    0.58697355    0.08801268   -0.10171439   -0.10148221    0.03623635
C   -0.80705408   -0.80260444   -0.04705883   -0.03584052    0.02291480   -0.01855688
C    0.30048145    1.47753081   -0.08792396    0.06861463   -0.03148700    0.02609512
C    0.45300228   -1.56732991   -0.30950119    0.07679941    0.01249606    0.00195506
C    1.62441631    1.30015137    0.04383456   -0.05808804    0.06214576   -0.00852757
C    1.69509991   -1.18501907    0.04842353   -0.02088205    0.06565443    0.02678903
H   -0.05741918    2.46556960   -0.54926408   -0.01083825    0.01991059   -0.02728524
H    0.32829090   -2.60303696   -0.72098991    0.00385576   -0.01772387   -0.01432194
H    2.36961815    2.06700866    0.04361689    0.00303979   -0.02126393    0.00535282
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C    2.26534378    0.02230191    0.14939653   -0.01805477   -0.07646645   -0.02358757
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   15
   -420.48336532
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O   -1.96265192   -1.19562314    0.18909768    0.02155698    0.04877786    0.01778143
C   -0.80066659    0.58004411    0.07871754   -0.07554995   -0.11096579    0.03128977
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H    2.41684058   -2.05327848   -0.04572659    0.01369748   -0.02111259   -0.00602557
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   15
   -420.48373275
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O   -1.97687508   -1.20692927    0.19808033   -0.00623667    0.03472328    0.02460573
C   -0.77637791    0.57975935    0.06753675   -0.04230857   -0.10729258    0.02500413
C   -0.81428139   -0.79174378   -0.07915194   -0.00139933    0.04906537   -0.03688949
C    0.29503982    1.51084124   -0.05418477    0.04501827    0.01559256    0.02458884
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C    1.67908002   -1.18693430    0.05326181   -0.06538228    0.04752959    0.01562347
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H    3.36914638    0.02814349    0.24634855    0.00217740   -0.00298181   -0.00331189
   15
   -420.48716924
H   -2.62286133    0.58412337   -0.00158181    0.01530782    0.01599813   -0.00183378
O   -1.94349542    1.26327788   -0.04236016   -0.01703741    0.00450223   -0.00673870
O   -1.99083034   -1.21981251    0.20594832   -0.03012627    0.02114992    0.03092422
C   -0.74955347    0.58589380    0.05484655   -0.00448227   -0.08985887    0.01816157
C   -0.81722891   -0.79041262   -0.09213721    0.01290128    0.04967341   -0.04576119
C    0.28775956    1.52684398   -0.03961296    0.01603441    0.03876537    0.01855884
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C    1.65538838    1.26167266    0.00977442   -0.00818808    0.01021552   -0.00828862
C    1.67639536   -1.19258981    0.05408397   -0.06625273    0.02519467    0.01020490
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C    2.29027405    0.04329213    0.19598685    0.00154062   -0.01908669   -0.00235819
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   15
   -420.48449256
H   -2.66661812    0.57768733   -0.00096777   -0.01161629   -0.00064336   -0.00106543
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O   -2.00343852   -1.23366070    0.21241791   -0.04879152    0.00920992    0.03602166
C   -0.72246501    0.59740782    0.04105602    0.03481583   -0.06156571    0.01169578
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C    0.27952683    1.54055750   -0.02617325   -0.01620543    0.05090176    0.01449633
C    0.43825751   -1.53722909   -0.31154803    0.06286765   -0.00304247   -0.00138610
C    1.66684862    1.24440219   -0.00041579   -0.01449667   -0.04749263   -0.00109295
C    1.67762936   -1.19974689    0.05428323   -0.04974400   -0.00151747    0.00592241
H   -0.28739990    2.30710327   -0.47798717   -0.01718556   -0.04926413   -0.00297384
H    0.28492196   -2.48234540   -0.74437561    0.00394746    0.03091135    0.00273918
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C    2.29876758    0.05443871    0.21236610    0.00115403    0.00606982    0.00380925
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   15
   -420.47546786
H   -2.70251031    0.57129167    0.00042914   -0.03079761   -0.01086546   -0.00051778
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O   -2.01385313   -1.24793486    0.21725910   -0.06205611   -0.00055550    0.03952835
C   -0.69747517    0.61261835    0.02655203    0.07273110   -0.02792206    0.00642276
C   -0.82603837   -0.79620503   -0.10937485    0.03018014    0.02968814   -0.05864747
C    0.27224187    1.55128979   -0.01364518   -0.04238088    0.04414510    0.01703738
C    0.42332047   -1.52922804   -0.31201338    0.04185523    0.01707369    0.00344120
C    1.67912308    1.22992657   -0.01053490   -0.00915070   -0.09056600    0.00524434
C    1.68180457   -1.20681143    0.05411697   -0.02035219   -0.02805183    0.00312265
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H    0.26667018   -2.49391324   -0.75005384    0.00113463    0.01713469   -0.00339749
H    2.41803992    2.11252176   -0.20629713    0.03012273    0.02552843   -0.00841335
H    2.47231107   -1.90954019   -0.01988912   -0.00350743    0.02910512    0.00337571
C    2.30719893    0.06523047    0.22851897   -0.00072334    0.02874891    0.00919698
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   15
   -420.46802322
H   -2.71704877    0.57213603    0.00222867   -0.03630792   -0.01131402   -0.00045120
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O   -2.02147182   -1.26219191    0.22031347   -0.07002662   -0.00815768    0.04124676
C   -0.67686262    0.62952284    0.01165219    0.10630702    0.00467813    0.00259311
C   -0.83294867   -0.80215324   -0.11285539    0.03374324    0.01557617   -0.06115599
C    0.26747094    1.55943950   -0.00217407   -0.05908863    0.02049603    0.02464965
C    0.40586702   -1.52227141   -0.31268599    0.01792468    0.03973050    0.00817701
C    1.69191588    1.22083158   -0.02095492    0.00331800   -0.11433641    0.00836370
C    1.68721758   -1.21222834    0.05375201    0.00750317   -0.04476851    0.00229350
H   -0.31766091    2.37463813   -0.39990917   -0.02706180   -0.03368036   -0.00944910
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C    2.31566730    0.07431357    0.24411794   -0.00128706    0.04543383    0.01413896
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   15
   -420.46782147
H   -2.70631555    0.58052862    0.00438596   -0.02712700   -0.00166883   -0.00096363
O   -1.95557637    1.24218538   -0.04088775   -0.00665601    0.00415391   -0.00004727
O   -2.02593306   -1.27608645    0.22150341   -0.07266979   -0.01371504    0.04108293
C   -0.66263819    0.64618068   -0.00340939    0.13159168    0.03007392   -0.00026711
C   -0.84188164   -0.80904961   -0.11265397    0.03364602    0.00262418   -0.06034389
C    0.26623988    1.56637398    0.00781080   -0.06888578   -0.00799634    0.03151788
C    0.38732922   -1.51768140   -0.31383493   -0.00594109    0.05545464    0.00941518
C    1.70449711    1.21854799   -0.03185843    0.01824227   -0.11725766    0.00696393
C    1.69226328   -1.21503282    0.05323730    0.01915061   -0.04325691    0.00361090
H   -0.30622496    2.44947878   -0.35275252   -0.03444853   -0.01068776   -0.01585298
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H    2.38472871    2.14073102   -0.29274195    0.02394951    0.03319561   -0.01364423
H    2.47979304   -1.90595342   -0.01224260   -0.00764613    0.03546372    0.00493943
C    2.32419639    0.08069332    0.25886012    0.00147862    0.05331317    0.01940779
H    3.40144827    0.01189986    0.11554825   -0.00095475   -0.00640122   -0.01082427
   15
   -420.47273648
H   -2.67685524    0.58953902    0.00727939   -0.00494621    0.01734752   -0.00217022
O   -1.95850578    1.23545188   -0.04027296   -0.02946361   -0.01883810    0.00257872
O   -2.02711807   -1.28936628    0.22083647   -0.06969031   -0.01724127    0.03900227
C   -0.65630718    0.66108073   -0.01845531    0.14392667    0.04342135   -0.00302241
C   -0.85282567   -0.81611803   -0.10882046    0.02874335   -0.00774647   -0.05604943
C    0.26914623    1.57375005    0.01591159   -0.07275534   -0.02841586    0.03419744
C    0.36913496   -1.51639030   -0.31553167   -0.02670363    0.06031248    0.00637016
C    1.71596299    1.22323659   -0.04315204    0.03573739   -0.09626344   -0.00070119
C    1.69622280   -1.21529307    0.05249787    0.01690997   -0.02779420    0.00618140
H   -0.27030517    2.53211709   -0.29443437   -0.03660115    0.01086264   -0.01818609
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H    2.34033137    2.11945407   -0.32199107    0.00759923    0.01801161   -0.01074975
H    2.49270389   -1.94304929   -0.01368327    0.00921209    0.01715213    0.00315163
C    2.33261921    0.08389799    0.27242281    0.00746464    0.05152871    0.02576921
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   15
   -420.47700281
H   -2.64388042    0.58603901    0.01174752    0.01723974    0.03580872   -0.00352560
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O   -2.02516383   -1.30187265    0.21840709   -0.06062194   -0.01849718    0.03499733
C   -0.65859922    0.67342410   -0.03331467    0.14012467    0.04312073   -0.00650860
C   -0.86547649   -0.82273222   -0.10161436    0.01752481   -0.01532562   -0.04831467
C    0.27641601    1.58276858    0.02196380   -0.06938173   -0.03391815    0.03298803
C    0.35252992   -1.51868676   -0.31759369   -0.04236529    0.05321073   -0.00064004
C    1.72524308    1.23361917   -0.05436331    0.05763810   -0.05047298   -0.01604852
C    1.69916595   -1.21388206    0.05138477    0.01288875   -0.01002555    0.00877347
H   -0.20838938    2.60731669   -0.22330168   -0.03272719    0.02608964   -0.01590348
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H    2.49913055   -1.99243147   -0.01737077    0.02398709   -0.00267315    0.00095500
C    2.34058662    0.08402624    0.28442053    0.01423109    0.04195592    0.03335462
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   15
   -420.48110425
H   -2.62195431    0.55803718    0.01866699    0.01805684    0.03383456   -0.00347586
O   -1.95957479    1.22544270   -0.03948983   -0.04378259   -0.04115335    0.00527235
O   -2.02048311   -1.31354890    0.21439654   -0.04514887   -0.01734601    0.02918893
C   -0.66928613    0.68321432   -0.04777481    0.12055439    0.03202618   -0.01109638
C   -0.87915018   -0.82843156   -0.09150246   -0.00101970   -0.02055470   -0.03735954
C    0.28784604    1.59376313    0.02603210   -0.05901559   -0.02445390    0.02949498
C    0.33845733   -1.52414300   -0.31960126   -0.05210125    0.03463916   -0.01071267
C    1.73105100    1.24700917   -0.06458313    0.07580504    0.00275352   -0.03445554
C    1.70130640   -1.21183940    0.04974411    0.01320930    0.00294797    0.01076488
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H    2.48880960   -2.04023770   -0.02176719    0.03024384   -0.01690965   -0.00093743
C    2.34770397    0.08163544    0.29439772    0.01898794    0.02868841    0.04144973
H    3.41594185    0.05371666    0.12126300   -0.00626831    0.00034973   -0.01081973
   15
   -420.48954603
H   -2.61185915    0.50700513    0.02797111    0.00032352    0.01079733   -0.00157438
O   -1.95714674    1.22309697   -0.03943533   -0.01535904   -0.02060670    0.00331879
O   -2.01377615   -1.32444636    0.20906703   -0.02381074   -0.01405508    0.02195008
C   -0.68720449    0.69109198   -0.06155965    0.08907277    0.01605053   -0.01651501
C   -0.89272851   -0.83289538   -0.07914422   -0.02618780   -0.02424036   -0.02380958
C    0.30282220    1.60618221    0.02832011   -0.04405404   -0.00413207    0.02522429
C    0.32750627   -1.53165785   -0.32095671   -0.05594455    0.00922337   -0.02153165
C    1.73240589    1.26040052   -0.07278179    0.06889452    0.02460535   -0.04093351
C    1.70262467   -1.20994027    0.04745672    0.01816711    0.00899720    0.01190251
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H    2.24877825    2.07113161   -0.39110008   -0.04612272   -0.04848850    0.00917123
H    2.45723429   -2.07633181   -0.02551834    0.02772050   -0.02338066   -0.00232747
C    2.35368841    0.07750630    0.30187249    0.02080640    0.01593223    0.04869341
H    3.42969580    0.06954164    0.13880482   -0.00208242    0.00277442   -0.01075857
   15
   -420.49678276
H   -2.60224906    0.44818546    0.03839605   -0.01420552   -0.01281716    0.00061237
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O   -2.00600239   -1.33471079    0.20274408    0.00102136   -0.00953716    0.01407759
C   -0.71047383    0.69799229   -0.07434496    0.05028183    0.00130972   -0.02207113
C   -0.90470585   -0.83589752   -0.06535285   -0.05466243   -0.02702665   -0.00892834
C    0.32045121    1.61882713    0.02907961   -0.02668253    0.02092602    0.02153840
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C    1.72973464    1.27249249   -0.07858887    0.03534234    0.01124919   -0.03172448
C    1.70282564   -1.20854605    0.04445467    0.02685912    0.00717287    0.01199197
H    0.08923943    2.71001004    0.04073617    0.00261992    0.01995591    0.00349809
H    0.17703416   -2.54802396   -0.59597582    0.00136923    0.02610273    0.00396555
H    2.27430571    2.11221963   -0.42336508   -0.02455270   -0.01522236   -0.00497963
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C    2.35842253    0.07240050    0.30641136    0.02106477    0.00569201    0.05417664
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   15
   -420.49346549
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   15
   -420.48084820
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O   -1.99163345   -1.35412425    0.18850328    0.04130806   -0.00315976    0.00120747
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   15
   -420.46675680
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   15
   -420.45818947
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O   -1.98406960   -1.37274353    0.17390194    0.03880227   -0.01045115   -0.00291408
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C    1.68127931   -1.19992443    0.02613236    0.04015459   -0.02123993    0.00501925
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   15
   -420.45678648
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O   -1.98303987   -1.38145162    0.16676847    0.02233343   -0.01925709   -0.00252371
C   -0.82005694    0.73595292   -0.11361599   -0.13881130    0.00793138   -0.03348081
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   15
   -420.45999107
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C    1.73399854    1.33271546   -0.08824161   -0.05077204    0.08241449   -0.02420361
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C    2.35503876    0.04661575    0.26195539    0.03784039   -0.01562260    0.04735995
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   15
   -420.46627811
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O   -1.98307944   -1.39578064    0.15280333   -0.01737001   -0.03895533   -0.00090376
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C    0.42079453    1.64749401    0.00750447    0.07576563    0.01238832   -0.00322535
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C    1.74672849    1.33368915   -0.08632706   -0.01715261    0.10813530   -0.03041590
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C    2.34738559    0.04508924    0.24326798    0.03340464   -0.01418841    0.04023161
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   15
   -420.47788484
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O   -1.98237265   -1.40051987    0.14590081   -0.03386524   -0.04664658   -0.00039995
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C    1.76058964    1.32830793   -0.08261811   -0.00084007    0.09857069   -0.02852599
C    1.63108245   -1.18321000    0.00337942   -0.03631097    0.03423587   -0.00700902
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C    2.33773169    0.04440857    0.22215831    0.02496482   -0.01031844    0.03086676
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   15
   -420.49123149
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O   -1.98014292   -1.40315234    0.13901724   -0.04675300   -0.05175534   -0.00009404
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C    0.41600156    1.64263653   -0.00060469    0.05622355    0.02816168    0.00152961
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H    2.25138309   -2.11552852    0.07395908    0.00136407   -0.02273653    0.00098480
C    2.32658005    0.04433732    0.19919160    0.01410534   -0.00356802    0.01958607
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   15
   -420.49749736
H   -2.64116673    0.38193792    0.10667417   -0.02348454   -0.02009015    0.00636579
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O   -1.97580519   -1.40344621    0.13213812   -0.05606057   -0.05429155    0.00015541
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C   -0.80720131   -0.79885652    0.01416406    0.06444886   -0.00105996    0.03021667
C    0.40817195    1.63794950   -0.00469857    0.04182124    0.03506650    0.00434703
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C    1.78907301    1.30296299   -0.07023907   -0.01064797   -0.00344874   -0.02521613
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H    2.26991085   -2.06099518    0.09478905   -0.00275754   -0.00580400    0.00222419
C    2.31457789    0.04446870    0.17504427    0.00270972    0.00577481    0.00753972
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   15
   -420.49597593
H   -2.66920324    0.40583314    0.10457127   -0.02630293   -0.01625882    0.00563744
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O   -1.96893803   -1.40128475    0.12525181   -0.06153881   -0.05468231    0.00043895
C   -0.75214543    0.76975316   -0.09616407    0.01386427    0.02609373   -0.02250209
C   -0.79623199   -0.79330206    0.01171871    0.07690713   -0.00316556    0.02712505
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C    1.80409482    1.28891469   -0.06175342   -0.00081630   -0.04790797   -0.02719320
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C    2.30240564    0.04424338    0.15043643   -0.00750726    0.01649747   -0.00360439
H    3.30259924   -0.06086701    0.60298872    0.00267937   -0.00331929    0.01721353
   15
   -420.49098072
H   -2.67895468    0.44080865    0.09852384   -0.01819182   -0.00209146    0.00295885
O   -2.07712633    1.23254620   -0.02945115   -0.04765241   -0.00092198   -0.00135782
O   -1.95929616   -1.39664864    0.11834540   -0.06232352   -0.05330396    0.00076634
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C   -0.78987681   -0.78756110    0.00763588    0.08193670   -0.00430281    0.02343419
C    0.38582865    1.62257887   -0.01360600    0.01305270    0.01656418    0.00094060
C    0.34359267   -1.57736259   -0.18711850    0.01155996    0.03181948   -0.00802588
C    1.81912304    1.27769889   -0.05162738    0.01773536   -0.07924441   -0.02841154
C    1.60837034   -1.18894385   -0.01386902   -0.03363265   -0.01071173   -0.00589567
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H    2.31811247   -1.95385638    0.13166535   -0.01307390    0.02809974    0.00252827
C    2.29067528    0.04302603    0.12603376   -0.01535047    0.02597157   -0.01224469
H    3.26452700   -0.08608015    0.60760447   -0.00510521   -0.00513911    0.01643289
   15
   -420.48633628
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   15
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   15
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   15
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   15
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   15
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   15
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   15
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   15
   -420.54441011
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O   -1.95606462   -1.28512634    0.02983075   -0.00443501   -0.00222389    0.00292394
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   15
   -420.54249075
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   15
   -420.54142456
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O   -1.95229428   -1.29564122    0.04913385   -0.00121101   -0.00248242    0.00453716
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   15
   -420.54137362
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O   -1.95028089   -1.30073077    0.05849421    0.00236100   -0.00217901    0.00507160
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   15
   -420.54265312
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   15
   -420.54447305
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O   -1.94678202   -1.31063476    0.07651266    0.01140264   -0.00134319    0.00550453
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C    0.30890386    1.57040249   -0.03630012   -0.00808792    0.01357163   -0.00981243
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   15
   -420.54521344
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C    1.69650097    1.27964208    0.02820768    0.00061846   -0.00632702    0.00372975
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C    2.30476257    0.04776921    0.05734564   -0.00485559   -0.00110525    0.00476128
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   15
   -420.54442541
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O   -1.94532809   -1.32027247    0.09353986    0.01879974   -0.00199984    0.00543154
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H    2.33576109   -2.07094648   -0.00244515    0.00228521   -0.00963680   -0.00032657
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   15
   -420.54315105
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H    2.32939765   -2.08169144   -0.00064592    0.00196461   -0.01308893   -0.00013285
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   15
   -420.54233000
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C    0.33344537    1.56261743   -0.04200000    0.04004355    0.00911887   -0.00460999
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C    1.69558063    1.28205265    0.03356793   -0.00472413   -0.01408009    0.00138257
C    1.65918550   -1.19999742   -0.02067117   -0.02215596    0.01137732   -0.00176954
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H    2.32179891   -2.08330632    0.00125076   -0.00133448   -0.01159268    0.00002562
C    2.30194473    0.07090438    0.07212081   -0.01436521    0.03628633    0.00419492
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   15
   -420.54181675
H   -2.62930130    0.55092008    0.06452182   -0.00383294   -0.00017414    0.00137648
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O   -1.94945877   -1.33373353    0.11721423    0.01709086   -0.00962421    0.00604074
C   -0.77430907    0.68964727   -0.04057469   -0.03512120   -0.00801855    0.00513650
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C    0.33483180    1.55924372   -0.04244951    0.03963444    0.01053317   -0.00231648
C    0.35970966   -1.58839786   -0.10847638    0.01865662   -0.01165673   -0.00146706
C    1.69560370    1.28426918    0.03511667   -0.00910049   -0.01766614    0.00026491
C    1.66268604   -1.20157836   -0.02212704   -0.01247945    0.00451804   -0.00157686
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H    0.15577617   -2.65776323   -0.11023972    0.00138405   -0.00126523    0.00198970
H    2.34415420    2.15515459    0.08058211   -0.00048788   -0.00195774   -0.00044729
H    2.31528944   -2.07682601    0.00313237   -0.00672265   -0.00590300    0.00012757
C    2.30278007    0.07507947    0.07652693   -0.00623033    0.03994360    0.00436459
H    3.38328970   -0.02503970    0.15311544   -0.00047058   -0.00940843   -0.00057292
   15
   -420.54127780
H   -2.63447803    0.55724625    0.06449111   -0.00591519   -0.00051452    0.00146320
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O   -1.95250014   -1.33753695    0.12457707    0.01261864   -0.01354643    0.00664725
C   -0.77562637    0.69586538   -0.04706832   -0.03680786    0.00273683    0.00313409
C   -0.85584349   -0.77264502   -0.04725208   -0.02955475    0.02731357   -0.01109966
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   15
   -420.54122128
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   15
   -420.54207232
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   15
   -420.54286931
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   15
   -420.54251746
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   15
   -420.54133351
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C    1.68416875   -1.21057698   -0.02970471    0.00040486    0.01375526    0.00029720
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   15
   -420.54059610
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   15
   -420.54073271
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   15
   -420.54096533
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   15
   -420.54083148
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   15
   -420.54089440
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C    2.31512073    0.05472417    0.11660126    0.02193572   -0.01164726    0.00072174
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   15
   -420.54145060
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C    1.70545864    1.30042127    0.06244407    0.00469600    0.00363652   -0.00267225
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H    3.37185019    0.08900751    0.30115081   -0.01098347    0.00599001    0.00055969
   15
   -420.54160353
H   -2.59195281    0.52452120    0.03293342    0.01016868   -0.00021503   -0.00160321
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O   -1.97274045   -1.31253903    0.18373912   -0.00385953    0.00029957    0.00381702
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C   -0.83586229   -0.82855906    0.00388897    0.00049462   -0.03119868    0.00632830
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   15
   -420.54077721
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   15
   -420.53985788
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   15
   -420.53991741
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   15
   -420.54082700
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   15
   -420.54149886
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   15
   -420.54164628
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O   -1.96374256   -1.28049913    0.19938211   -0.00382944    0.00814987    0.00162291
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   15
   -420.54205575
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   15
   -420.54269367
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C   -0.81618734   -0.79214277    0.02314095    0.00141415   -0.00031937    0.00792916
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   15
   -420.54257276
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   15
   -420.54153887
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C    2.30737151    0.02236587    0.16270760   -0.01275601   -0.02202669    0.00270429
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   15
   -420.54080789
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C    1.67417828    1.25764736    0.09871508    0.01123894    0.02066581    0.00604426
C    1.71301516   -1.22145798   -0.08319981   -0.00283758    0.02717992    0.00602992
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C    2.30651024    0.01761474    0.16554087   -0.01513512   -0.02833690    0.00287033
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   15
   -420.54138123
H   -2.66625225    0.52576838    0.05632219   -0.01044319    0.00259566    0.00106684
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O   -1.94623381   -1.25887441    0.21131170   -0.01491887   -0.00187884    0.00584804
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C   -0.80326248   -0.76115274    0.02017425    0.00679077    0.01667774   -0.00127231
C    0.27461436    1.54386352   -0.11429674   -0.05000645   -0.03162410   -0.01391436
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   15
   -420.54259379
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O   -1.94087203   -1.25520965    0.21251270   -0.01083916   -0.00094138    0.00585402
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C   -0.80103685   -0.75546171    0.01927318    0.00476257    0.01742047   -0.00336999
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   15
   -420.54308399
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O   -1.93502401   -1.25150550    0.21344909   -0.00527901    0.00086985    0.00559523
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C    0.28003289    1.54555941   -0.11252194   -0.03845594   -0.00897400   -0.01216418
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C    1.66234329    1.24079115    0.10243414    0.00177308   -0.00093797    0.00303849
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   15
   -420.54282631
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C    0.28645689    1.54761765   -0.11050449   -0.02441618    0.00044427   -0.01070373
C    0.37803735   -1.57277949   -0.20774891   -0.00393369   -0.00212946   -0.00262779
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   15
   -420.54261122
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C    1.65344895    1.22884294    0.10387387   -0.00613463   -0.01747785    0.00007918
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H    0.07935509    2.59928546   -0.19898184    0.00380762   -0.00836863    0.00063103
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C    2.30548905    0.01835249    0.17486371    0.02110088   -0.00445508    0.01186292
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   15
   -420.54218924
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O   -1.91725301   -1.24110047    0.21482961    0.01442754    0.00879873    0.00394167
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C   -0.79293045   -0.74238307    0.01873486   -0.00937709    0.00798696   -0.00923821
C    0.30263182    1.55161205   -0.10468577    0.01174812   -0.00035765   -0.00497673
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C    1.64944664    1.22422037    0.10454220   -0.00834000   -0.02067377   -0.00110209
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   15
   -420.54078933
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O   -1.91224147   -1.23826495    0.21489607    0.01940398    0.01100419    0.00346982
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C   -0.79003041   -0.74082025    0.01981024   -0.01132115    0.00384457   -0.01018513
C    0.31022284    1.55356629   -0.10122847    0.02844012   -0.00484383   -0.00119539
C    0.36945137   -1.56235507   -0.19800276   -0.00781816    0.00644762    0.00259267
C    1.64594520    1.22083117    0.10527592   -0.00987101   -0.02054492   -0.00203898
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C    2.29898935    0.02395731    0.17436178   -0.00417985    0.01467796    0.01001218
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   15
   -420.53900768
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O   -1.90810225   -1.23592588    0.21480436    0.02223478    0.01242929    0.00319543
C   -0.79033018    0.71999509   -0.01465527   -0.02251041   -0.02276129    0.01719555
C   -0.78645624   -0.73949034    0.02150109   -0.01116408   -0.00022083   -0.01102563
C    0.31611720    1.55580276   -0.09769677    0.04052429   -0.00730052    0.00218078
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C    1.64304272    1.21867678    0.10613240   -0.01180756   -0.01890363   -0.00287748
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H    0.05498778   -2.58616191   -0.39091962   -0.00585891    0.00039116   -0.00086742
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C    2.29568669    0.02571716    0.17316585   -0.01393766    0.02218366    0.00897091
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   15
   -420.53833072
H   -2.52723903    0.34840015    0.04444551    0.00869087   -0.01138494    0.00212914
O   -2.02461165    1.22260167   -0.09630337   -0.00409670    0.01772859   -0.00770645
O   -1.90496195   -1.23414737    0.21456674    0.02243836    0.01290349    0.00315770
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C   -0.78221949   -0.73814990    0.02385828   -0.00851971   -0.00372990   -0.01174974
C    0.31959311    1.55846324   -0.09429151    0.04617318   -0.00631866    0.00447085
C    0.36599639   -1.55701567   -0.19209718   -0.01050725    0.00728754    0.00428743
C    1.64086243    1.21767042    0.10716364   -0.01530434   -0.01810725   -0.00385198
C    1.71442943   -1.25274665   -0.13226252   -0.00702262   -0.00253079   -0.00971559
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H    2.45183144   -2.07441860   -0.25429288    0.01290431   -0.00755672   -0.00076517
C    2.29319122    0.02614913    0.17142441   -0.01665206    0.02697559    0.00852660
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   15
   -420.53918155
H   -2.53630422    0.34725694    0.03740254    0.00645522   -0.01034256    0.00176423
O   -2.02968776    1.21787691   -0.09851129   -0.00898696    0.01544818   -0.00696086
O   -1.90282976   -1.23295077    0.21418514    0.01999376    0.01242509    0.00329795
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C   -0.77747910   -0.73658905    0.02692498   -0.00356292   -0.00622145   -0.01225351
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C    0.36517812   -1.55500416   -0.18951105   -0.01200128    0.00677897    0.00464386
C    1.63961630    1.21776795    0.10842891   -0.02042541   -0.01893222   -0.00502337
C    1.71576938   -1.25383739   -0.13515175   -0.00066472   -0.00151360   -0.00939460
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H    2.42950907   -2.08969717   -0.26210316    0.00878346   -0.00786724   -0.00099574
C    2.29166476    0.02496673    0.16916357   -0.01184021    0.02837508    0.00882544
H    3.38017543    0.05394121    0.33898903    0.00965063    0.00097351    0.00191282
   15
   -420.54027102
H   -2.55004134    0.35343285    0.02910787    0.00443164   -0.00712948    0.00106698
O   -2.03435628    1.21246522   -0.10040582   -0.01378076    0.00964439   -0.00557516
O   -1.90159663   -1.23231486    0.21365361    0.01539786    0.01111532    0.00351517
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C   -0.77253121   -0.73465886    0.03073082    0.00297047   -0.00733930   -0.01237074
C    0.31836371    1.56463312   -0.08832265    0.03663845    0.00343787    0.00491128
C    0.36508287   -1.55340299   -0.18720468   -0.01292419    0.00634174    0.00476305
C    1.63960598    1.21901116    0.10999759   -0.02561408   -0.01984297   -0.00610620
C    1.71713458   -1.25482286   -0.13747212    0.00862430   -0.00316926   -0.00920672
H    0.06685606    2.59584608   -0.28753307   -0.00227527   -0.00753286   -0.00479455
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H    2.40105229   -2.09953863   -0.26923114    0.00152836   -0.00440233   -0.00067086
C    2.29082501    0.02208618    0.16636603   -0.00137576    0.02619884    0.00968839
H    3.36085293    0.04433429    0.34187601   -0.00179463   -0.00009706    0.00050717
   15
   -420.54050468
H   -2.56701035    0.36465742    0.02005557    0.00280747   -0.00238141    0.00017245
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O   -1.90105735   -1.23218170    0.21296298    0.00953291    0.00924551    0.00366542
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C   -0.76776514   -0.73229260    0.03528187    0.00993640   -0.00691064   -0.01189645
C    0.31422157    1.56758385   -0.08579102    0.02415319    0.00598698    0.00410215
C    0.36576314   -1.55218779   -0.18518564   -0.01261820    0.00633900    0.00469337
C    1.64113366    1.22144329    0.11193291   -0.02863281   -0.01856379   -0.00664911
C    1.71797736   -1.25561151   -0.13923586    0.01804416   -0.00575641   -0.00896475
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H    2.37155296   -2.10632075   -0.27589508   -0.00664755    0.00082268   -0.00005115
C    2.29006564    0.01763765    0.16298337    0.00950455    0.02074043    0.01035888
H    3.34284534    0.03477930    0.34440849   -0.01345499   -0.00084848   -0.00103877
   15
   -420.54046376
H   -2.58600913    0.37759125    0.01087635    0.00117790    0.00249199   -0.00068176
O   -2.04163089    1.20073240   -0.10352071   -0.02109346   -0.00768656   -0.00192092
O   -1.90094985   -1.23246718    0.21210680    0.00345723    0.00709344    0.00363290
C   -0.76882223    0.73890665   -0.02198641    0.02363826    0.00494033    0.00858453
C   -0.76359616   -0.72951624    0.04054863    0.01614137   -0.00493208   -0.01066983
C    0.30862751    1.57020916   -0.08351091    0.00986966    0.00144429    0.00392521
C    0.36719830   -1.55135853   -0.18344933   -0.01065950    0.00679881    0.00438659
C    1.64437363    1.22498054    0.11426581   -0.02782638   -0.01383262   -0.00628873
C    1.71774625   -1.25606343   -0.14045985    0.02404729   -0.00607382   -0.00822949
H    0.08277441    2.59298329   -0.28849901    0.00185660   -0.01619673   -0.00340188
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   15
   -420.54085957
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O   -1.90100210   -1.23307471    0.21108681   -0.00185703    0.00499754    0.00332911
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C    1.71609154   -1.25617308   -0.14119151    0.02405193   -0.00160017   -0.00656785
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   15
   -420.54104152
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O   -1.90097583   -1.23391026    0.20991693   -0.00566031    0.00325467    0.00271574
C   -0.76560608    0.74788969   -0.02952847    0.03805927    0.01972564    0.00357782
C   -0.75842761   -0.72328728    0.05288181    0.02275916    0.00265268   -0.00577371
C    0.29648524    1.57596226   -0.07970957   -0.01649616   -0.02264930    0.00513595
C    0.37175692   -1.55097559   -0.18073176   -0.00197973    0.00796010    0.00282255
C    1.65552219    1.23402833    0.11997488   -0.01357075    0.00465537   -0.00264183
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C    2.28422789   -0.00113131    0.14943760   -0.00516101   -0.00708045    0.00252011
H    3.35083091    0.01008777    0.35601077   -0.00160440   -0.00046719    0.00245754
   15
   -420.54043040
H   -2.63995448    0.39892959   -0.01247305   -0.00878522    0.00499506   -0.00137224
O   -2.04567358    1.18628847   -0.10767132   -0.01409679   -0.02110582    0.00151435
O   -1.90070015   -1.23489575    0.20862495   -0.00750346    0.00211314    0.00179524
C   -0.76725143    0.75080427   -0.03369884    0.03823233    0.02247283    0.00146577
C   -0.75782459   -0.72028885    0.05965288    0.02242787    0.00734256   -0.00225903
C    0.29151817    1.58048631   -0.07825200   -0.02586654   -0.03045193    0.00471865
C    0.37436040   -1.55148853   -0.17965556    0.00373495    0.00799284    0.00153149
C    1.66258094    1.23843735    0.12313299   -0.00256282    0.01509672    0.00012673
C    1.70884668   -1.25664173   -0.14161363    0.00897386    0.01472325   -0.00185624
H    0.09858783    2.65074184   -0.26779285    0.00150271    0.00929410   -0.00654444
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C    2.28206008   -0.00733741    0.14431190   -0.01664074   -0.01626372   -0.00152157
H    3.36491708    0.00289333    0.35845485    0.00913968    0.00004794    0.00492238
   15
   -420.53979291
H   -2.64901748    0.39817372   -0.01830149   -0.01158446    0.00325779   -0.00125523
O   -2.04548881    1.18323054   -0.10913994   -0.00799484   -0.02155609    0.00205233
O   -1.90009217   -1.23597970    0.20725254   -0.00719650    0.00168724    0.00060024
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C   -0.75856636   -0.71773355    0.06655832    0.01977815    0.01184718    0.00172503
C    0.28809484    1.58680806   -0.07707308   -0.03115098   -0.02960779    0.00298020
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C    1.66979937    1.24194889    0.12628420    0.00750226    0.02243597    0.00274596
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H    0.10147710    2.66543796   -0.25239813    0.00186065    0.01260443   -0.00611694
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H    2.36355977    2.05077321    0.26974958   -0.00074775   -0.01082641   -0.00052557
H    2.33378178   -2.14978688   -0.30624655   -0.00280067   -0.01332421   -0.00321591
C    2.28086885   -0.01257084    0.13927134   -0.02231529   -0.02327308   -0.00421848
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   15
   -420.54010110
H   -2.64989136    0.39501660   -0.02322004   -0.01190537    0.00244989   -0.00124639
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O   -1.89916550   -1.23714292    0.20585355   -0.00481110    0.00201116   -0.00079889
C   -0.77703290    0.75269277   -0.04220217    0.02084653    0.01627497   -0.00181427
C   -0.76049465   -0.71589092    0.07335834    0.01520206    0.01558586    0.00594146
C    0.28653371    1.59487373   -0.07606889   -0.03213608   -0.01953316    0.00015953
C    0.37854947   -1.55392687   -0.17768670    0.01432395    0.00669226   -0.00156818
C    1.67658282    1.24413379    0.12927317    0.01392946    0.02384745    0.00462434
C    1.69948661   -1.26033555   -0.14152543   -0.00937206    0.01597324    0.00010003
H    0.10299783    2.67141714   -0.23266215    0.00265560    0.00995055   -0.00465572
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H    2.34300534   -2.14426314   -0.30824409   -0.00056296   -0.01323884   -0.00326789
C    2.28098941   -0.01641189    0.13447656   -0.02049197   -0.02727998   -0.00506800
H    3.37051227   -0.01181037    0.35196446    0.01304977    0.00045314    0.00611760
   15
   -420.54094052
H   -2.64235857    0.39001216   -0.02723264   -0.00948799    0.00298930   -0.00137300
O   -2.04427869    1.18007039   -0.11237744    0.00205478   -0.02275454    0.00297185
O   -1.89802736   -1.23839939    0.20449109   -0.00062950    0.00295961   -0.00230511
C   -0.78412863    0.75203349   -0.04633637    0.00546599    0.00891367   -0.00306850
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C    0.28689845    1.60408468   -0.07507186   -0.02959343   -0.00237988   -0.00314605
C    0.37950229   -1.55577701   -0.17660816    0.01775758    0.00602754   -0.00302676
C    1.68254549    1.24490879    0.13198716    0.01614859    0.01892688    0.00558907
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C    2.28231363   -0.01861912    0.12997918   -0.01163016   -0.02810935   -0.00412349
H    3.35927377   -0.01960360    0.34218619    0.00502768    0.00020672    0.00454230
   15
   -420.54091266
H   -2.62810738    0.38281276   -0.03025319   -0.00518519    0.00418470   -0.00155011
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O   -1.89686545   -1.23979189    0.20323309    0.00483228    0.00437047   -0.00379686
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C   -0.76672993   -0.71516363    0.08562743    0.00248769    0.01899680    0.01409943
C    0.28904147    1.61342841   -0.07388614   -0.02465510    0.01689247   -0.00615285
C    0.37939093   -1.55799465   -0.17534799    0.01923382    0.00594288   -0.00421781
C    1.68754401    1.24455887    0.13436612    0.01590289    0.01006210    0.00594599
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H    0.09956098    2.66794506   -0.18464889    0.00444020   -0.00633838   -0.00073903
H    0.15150654   -2.60465358   -0.34510615    0.00877836    0.00049348    0.00002719
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H    2.36315615   -2.10856485   -0.30588347   -0.00264981   -0.00126030   -0.00107563
C    2.28431974   -0.01914012    0.12572525    0.00133208   -0.02619646   -0.00202575
H    3.34464695   -0.02753126    0.32918727   -0.00673483   -0.00027268    0.00215326
   15
   -420.53989016
H   -2.61013605    0.37264443   -0.03216001   -0.00063628    0.00463941   -0.00164966
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O   -1.89592496   -1.24138332    0.20214673    0.01087977    0.00591730   -0.00514841
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C   -0.77027485   -0.71648305    0.09060529   -0.00427641    0.01824625    0.01758416
C    0.29266694    1.62177441   -0.07233368   -0.01794561    0.03148176   -0.00816937
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C    1.69158101    1.24360329    0.13638635    0.01556358    0.00058073    0.00611180
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H    0.09340033    2.66969533   -0.15911447    0.00418359   -0.01117320    0.00044095
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H    2.37545854   -2.08675427   -0.30305254   -0.00477420    0.00629091    0.00036294
C    2.28625546   -0.01808681    0.12159453    0.01219517   -0.02226237   -0.00006284
H    3.33474645   -0.03525406    0.31461556   -0.01636810   -0.00090295    0.00014051
   15
   -420.53911417
H   -2.59163383    0.35926009   -0.03289172    0.00267434    0.00311169   -0.00153337
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O   -1.89547716   -1.24324224    0.20129292    0.01666493    0.00719300   -0.00622155
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C   -0.77356497   -0.71889832    0.09452300   -0.01026389    0.01596499    0.02040615
C    0.29737068    1.62826461   -0.07029248   -0.00982756    0.03672052   -0.00913781
C    0.37575439   -1.56355547   -0.17201586    0.01570322    0.00760067   -0.00561271
C    1.69466951    1.24260230    0.13803628    0.01660670   -0.00689222    0.00638033
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H    2.39106208   -2.06927131   -0.30044403   -0.00461157    0.01056903    0.00118066
C    2.28749919   -0.01569393    0.11747478    0.01425526   -0.01695209    0.00054352
H    3.33610601   -0.04231263    0.29984957   -0.01747278   -0.00176016   -0.00036246
   15
   -420.53916948
H   -2.57495080    0.34375993   -0.03253261    0.00422497   -0.00043846   -0.00119312
O   -2.04383270    1.18579338   -0.12051019    0.01078650   -0.01137248    0.00244108
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C   -0.80623331    0.74872852   -0.06041086   -0.04601875   -0.01670115   -0.00664408
C   -0.77624234   -0.72227332    0.09721055   -0.01464850    0.01250918    0.02243168
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C    0.37244041   -1.56699394   -0.16985902    0.01112640    0.00837300   -0.00592052
C    1.69674525    1.24200034    0.13929924    0.01931576   -0.01085548    0.00685184
C    1.68865943   -1.27455057   -0.13991440   -0.01712974   -0.02485747   -0.00449609
H    0.07364676    2.69406283   -0.10921705   -0.00079276    0.00018229    0.00112858
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H    2.40976550   -2.05909843   -0.29862659   -0.00086622    0.00998021    0.00103652
C    2.28793206   -0.01228003    0.11332939    0.00644331   -0.01083145   -0.00022695
H    3.34946145   -0.04808674    0.28525365   -0.00910741   -0.00291070    0.00060597
   15
   -420.53921374
H   -2.56123872    0.32862847   -0.03132057    0.00457233   -0.00484125   -0.00073209
O   -2.04476562    1.18909638   -0.12287096    0.00988662   -0.00365192    0.00155867
O   -1.89704086   -1.24795609    0.20045916    0.02373731    0.00730548   -0.00717508
C   -0.80628571    0.74967599   -0.06304368   -0.04758210   -0.01787152   -0.00725030
C   -0.77804554   -0.72640140    0.09854594   -0.01668640    0.00835877    0.02356817
C    0.30802627    1.63486897   -0.06453150    0.00707529    0.02720596   -0.00987790
C    0.36846038   -1.57093422   -0.16734475    0.00520279    0.00823756   -0.00609189
C    1.69764785    1.24203515    0.14014707    0.02298482   -0.01096009    0.00746349
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H    0.06355862    2.70893254   -0.08541057   -0.00413627    0.00949576    0.00160236
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H    2.42895022   -2.05589942   -0.29751243    0.00520547    0.00589609    0.00018970
C    2.28799591   -0.00821116    0.10919905   -0.00549472   -0.00470836   -0.00127841
H    3.36914450   -0.05175429    0.27020222    0.00312659   -0.00423093    0.00191301
   15
   -420.53914438
H   -2.55079178    0.31693460   -0.02958077    0.00445643   -0.00846445   -0.00027983
O   -2.04613734    1.19256821   -0.12530230    0.00641359    0.00326296    0.00063321
O   -1.89936755   -1.25081424    0.20052223    0.02351983    0.00565436   -0.00697345
C   -0.80348688    0.75169097   -0.06523867   -0.04386662   -0.01637317   -0.00772273
C   -0.77885391   -0.73103401    0.09846056   -0.01587452    0.00400454    0.02377280
C    0.31296911    1.63551022   -0.06076455    0.01328501    0.02175820   -0.01016717
C    0.36416972   -1.57536628   -0.16446266   -0.00151634    0.00683943   -0.00615517
C    1.69716397    1.24271891    0.14054417    0.02588792   -0.00836967    0.00793939
C    1.69149978   -1.27258161   -0.13767923   -0.01686852   -0.01436711   -0.00194585
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H    0.13844633   -2.63022663   -0.31858940    0.00737787   -0.00278768   -0.00050239
H    2.35098495    2.09138744    0.28677682   -0.00510244   -0.00246475   -0.00109891
H    2.44441728   -2.05691150   -0.29652853    0.01079786    0.00120106   -0.00077222
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   15
   -420.53972490
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O   -1.90275048   -1.25392500    0.20090013    0.02040786    0.00295265   -0.00634503
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   15
   -420.54132432
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O   -1.90704978   -1.25716703    0.20156452    0.01475365   -0.00048312   -0.00535007
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C   -0.77785608   -0.74077863    0.09403312   -0.00603799   -0.00383794    0.02148127
C    0.32027172    1.63293999   -0.05138291    0.01749354    0.02030229   -0.01004122
C    0.35627630   -1.58529893   -0.15758605   -0.01454848    0.00095037   -0.00590237
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   15
   -420.54285031
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O   -1.91201204   -1.26038621    0.20247005    0.00737821   -0.00421702   -0.00402262
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C    1.68683760    1.24731280    0.13896473    0.00990167   -0.00660085    0.00473700
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C    2.29497193    0.00841511    0.09335154   -0.00233584    0.00471314    0.00217868
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   15
   -420.54300857
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O   -1.91730663   -1.26341450    0.20355706   -0.00065099   -0.00786103   -0.00245296
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C   -0.77550989   -0.74964782    0.08446867    0.00920201   -0.00909888    0.01625378
C    0.32354030    1.62532755   -0.03960547    0.01245475    0.02357195   -0.00843334
C    0.35178267   -1.59545104   -0.14929674   -0.02171534   -0.00556604   -0.00490955
C    1.68150797    1.24957277    0.13772902   -0.00244181   -0.00789526    0.00239561
C    1.70559279   -1.26035832   -0.13212049    0.01719326   -0.00242493   -0.00058253
H    0.07222667    2.66672546    0.00687990   -0.00047469   -0.01148557    0.00353759
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H    2.42400172   -2.05959209   -0.28499486    0.00160671    0.00450490   -0.00007054
C    2.29815814    0.01194687    0.08929410    0.01120668    0.00287243    0.00384198
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   15
   -420.54206788
H   -2.55048903    0.35038537   -0.02057839    0.00568048    0.00083175   -0.00025125
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O   -1.92257338   -1.26608800    0.20475478   -0.00825027   -0.01104197   -0.00072372
C   -0.76249932    0.76938187   -0.06903415    0.02029265    0.02304740   -0.00703785
C   -0.77493360   -0.75333115    0.07812755    0.01581681   -0.01042007    0.01294113
C    0.32395012    1.61944127   -0.03292349    0.00940793    0.01743116   -0.00753287
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C    1.67632112    1.25229788    0.13634686   -0.01385425   -0.00680304    0.00035548
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   15
   -420.54143107
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O   -1.92747080   -1.26826316    0.20598510   -0.01452934   -0.01351208    0.00107093
C   -0.75438677    0.77106835   -0.06841396    0.03436386    0.03209774   -0.00615080
C   -0.77530340   -0.75638931    0.07100492    0.02037802   -0.01072788    0.00940942
C    0.32378558    1.61254214   -0.02578460    0.00739058    0.00331637   -0.00689068
C    0.35233865   -1.60429341   -0.13983109   -0.01907908   -0.01050567   -0.00336408
C    1.67195543    1.25541839    0.13493931   -0.02196409   -0.00257012   -0.00092123
C    1.70911531   -1.25308294   -0.12915643    0.02724023    0.00255274   -0.00055475
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C    2.30204532    0.01863667    0.08043865    0.01922207   -0.00181095    0.00479354
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   15
   -420.54126774
H   -2.57675390    0.37890677   -0.01669628    0.00036980    0.00237343    0.00010663
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O   -1.93171617   -1.26982861    0.20716702   -0.01888630   -0.01508394    0.00281491
C   -0.74833697    0.77082618   -0.06742275    0.04531693    0.03864376   -0.00506605
C   -0.77689274   -0.75880404    0.06331357    0.02237426   -0.00997286    0.00582148
C    0.32316968    1.60545951   -0.01822836    0.00625240   -0.01412150   -0.00636156
C    0.35440901   -1.60783288   -0.13476893   -0.01456371   -0.01270133   -0.00253313
C    1.66889479    1.25868096    0.13358272   -0.02544686    0.00431168   -0.00125703
C    1.70851827   -1.24958131   -0.12761981    0.02391804    0.00917920    0.00025320
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H    2.38198353   -2.08414928   -0.27357657   -0.00563255    0.00183918   -0.00022148
C    2.30228410    0.02207372    0.07558170    0.00944606   -0.00376410    0.00433552
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   15
   -420.54097708
H   -2.59145145    0.39060069   -0.01477505   -0.00381675    0.00016975    0.00072953
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O   -1.93511297   -1.27071357    0.20822163   -0.02100972   -0.01562531    0.00440442
C   -0.74500285    0.76826599   -0.06612565    0.05127544    0.04140670   -0.00387646
C   -0.77982160   -0.76062052    0.05526979    0.02169770   -0.00822059    0.00231375
C    0.32217278    1.59921193   -0.01028848    0.00566502   -0.02791546   -0.00560984
C    0.35735428   -1.61060458   -0.12955360   -0.00885695   -0.01481098   -0.00169488
C    1.66734901    1.26167674    0.13229785   -0.02422618    0.01234590   -0.00076431
C    1.70649348   -1.24663536   -0.12609870    0.01689644    0.01588962    0.00111533
H    0.10357782    2.67705101    0.03623711    0.00149361    0.00783710    0.00341655
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H    2.34454489    2.09702187    0.30042722    0.00147008   -0.00188222    0.00200492
H    2.37584903   -2.09819940   -0.26991552   -0.00289505   -0.00460030   -0.00119367
C    2.30196044    0.02573415    0.07046228   -0.00219596   -0.00485192    0.00390441
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   15
   -420.54098216
H   -2.60345512    0.40216601   -0.01337946   -0.00711621   -0.00194525    0.00134215
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O   -1.93756528   -1.27089369    0.20907740   -0.02079212   -0.01507094    0.00572289
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C    0.36083317   -1.61248211   -0.12423590   -0.00273393   -0.01659518   -0.00082547
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H    2.37181908   -2.10901912   -0.26541059   -0.00048632   -0.00975567   -0.00191511
C    2.30174819    0.02968053    0.06510536   -0.00978216   -0.00444538    0.00372620
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   15
   -420.54226624
H   -2.61047301    0.41503856   -0.01293483   -0.00813208   -0.00253350    0.00169352
O   -2.02798884    1.21910440   -0.14800492   -0.01910314   -0.00263419   -0.00334743
O   -1.93908273   -1.27039413    0.20967484   -0.01828553   -0.01341185    0.00669231
C   -0.74751621    0.75580708   -0.06289809    0.04382341    0.03342789   -0.00165979
C   -0.78939344   -0.76293007    0.03895996    0.01343612   -0.00243485   -0.00404602
C    0.31914146    1.59196427    0.00653073    0.00627369   -0.02855354   -0.00277956
C    0.36447851   -1.61336020   -0.11886870    0.00316624   -0.01754428    0.00012550
C    1.66835410    1.26507139    0.12981446   -0.01500454    0.02060349    0.00055944
C    1.69987755   -1.24378235   -0.12327462    0.00137568    0.01781185    0.00119815
H    0.11168327    2.67723954    0.03644468    0.00340154    0.01124978    0.00191359
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C    2.30209398    0.03388622    0.05952196   -0.01076195   -0.00215184    0.00377074
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   15
   -420.54463003
H   -2.61180629    0.42961230   -0.01368690   -0.00632885   -0.00110208    0.00166722
O   -2.01989653    1.22224073   -0.14977831   -0.01343289   -0.00405926   -0.00331383
O   -1.93977843   -1.26929001    0.20997014   -0.01366466   -0.01071118    0.00726298
C   -0.75291624    0.74638650   -0.06110070    0.03105357    0.02356395   -0.00081565
C   -0.79554118   -0.76377045    0.03107774    0.00674731    0.00106302   -0.00674164
C    0.31707185    1.59100211    0.01523960    0.00712646   -0.01516150   -0.00083062
C    0.36793587   -1.61318420   -0.11350995    0.00834907   -0.01708724    0.00120941
C    1.67037125    1.26499851    0.12854169   -0.01162526    0.01553394    0.00028272
C    1.69621058   -1.24398047   -0.12197557   -0.00421252    0.01083107    0.00019122
H    0.11248002    2.66523272    0.03416620    0.00533015    0.00448564    0.00081250
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H    2.32993951    2.09833594    0.28604869   -0.00508003   -0.00906092    0.00076520
H    2.36464955   -2.10889246   -0.25223830   -0.00122196   -0.00953434   -0.00168211
C    2.30305637    0.03821294    0.05370995   -0.00496875    0.00195018    0.00392469
H    3.40425561    0.10117529    0.07616784    0.00997577    0.00727602   -0.00145210
   15
   -420.54638489
H   -2.60871581    0.44489313   -0.01562126   -0.00233307    0.00173282    0.00134792
O   -2.01119426    1.22556605   -0.15140257   -0.00781443   -0.00670045   -0.00294887
O   -1.93986085   -1.26770321    0.20993739   -0.00726140   -0.00711907    0.00743893
C   -0.76017527    0.73555181   -0.05925296    0.01449935    0.01151088   -0.00017529
C   -0.80209227   -0.76467482    0.02360128   -0.00089588    0.00451045   -0.00903919
C    0.31457294    1.59093285    0.02399849    0.00766647    0.00289784    0.00117218
C    0.37089375   -1.61198374   -0.10822506    0.01239865   -0.01483720    0.00240898
C    1.67309782    1.26401398    0.12725460   -0.00943577    0.00503368   -0.00053383
C    1.69278833   -1.24481363   -0.12068582   -0.00779896   -0.00005164   -0.00123895
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H    0.08639915   -2.65547056   -0.22474436   -0.00457094    0.00091338   -0.00148298
H    2.33201576    2.11203097    0.28017501   -0.00139250   -0.00290492    0.00169267
H    2.36204446   -2.09808919   -0.24372400   -0.00429455   -0.00438069   -0.00089690
C    2.30429409    0.04241557    0.04766081    0.00568128    0.00726074    0.00403986
H    3.38759257    0.10487930    0.06679188   -0.00174767    0.00713887   -0.00152827
   15
   -420.54638473
H   -2.60397673    0.45894153   -0.01852539    0.00213018    0.00434766    0.00100221
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   15
   -420.54545872
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   15
   -420.54470349
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   15
   -420.54373936
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   15
   -420.54235143
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   15
   -420.54143549
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   15
   -420.54190790
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   15
   -420.54315059
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   15
   -420.54355982
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   15
   -420.54268867
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   15
   -420.54181793
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   15
   -420.54152410
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O   -1.97814961   -1.26425159    0.18445190   -0.01379041    0.00344765    0.01060455
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C    0.27777166    1.52411998    0.10245328   -0.03396476   -0.02218953    0.00292195
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C    1.67464156    1.29018578    0.10719912   -0.01230052    0.01103144    0.00639016
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C    2.30857697    0.04623752   -0.03051777    0.00629248   -0.03034557   -0.00704099
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   15
   -420.54115217
H   -2.64516683    0.57168517   -0.12703075   -0.00696569    0.00114495   -0.00111213
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C   -0.74561675    0.66970809   -0.04367804    0.04088964    0.01558192    0.00645881
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   15
   -420.54057491
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O   -1.98764557   -1.26853744    0.17465323   -0.02069738    0.00147282    0.00960181
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   15
   -420.54059594
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O   -1.99105212   -1.27079978    0.16908623   -0.02106235    0.00126979    0.00852820
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C   -0.81985543   -0.81418733    0.01307727    0.01958067   -0.01733999   -0.00620097
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   15
   -420.54159068
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O   -1.99351039   -1.27312129    0.16313326   -0.01946497    0.00149131    0.00718690
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C    1.66801362    1.29043298    0.09105958   -0.01714114    0.02084614    0.00393738
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C    2.31375876    0.07099537   -0.04823285   -0.01235133   -0.00371875   -0.00364805
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   15
   -420.54256412
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O   -1.99509187   -1.27551152    0.15685474   -0.01617068    0.00199621    0.00570231
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C    0.30878329    1.51290033    0.12231616    0.01897518   -0.01083719    0.00190611
C    0.38290735   -1.59521015   -0.05029071    0.02001733   -0.00561849   -0.00839620
C    1.66881005    1.28721962    0.08627555   -0.01991959    0.00948066    0.00190455
C    1.70273369   -1.20152761   -0.08231726   -0.00333174    0.01127813    0.00004028
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   15
   -420.54236580
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O   -1.99594436   -1.27799273    0.15031749   -0.01162504    0.00260687    0.00421070
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C   -0.83447461   -0.81094410    0.03132330    0.00183908   -0.00823870    0.00394664
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C    0.38215782   -1.59706202   -0.04597822    0.02058717   -0.00736529   -0.00896524
C    1.67080508    1.28345067    0.08137893   -0.02145584   -0.00540201   -0.00062701
C    1.70135896   -1.20536430   -0.07980353   -0.00357249   -0.00137702    0.00007898
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C    2.32039125    0.08684114   -0.05548026    0.00994444    0.02021144   -0.00128953
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   15
   -420.54144092
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O   -1.99627174   -1.28059189    0.14358876   -0.00645223    0.00311384    0.00282956
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C    1.67407916    1.28000174    0.07652097   -0.01938394   -0.01903674   -0.00326958
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H    2.37969948   -2.04442320   -0.09046988   -0.00855189    0.00475047    0.00200189
C    2.32318888    0.09329894   -0.05895320    0.01679763    0.03080151   -0.00036781
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   15
   -420.54090922
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O   -1.99630604   -1.28333131    0.13673091   -0.00138388    0.00331776    0.00164522
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C    0.37705973   -1.59951484   -0.03571642    0.01484649   -0.00416912   -0.00905650
C    1.67850436    1.27767925    0.07185929   -0.01314511   -0.02778180   -0.00560217
C    1.69925918   -1.21219141   -0.07480225   -0.00481201   -0.01771115    0.00054160
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C    2.32502420    0.09790855   -0.06240458    0.01335895    0.03848191    0.00067543
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   15
   -420.54081968
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O   -1.99627422   -1.28621925    0.12979767    0.00281063    0.00302653    0.00068848
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C   -0.85007718   -0.80334197    0.04756796   -0.01615530    0.00356034    0.01107064
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C    1.68370868    1.27700185    0.06753298   -0.00374726   -0.02955186   -0.00726196
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C    2.32609345    0.10021120   -0.06589787    0.00183387    0.04206190    0.00190815
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   15
   -420.54035559
H   -2.60571668    0.53963132   -0.17094124   -0.00077250   -0.00689464   -0.00213980
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O   -1.99636422   -1.28924224    0.12283225    0.00550663    0.00213909   -0.00002624
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C   -0.85375820   -0.80094001    0.05181065   -0.01913956    0.00622341    0.01245111
C    0.31891724    1.51983256    0.13896514    0.02454955   -0.00228990    0.00175563
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C    1.68913292    1.27807388    0.06364137    0.00696603   -0.02388922   -0.00803915
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C    2.32705387    0.09999328   -0.06950563   -0.01021603    0.04104966    0.00296181
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   15
   -420.53972854
H   -2.60685370    0.54142966   -0.16847307   -0.00012127   -0.00522107   -0.00195769
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O   -1.99669705   -1.29235999    0.11586724    0.00635622    0.00063176   -0.00053064
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C   -0.85629191   -0.79890998    0.05530268   -0.02009364    0.00800458    0.01335714
C    0.31592807    1.52017244    0.14171219    0.01598509   -0.00883206    0.00099203
C    0.36400895   -1.60150425   -0.01640049   -0.00818251   -0.00313716   -0.00586685
C    1.69414149    1.28056324    0.06023197    0.01651292   -0.01289041   -0.00803826
C    1.69886155   -1.21516611   -0.06762882   -0.01104539   -0.01184824    0.00195548
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H    2.41839706   -2.04946405   -0.09407753    0.00615035   -0.00580549    0.00159408
C    2.32860281    0.09731396   -0.07328899   -0.01660504    0.03583417    0.00334633
H    3.43339580    0.18200217   -0.16222976    0.01408650    0.01134457   -0.00216178
   15
   -420.53983761
H   -2.60799569    0.54684830   -0.16459904    0.00204606   -0.00129231   -0.00169975
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O   -1.99731131   -1.29550433    0.10892569    0.00536048   -0.00142654   -0.00085194
C   -0.77737890    0.67455759   -0.04613047   -0.02493742   -0.01254809   -0.01347737
C   -0.85762000   -0.79735978    0.05798913   -0.01915832    0.00892667    0.01381261
C    0.31198472    1.52102608    0.14439424    0.00491496   -0.01136739    0.00120630
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C    1.69817217    1.28382903    0.05730707    0.02193513   -0.00126727   -0.00771084
C    1.69994129   -1.21446008   -0.06543378   -0.00878788   -0.00954638    0.00235571
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H    0.24028587   -2.68739846   -0.01083820    0.00915723   -0.00427833   -0.00084787
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H    2.42574404   -2.04710199   -0.09823962    0.00828069   -0.00639107    0.00131079
C    2.33111556    0.09248350   -0.07727007   -0.01500657    0.02741964    0.00279946
H    3.43744576    0.17652850   -0.17513169    0.01531955    0.01133042   -0.00260173
   15
   -420.54079423
H   -2.61061133    0.55316049   -0.15950034    0.00419142    0.00322399   -0.00144565
O   -1.94544190    1.27859366   -0.15311657    0.02108367   -0.00406734    0.00095062
O   -1.99816293   -1.29858255    0.10202221    0.00281799   -0.00386385   -0.00101169
C   -0.77596053    0.68269864   -0.04311944   -0.01948648   -0.00122954   -0.01313223
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C    0.30774974    1.52254614    0.14699865   -0.00727371   -0.00976568    0.00233145
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   15
   -420.54163714
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   15
   -420.54166210
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   15
   -420.54164969
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   15
   -420.54244023
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   15
   -420.54317831
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   15
   -420.54313451
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   15
   -420.54264798
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O   -1.99803095   -1.30976680    0.05477424   -0.01881519   -0.01218248    0.00004293
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   15
   -420.54250479
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   15
   -420.54267202
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O   -1.99190190   -1.30816466    0.04139586   -0.01678973   -0.00918291    0.00046879
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   15
   -420.54229994
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O   -1.98766384   -1.30670167    0.03467959   -0.01407470   -0.00733996    0.00068265
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   15
   -420.54126606
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O   -1.98279004   -1.30490533    0.02793242   -0.01061580   -0.00555337    0.00087958
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C    2.32955825    0.04498399   -0.11338404    0.01973592    0.00036100   -0.00864980
H    3.38247107   -0.04786394   -0.24089533   -0.01681886   -0.00963545    0.00166092
   15
   -420.54107850
H   -2.59329740    0.44778360   -0.07712353    0.00170308   -0.00649768    0.00339011
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O   -1.97743581   -1.30285622    0.02114543   -0.00683240   -0.00398925    0.00105076
C   -0.77368703    0.69395074    0.03164594   -0.00886897   -0.02861765    0.00403171
C   -0.82945726   -0.79319072    0.04040778   -0.00204238   -0.01563703   -0.00708324
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   15
   -420.54216511
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   15
   -420.54329614
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   15
   -420.54361413
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   15
   -420.54361565
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   15
   -420.54394948
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   15
   -420.54415807
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   15
   -420.54313289
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   15
   -420.54139219
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   15
   -420.54078396
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   15
   -420.54159775
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C   -0.80463578   -0.73230964    0.04655112   -0.00427911    0.01580058   -0.00283219
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   15
   -420.54243283
H   -2.60349308    0.41157338   -0.15176208   -0.00624602    0.00273883   -0.00275285
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C   -0.80217081   -0.72740636    0.04920268   -0.00650351    0.01955859   -0.00102420
C    0.31140428    1.56336913    0.09122735   -0.00803124   -0.03725255   -0.00533412
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C    1.68997230   -1.25680286   -0.06045276   -0.00029384   -0.00322963   -0.00989302
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C    2.30016665    0.02507183   -0.10628021   -0.00227683   -0.01338298    0.00154839
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   15
   -420.54263842
H   -2.58632940    0.40273040   -0.15509391   -0.00185907    0.00472291   -0.00259665
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C   -0.77835602    0.76049640    0.07224940    0.00367639    0.03933979    0.01195878
C   -0.79931466   -0.72368145    0.05191561   -0.00833448    0.02243308    0.00092093
C    0.31238607    1.56447977    0.08574369    0.00183387   -0.04232981   -0.00623523
C    0.36183833   -1.58277978    0.12171986   -0.00785737   -0.00197691    0.00005953
C    1.67545960    1.26229958    0.02723912   -0.01475395    0.02213845    0.00570326
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   15
   -420.54284095
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C   -0.79595716   -0.72130753    0.05457248   -0.00964076    0.02416215    0.00293869
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   15
   -420.54349122
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   15
   -420.54373772
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C   -0.78746925   -0.72094653    0.05923060   -0.00985951    0.02354640    0.00693108
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C    2.29379194    0.02510810   -0.10264343    0.00003939    0.00789996    0.00291449
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   15
   -420.54257824
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   15
   -420.54099100
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   15
   -420.54074913
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   15
   -420.54168632
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C    2.28694342    0.01881725   -0.10144505   -0.00218822    0.01599616    0.00003451
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   15
   -420.54237404
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C   -0.75945336   -0.74099677    0.06174641    0.01416617    0.00049749    0.01438430
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C    0.38769521   -1.59216179    0.14185984    0.01637357    0.00414331    0.00257117
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C    1.70228706   -1.26826930   -0.02528671   -0.00337341    0.00808020   -0.00558272
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   15
   -420.54236828
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C    2.28256252    0.01012951   -0.10088816   -0.02224006    0.00210201   -0.00133056
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   15
   -420.54246239
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O   -1.90911658   -1.21585154   -0.12196953    0.00058983    0.01322694   -0.00820154
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C    0.27758319    1.61224638    0.04917787   -0.01520777    0.00133799    0.00017464
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   15
   -420.54290050
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O   -1.90831386   -1.21206281   -0.12605639    0.00213186    0.01594785   -0.00790392
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C    1.66445483    1.24407679   -0.01907830    0.01765019    0.00597253   -0.00309350
C    1.71025952   -1.27509774   -0.00555955    0.00424032    0.00757327   -0.00189644
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H    2.33474629    2.07561916    0.02622756   -0.00863771   -0.01146049    0.00298886
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C    2.28295112    0.00104327   -0.09996114   -0.01378554   -0.01699966   -0.00497094
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   15
   -420.54272136
H   -2.60373250    0.40369681   -0.04694864   -0.00148902    0.00233514    0.00001478
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O   -1.90761196   -1.20899697   -0.12978576    0.00475860    0.01848159   -0.00731603
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C   -0.74982047   -0.75943328    0.04905868    0.02923001   -0.02024723    0.01401653
C    0.26869171    1.61521959    0.04355826   -0.03394839    0.00946667    0.00211960
C    0.37694589   -1.59387946    0.14900901   -0.02141352    0.01543108    0.00685985
C    1.66213061    1.24755677   -0.02218680    0.00968007    0.00709226   -0.00260293
C    1.71271727   -1.27851095    0.00134136    0.00908136    0.00046574   -0.00082757
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   15
   -420.54123956
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   15
   -420.53985857
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   15
   -420.53998241
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O   -1.90745281   -1.20521770   -0.13914051    0.01554956    0.02395016   -0.00454194
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   15
   -420.54105218
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O   -1.90858862   -1.20603849   -0.14178677    0.01827618    0.02448709   -0.00363446
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C   -0.76454305   -0.76074686    0.02351039    0.00245882   -0.01384299    0.00574140
C    0.27545163    1.61322305    0.03059497   -0.02137389   -0.00057034    0.00322230
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   15
   -420.54176341
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C    2.28448489    0.00610695   -0.08712993   -0.00487456   -0.02115708   -0.00942322
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   15
   -420.54209083
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C   -0.77480806   -0.75571883    0.00808249   -0.01133363   -0.00348049    0.00108873
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C    1.71702841   -1.29049242    0.04123011   -0.01015590   -0.00804838    0.00578013
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   15
   -420.54288920
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   15
   -420.54408923
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   15
   -420.54442178
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C    1.72178847   -1.28835201    0.05748833   -0.00030749   -0.01856012    0.00388549
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   15
   -420.54356534
H   -2.59788579    0.40928120    0.07201483   -0.00385795   -0.00569632    0.00262551
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C    1.65518713    1.24738284   -0.05423146   -0.01279270   -0.02506542    0.00708745
C    1.72384501   -1.28573492    0.06236433    0.00588282   -0.02001792    0.00269215
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C    2.28465012    0.03855140   -0.06169120    0.00447859    0.03054446   -0.00505333
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   15
   -420.54293947
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O   -1.93733346   -1.23801836   -0.15651883   -0.00647478   -0.00020001   -0.00406222
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C   -0.78718887   -0.74519400   -0.03004524   -0.00848668    0.01954869   -0.00485051
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C    1.72555732   -1.28193061    0.06707833    0.00985473   -0.01691022    0.00133631
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H    2.41390378   -2.11190255    0.08276964   -0.00831850    0.00238747   -0.00179197
C    2.28524873    0.04194282   -0.05545616    0.00387374    0.03502917   -0.00335076
H    3.34821060    0.03494651   -0.14247240   -0.01550527   -0.00412723    0.00090827
   15
   -420.54333862
H   -2.56019412    0.39041402    0.07574312    0.00252242   -0.00797643    0.00213680
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O   -1.94241695   -1.24436483   -0.15803152   -0.01313505   -0.00524570   -0.00437139
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C   -0.78742621   -0.74573664   -0.03698097   -0.00360037    0.02079343   -0.00520995
C    0.30568079    1.60093070   -0.00151392    0.02164130    0.01512099   -0.00268902
C    0.40008091   -1.63645984    0.12179019    0.02439264   -0.02658675    0.00884508
C    1.66040395    1.24673004   -0.06373539   -0.00908303   -0.03745064    0.00784448
C    1.72668818   -1.27712503    0.07171272    0.01101366   -0.00961766   -0.00025306
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   15
   -420.54383345
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O   -1.94690818   -1.25047657   -0.15934677   -0.01880593   -0.00940955   -0.00444576
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C   -0.78744689   -0.74752823   -0.04360224    0.00150603    0.02032251   -0.00545250
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   15
   -420.54362284
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O   -1.95055227   -1.25616552   -0.16046118   -0.02285688   -0.01244159   -0.00427839
C   -0.77163970    0.74872447    0.03639090    0.00309607    0.01690315    0.00059197
C   -0.78755701   -0.75054000   -0.04989389    0.00630072    0.01808625   -0.00565537
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C    1.66758623    1.25437822   -0.07504710    0.00549943   -0.01427560    0.00439052
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H    0.01523036    2.65830463    0.00072710   -0.00715280    0.00925787    0.00033457
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C    2.28776377    0.03987069   -0.03623320   -0.02073188    0.02083139    0.00595015
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   15
   -420.54318508
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O   -2.01034370    1.24755469    0.12783902   -0.00999203    0.00902228    0.00195777
O   -1.95316716   -1.26129473   -0.16138233   -0.02481439   -0.01419639   -0.00387476
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C    0.29673079    1.58613481   -0.01229731   -0.00661760   -0.02135116   -0.00292030
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C    1.67092503    1.25993237   -0.08116429    0.01199606    0.00280516    0.00190568
C    1.72618625   -1.26128330    0.08613333    0.01164986    0.01090200   -0.00498515
H    0.01949247    2.66065860   -0.00053179   -0.00632160    0.01225195    0.00044808
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H    2.46724792   -2.07484787    0.18644164    0.00890270   -0.00597531    0.00145529
C    2.29045423    0.03604528   -0.03027348   -0.02126290    0.00896133    0.00880472
H    3.39125901    0.00688003   -0.16599617    0.01242510   -0.00608484   -0.00508513
   15
   -420.54349635
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O   -1.95466506   -1.26578469   -0.16212843   -0.02441264   -0.01462602   -0.00326521
C   -0.76074976    0.74429607    0.04066825    0.02535526    0.02367138    0.00222337
C   -0.78915112   -0.75958719   -0.06143972    0.01326183    0.00894910   -0.00605513
C    0.29365602    1.58293415   -0.01553038   -0.01829872   -0.02338112   -0.00249718
C    0.37958058   -1.62043584    0.09460245    0.00112359   -0.01538479    0.00088691
C    1.67356660    1.26534632   -0.08740067    0.01297918    0.01422996    0.00018646
C    1.72466762   -1.25688752    0.09142760    0.01453124    0.01072431   -0.00546993
H    0.02820271    2.65454820   -0.00210747   -0.00375247    0.00929679    0.00046328
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C    2.29439656    0.03168144   -0.02484177   -0.01504482   -0.00359460    0.01077619
H    3.39017828    0.01118123   -0.16538294    0.00969316   -0.00469724   -0.00548617
   15
   -420.54429958
H   -2.54550277    0.41299159    0.06288131    0.00779272   -0.00410183   -0.00013893
O   -2.00807780    1.25223954    0.14087419   -0.01319674    0.01462033    0.00291038
O   -1.95506417   -1.26961596   -0.16272707   -0.02164778   -0.01373104   -0.00246959
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C   -0.79105354   -0.76507333   -0.06666958    0.01488543    0.00274184   -0.00627679
C    0.29167603    1.58111221   -0.01861290   -0.02761358   -0.01847352   -0.00197763
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C    1.67545878    1.26994572   -0.09365460    0.00712431    0.01684810   -0.00033060
C    1.72226596   -1.25312114    0.09704813    0.01819539    0.00680069   -0.00507148
H    0.03954583    2.64204592   -0.00401069   -0.00002452    0.00134580    0.00037812
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C    2.29922196    0.02752851   -0.02005658   -0.00350631   -0.01486189    0.01173020
H    3.38242815    0.01883945   -0.16086662    0.00187213   -0.00288605   -0.00508911
   15
   -420.54438392
H   -2.56475631    0.42409256    0.05899255    0.00261434   -0.00646609   -0.00088985
O   -2.00606428    1.25366203    0.14720562   -0.01162371    0.01734584    0.00345264
O   -1.95448907   -1.27282899   -0.16321430   -0.01674580   -0.01156992   -0.00150848
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C   -0.79384918   -0.77072337   -0.07151972    0.01508906   -0.00384674   -0.00652001
C    0.29134402    1.58038425   -0.02157555   -0.03251753   -0.00904886   -0.00150978
C    0.36723812   -1.60612113    0.08016572   -0.01458705   -0.00690749   -0.00348250
C    1.67693892    1.27355326   -0.09989157   -0.00243770    0.01410131   -0.00024130
C    1.71876919   -1.24975662    0.10297194    0.02076769    0.00104327   -0.00401344
H    0.05090059    2.62868754   -0.00618248    0.00381344   -0.00835114    0.00023702
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H    2.33314858    2.13607337   -0.23495009    0.00121722    0.00246126   -0.00173926
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C    2.30424993    0.02426075   -0.01597686    0.00980253   -0.02343161    0.01190940
H    3.37344682    0.02857238   -0.15271085   -0.00779837   -0.00101169   -0.00427531
   15
   -420.54387292
H   -2.58593423    0.43975899    0.05574113   -0.00188242   -0.00733007   -0.00154011
O   -2.00352548    1.25430592    0.15338110   -0.00948122    0.01787766    0.00380292
O   -1.95316073   -1.27552120   -0.16363349   -0.01010319   -0.00829469   -0.00042913
C   -0.75621363    0.72725547    0.04595000    0.03153685    0.01708985    0.00480571
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C    0.29294967    1.58020727   -0.02444597   -0.03166786   -0.00030754   -0.00122713
C    0.36215271   -1.59820277    0.07319729   -0.02053525   -0.00093450   -0.00557853
C    1.67856140    1.27630853   -0.10611259   -0.01110299    0.01107102   -0.00036741
C    1.71403371   -1.24646003    0.10913801    0.01994240   -0.00379731   -0.00286036
H    0.05958821    2.62112086   -0.00852683    0.00639709   -0.01438666    0.00012969
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H    2.35838934    2.14368668   -0.23989303    0.00973603    0.01010795   -0.00279143
H    2.45431533   -2.00986644    0.27877732    0.00128302    0.01363811    0.00096836
C    2.30870448    0.02239308   -0.01261630    0.01924815   -0.02862728    0.01186430
H    3.36987491    0.03904307   -0.14145971   -0.01404414    0.00071847   -0.00371161
   15
   -420.54408691
H   -2.60588243    0.46055736    0.05358231   -0.00430320   -0.00576920   -0.00188360
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O   -1.95137855   -1.27784013   -0.16403340   -0.00224844   -0.00418079    0.00071427
C   -0.75859587    0.71917922    0.04720218    0.02446949    0.00948343    0.00575236
C   -0.80207532   -0.78094787   -0.08002136    0.01084369   -0.01571007   -0.00705295
C    0.29644122    1.58007771   -0.02724093   -0.02502241    0.00303221   -0.00118995
C    0.35829649   -1.59023226    0.06656562   -0.02413452    0.00586948   -0.00749576
C    1.68083563    1.27838134   -0.11230822   -0.01588461    0.01052212   -0.00112984
C    1.70811588   -1.24294871    0.11547969    0.01448386   -0.00575747   -0.00219236
H    0.06381276    2.62342078   -0.01097038    0.00671017   -0.01250320    0.00012752
H    0.10547607   -2.63212488    0.24460576   -0.00122767    0.00214320    0.00409143
H    2.37686283    2.14431982   -0.24287743    0.01422114    0.01284359   -0.00300948
H    2.44444922   -2.00970284    0.29952612    0.00229570    0.01269217    0.00137584
C    2.31203833    0.02223938   -0.00997412    0.02032173   -0.03036173    0.01194388
H    3.37594618    0.04900460   -0.12749289   -0.01267417    0.00228641   -0.00380387
   15
   -420.54497190
H   -2.62289075    0.48536507    0.05275555   -0.00415739   -0.00178617   -0.00179446
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O   -1.94949650   -1.27997096   -0.16446567    0.00616811    0.00035320    0.00184450
C   -0.76244307    0.71053643    0.04810687    0.01443807    0.00046845    0.00662688
C   -0.80724880   -0.78481059   -0.08364063    0.00634435   -0.01984814   -0.00734299
C    0.30142482    1.57979177   -0.02996288   -0.01417659    0.00120378   -0.00134354
C    0.35588615   -1.58261554    0.06038466   -0.02503159    0.01241513   -0.00892209
C    1.68404463    1.27980181   -0.11843182   -0.01549312    0.01313615   -0.00259011
C    1.70134054   -1.23910322    0.12195692    0.00542763   -0.00499777   -0.00210463
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H    2.38539651    2.13604538   -0.24374784    0.01363728    0.00989434   -0.00232006
H    2.43280468   -2.01844686    0.31924103    0.00534983    0.00793368    0.00248802
C    2.31418300    0.02390547   -0.00805328    0.01365530   -0.02878461    0.01180276
H    3.39072310    0.05733130   -0.11076602   -0.00445035    0.00366009   -0.00422586
   15
   -420.54524551
H   -2.63701872    0.51137976    0.05320036   -0.00215434    0.00344858   -0.00136030
O   -1.99355900    1.25202856    0.17090862   -0.00737142    0.00274876    0.00240552
O   -1.94789344   -1.28211735   -0.16498116    0.01433636    0.00476663    0.00286070
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C   -0.81279957   -0.78748183   -0.08681591    0.00058615   -0.02220734   -0.00760993
C    0.30725843    1.57943710   -0.03260355   -0.00182361   -0.00146919   -0.00151033
C    0.35497578   -1.57574161    0.05473963   -0.02315820    0.01736984   -0.00962798
C    1.68816386    1.28041402   -0.12439606   -0.00979760    0.01842736   -0.00455806
C    1.69424177   -1.23495980    0.12856237   -0.00459592   -0.00337549   -0.00220349
H    0.05932111    2.64778479   -0.01622103    0.00228576    0.00657673    0.00035953
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H    2.38440735    2.12095334   -0.24299538    0.00818644    0.00183482   -0.00086502
H    2.41732006   -2.03281354    0.33715125    0.00821244    0.00165884    0.00381320
C    2.31551586    0.02729680   -0.00684160    0.00415082   -0.02406320    0.01076510
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   15
   -420.54433570
H   -2.64959138    0.53496376    0.05462227   -0.00022873    0.00780402   -0.00087245
O   -1.98956330    1.25062001    0.17648765   -0.00663529   -0.00373079    0.00152679
O   -1.94693628   -1.28447735   -0.16562575    0.02127487    0.00847109    0.00368241
C   -0.77205626    0.69372980    0.04867262   -0.00810290   -0.01750841    0.00785535
C   -0.81838308   -0.78882033   -0.08953131   -0.00569228   -0.02250442   -0.00779340
C    0.31320770    1.57915527   -0.03515353    0.00951818   -0.00102678   -0.00154685
C    0.35545337   -1.56990519    0.04967260   -0.01878475    0.01975343   -0.00947366
C    1.69285687    1.27990868   -0.13008421   -0.00047660    0.02417075   -0.00658952
C    1.68741282   -1.23060686    0.13529921   -0.01302564   -0.00282038   -0.00193696
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H    0.15858540   -2.63085195    0.21757856    0.00413445   -0.00206160    0.00425936
H    2.37770622    2.10469895   -0.24164240   -0.00014171   -0.00881085    0.00091369
H    2.39605736   -2.04843718    0.35234084    0.00883717   -0.00365794    0.00473292
C    2.31658673    0.03212914   -0.00627467   -0.00333916   -0.01650729    0.00850420
H    3.42254682    0.06551047   -0.06821623    0.01284737    0.00483244   -0.00364643
   15
   -420.54314669
H   -2.66186354    0.55310250    0.05669705   -0.00050796    0.00934744   -0.00075249
O   -1.98527625    1.24937052    0.18199578   -0.00337862   -0.00752617    0.00105454
O   -1.94693602   -1.28721680   -0.16643633    0.02597218    0.01087253    0.00421424
C   -0.77647332    0.68664423    0.04826000   -0.01776639   -0.02467904    0.00807536
C   -0.82362512   -0.78880879   -0.09177630   -0.01140609   -0.02061471   -0.00779536
C    0.31859553    1.57891133   -0.03761105    0.01812533    0.00418635   -0.00136177
C    0.35705733   -1.56524923    0.04517442   -0.01247917    0.01930637   -0.00850218
C    1.69758189    1.27796289   -0.13537698    0.00823202    0.02554981   -0.00794753
C    1.68135550   -1.22607289    0.14214950   -0.01828157   -0.00432372   -0.00094252
H    0.04805182    2.65625808   -0.02245970   -0.00162833    0.01488382    0.00043078
H    0.17203482   -2.62841574    0.20232302    0.00564872   -0.00129085    0.00365976
H    2.37102821    2.09463120   -0.24091857   -0.00695818   -0.01686517    0.00225290
H    2.36861950   -2.06158265    0.36417210    0.00632000   -0.00643529    0.00482466
C    2.31783651    0.03794887   -0.00621674   -0.00635609   -0.00679371    0.00519779
H    3.42758503    0.06453216   -0.04282797    0.01447976    0.00435362   -0.00234387
   15
   -420.54267500
H   -2.67359811    0.56469334    0.05934299   -0.00354301    0.00791001   -0.00110286
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   15
   -420.54239424
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   15
   -420.54136753
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   15
   -420.54034905
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   15
   -420.54057953
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   15
   -420.54164665
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   15
   -420.54219021
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O   -1.97404740   -1.31598958   -0.17687642   -0.01149505   -0.01397327   -0.00004635
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   15
   -420.54174418
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O   -1.97864615   -1.31941413   -0.17869881   -0.01710513   -0.01824209   -0.00097702
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   15
   -420.54107375
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O   -1.98247733   -1.32201533   -0.18047718   -0.02045490   -0.02135634   -0.00181249
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   15
   -420.54063227
H   -2.59317710    0.49497978    0.13102886   -0.00113368   -0.00411647   -0.00182145
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   15
   -420.53984592
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O   -1.98733442   -1.32424519   -0.18375848   -0.02034431   -0.02349692   -0.00298640
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C    0.31542325    1.51080088   -0.06967298   -0.03226732   -0.03016571    0.00770615
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C    1.71059191    1.27549890   -0.16937861    0.00404756    0.01461633   -0.00715748
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C    2.33906977    0.04978002    0.01437189    0.00773299   -0.02273751   -0.00737655
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   15
   -420.53842536
H   -2.56111394    0.46342424    0.15812968    0.00181744   -0.00919527   -0.00168685
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O   -1.98836365   -1.32377698   -0.18520824   -0.01734089   -0.02243437   -0.00328722
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C   -0.84648009   -0.77694185   -0.09571994    0.00466888    0.00593392    0.00221179
C    0.31758377    1.50741228   -0.07449789   -0.03125741   -0.02456224    0.00710604
C    0.34896185   -1.55608719    0.00880016   -0.01003276   -0.00262011   -0.00351848
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C    1.67303377   -1.16472153    0.20282601    0.00670392    0.01943099    0.01299755
H    0.05095626    2.54355544   -0.06608388    0.00392029   -0.01438617   -0.00006685
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H    2.37831915   -1.96343699    0.38877468    0.00176613    0.01024896   -0.00120713
C    2.34248620    0.04922514    0.02014763    0.01900698   -0.02769942   -0.00441528
H    3.40722017    0.03129922    0.14399116   -0.01086701   -0.00103115    0.00332690
   15
   -420.53747050
H   -2.54627275    0.45689981    0.17356299    0.00612175   -0.00789369   -0.00121038
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   15
   -420.53785471
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   15
   -420.53880862
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   15
   -420.53934666
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   15
   -420.53954157
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   15
   -420.54014826
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   15
   -420.54117656
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O   -1.98693069   -1.30055784   -0.19137895    0.01376776    0.00250565   -0.00206674
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   15
   -420.54150159
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O   -1.98808694   -1.29643203   -0.19179915    0.01170004    0.00393318   -0.00194696
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C    1.71308115    1.26645593   -0.16687420    0.00446170   -0.01434154    0.00009606
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   15
   -420.54075076
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C    1.71519695    1.26383751   -0.16558888    0.00533303   -0.02891375    0.00269948
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   15
   -420.54005475
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O   -1.99176337   -1.28871717   -0.19237508    0.00103843    0.00360353   -0.00196133
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   15
   -420.53989019
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O   -1.99380631   -1.28511548   -0.19253030   -0.00582106    0.00242608   -0.00206386
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C   -0.84749175   -0.79332946   -0.10299931   -0.00557582    0.00137430   -0.00117269
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C    1.71826033    1.26409704   -0.16355292    0.01305636   -0.03167870    0.00312917
C    1.68831752   -1.19592744    0.18157764    0.00201306   -0.00201798    0.00271562
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   15
   -420.53968738
H   -2.67586700    0.59080555    0.30073886   -0.00127468    0.01386064    0.00461797
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O   -1.99558622   -1.28162319   -0.19259189   -0.01239724    0.00106089   -0.00218414
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C   -0.84300232   -0.79325897   -0.10378118   -0.00084737    0.00282539   -0.00186488
C    0.31105073    1.54228600   -0.13761106   -0.00106641    0.00417302   -0.00411716
C    0.38030157   -1.57407383    0.00613804    0.01501427    0.00199147   -0.00405570
C    1.71874140    1.26713704   -0.16282657    0.01982918   -0.01878427    0.00061506
C    1.69026025   -1.19746663    0.17684105   -0.00001320    0.00439231    0.00027188
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H    2.28213351   -2.09968980    0.36060689   -0.01072871   -0.01090992    0.00108083
C    2.32996895    0.08156311    0.09007095   -0.01121505    0.02696373    0.01035900
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   15
   -420.53906142
H   -2.68473068    0.59248078    0.29727478   -0.00509166    0.01211330    0.00482913
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O   -1.99680766   -1.27817973   -0.19255447   -0.01790482   -0.00013186   -0.00228657
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C   -0.83845768   -0.79335386   -0.10444958    0.00310020    0.00318830   -0.00271436
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   15
   -420.53852198
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   15
   -420.53911321
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O   -1.99665718   -1.27124445   -0.19216754   -0.02370367   -0.00116906   -0.00226856
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C    0.28826794    1.54729651   -0.14835835   -0.03055603   -0.01414937   -0.00065975
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   15
   -420.54054326
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O   -1.99502363   -1.26770619   -0.19181909   -0.02358715   -0.00083520   -0.00209200
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C    1.70546270    1.28013579   -0.15828321    0.01837893    0.02489466   -0.00718543
C    1.69870614   -1.20826235    0.15869793   -0.00050832    0.00771987   -0.00369748
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H    2.31795353   -2.08427874    0.33063086   -0.00974999   -0.00379286    0.00002671
C    2.32787209    0.05517973    0.10076871    0.00413806   -0.01538282    0.01710228
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   15
   -420.54158878
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O   -1.99232759   -1.26413124   -0.19137593   -0.02147602   -0.00001664   -0.00182694
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C    0.28114274    1.55412009   -0.15516206   -0.03837178    0.00132781   -0.00122958
C    0.39048619   -1.58754289    0.01849821    0.02204908   -0.00295927    0.00005903
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H    2.34520372   -2.06644210    0.32219216   -0.00762110    0.00057513   -0.00031811
C    2.32806318    0.04938255    0.10102352    0.01589905   -0.02201227    0.01714895
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   15
   -420.54203671
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O   -1.98866388   -1.26055693   -0.19085023   -0.01759595    0.00124611   -0.00146714
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C    0.38818362   -1.58992840    0.02111618    0.01716581   -0.00110742    0.00026610
C    1.69107663    1.27926960   -0.15365778   -0.00750050    0.01019978   -0.00385663
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C    2.32731654    0.04490268    0.10024456    0.02299943   -0.02585080    0.01650643
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   15
   -420.54255856
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C   -0.81840914   -0.79449512   -0.10273737    0.00276408   -0.01062547   -0.00897334
C    0.28288705    1.56080967   -0.16164644   -0.02629449    0.00871067   -0.00279123
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C    1.70560489   -1.22135842    0.14724775   -0.00120470    0.00253636   -0.00373873
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H    2.41280976   -2.03342858    0.30588643    0.00238206    0.00350037    0.00014554
C    2.32521879    0.04197182    0.09847220    0.02238448   -0.02681206    0.01489066
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   15
   -420.54297794
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C   -0.81622431   -0.79343348   -0.10089818   -0.00045002   -0.01281550   -0.00957760
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C    1.67813428    1.27569418   -0.14804657   -0.01649244    0.00592080   -0.00278731
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   15
   -420.54241352
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O   -1.97391061   -1.25045250   -0.18894481    0.00031441    0.00563001   -0.00034028
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C   -0.81401106   -0.79160096   -0.09848103   -0.00388734   -0.01415816   -0.00993089
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   15
   -420.54088705
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O   -1.96863642   -1.24750991   -0.18825684    0.00598328    0.00646823   -0.00009223
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C    1.66877163    1.27037550   -0.14171383   -0.00658010    0.01526063   -0.00375879
C    1.71314868   -1.23587708    0.13778250   -0.00015665   -0.00248729   -0.00253141
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   15
   -420.53964231
H   -2.52560657    0.41304542    0.13708061    0.00816194   -0.01175736   -0.00511356
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O   -1.96362753   -1.24485857   -0.18756422    0.01002104    0.00670007    0.00003175
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C   -0.80870641   -0.78536768   -0.09184419   -0.00875622   -0.01347211   -0.00980804
C    0.29850589    1.57081501   -0.17252614    0.02122709   -0.00037754   -0.00442316
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C    1.66488206    1.26651181   -0.13822580   -0.00172663    0.01657070   -0.00347515
C    1.71581120   -1.24062412    0.13498757    0.00505768   -0.00701009   -0.00131461
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H    2.49870931   -1.99622478    0.27041352    0.01371053    0.00689671    0.00005042
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   15
   -420.53974675
H   -2.52161735    0.40620794    0.12527542    0.00819808   -0.01217843   -0.00576429
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O   -1.95906459   -1.24250877   -0.18687238    0.01175281    0.00629452   -0.00006570
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C   -0.80532737   -0.78100950   -0.08763218   -0.00887210   -0.01124479   -0.00926984
C    0.30078913    1.57340860   -0.17466651    0.02541037    0.00646598   -0.00556447
C    0.36623458   -1.60770560    0.03617391   -0.02083854   -0.00155824    0.00238419
C    1.66112537    1.26169360   -0.13453430   -0.00229946    0.00873315   -0.00191440
C    1.71815928   -1.24494628    0.13227147    0.01193271   -0.01168438    0.00003245
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H    2.49638995   -1.99612911    0.26082930    0.01012218    0.00967261   -0.00067320
C    2.30285493    0.04726632    0.07999804    0.00102969    0.00056454   -0.00113631
H    3.38663558    0.05341365    0.25723896    0.00623910   -0.00448560    0.00630377
   15
   -420.54058466
H   -2.52353547    0.40799276    0.11758024    0.00828877   -0.01013376   -0.00573619
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O   -1.95502521   -1.24044213   -0.18617915    0.01095443    0.00529225   -0.00024376
C   -0.77585404    0.71311336    0.03970165   -0.02931839   -0.00727250    0.00487281
C   -0.80142120   -0.77597705   -0.08286132   -0.00712084   -0.00785683   -0.00837346
C    0.30155786    1.57560082   -0.17646982    0.02516233    0.01523375   -0.00680807
C    0.36486277   -1.61125693    0.03837733   -0.02393741   -0.00599890    0.00308193
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   15
   -420.54114976
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   15
   -420.54164005
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   15
   -420.54239200
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   15
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   15
   -420.54169709
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   15
   -420.53992066
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   15
   -420.53879178
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   15
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   15
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   15
   -420.54018806
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   15
   -420.54137647
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   15
   -420.54281352
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   15
   -420.54328641
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C   -0.76437567   -0.74745077   -0.01166090   -0.00287408   -0.00141719    0.00999795
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C    1.65428194    1.25821775   -0.08905300   -0.01579342   -0.00270741   -0.00164672
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   15
   -420.54218011
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O   -1.89665554   -1.22099762   -0.16152575    0.03033902    0.01734078   -0.00545086
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C   -0.76280967   -0.74971609   -0.00874145   -0.00215595   -0.00721605    0.01018701
C    0.29102103    1.61278928   -0.16546515    0.01597498    0.00499193   -0.01537824
C    0.37079132   -1.59850596    0.04060605    0.00058884    0.01606709   -0.00225715
C    1.65884861    1.25932991   -0.08550135   -0.00365614    0.00471648   -0.00081826
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H    2.40531319   -2.10715082    0.16069252    0.00656229   -0.00617994    0.00118732
C    2.26546499    0.01665217    0.05209336   -0.01485896   -0.00407820    0.00499253
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   15
   -420.54048946
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O   -1.89475984   -1.22206712   -0.15794091    0.03402562    0.01770512   -0.00555502
C   -0.77203149    0.72218566    0.03638911   -0.01947651   -0.02894190    0.00102819
C   -0.76112229   -0.75154889   -0.00643782    0.00034533   -0.01223645    0.01032082
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C    1.66363613    1.26015964   -0.08190034    0.00841205    0.01145439    0.00004541
C    1.68858368   -1.27465833    0.08771856   -0.01194220   -0.00494086   -0.00122194
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H    2.34380390    2.07854407   -0.09186490   -0.01065889   -0.01456842    0.00332866
H    2.42028323   -2.09277638    0.15252276    0.00764658   -0.00284989    0.00094027
C    2.26697182    0.01335183    0.05101294   -0.01672531   -0.00485247    0.00617635
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   15
   -420.53950466
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O   -1.89439613   -1.22393433   -0.15410337    0.03457526    0.01658076   -0.00583414
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C   -0.75946392   -0.75264893   -0.00475826    0.00444162   -0.01581582    0.01042780
C    0.29194674    1.62064886   -0.15450602    0.01599867    0.01701580   -0.01650692
C    0.35913550   -1.59546187    0.03881796   -0.02472188    0.01739303   -0.00455085
C    1.66794583    1.26033147   -0.07830251    0.01451694    0.01147028    0.00100419
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H    2.42991014   -2.07648326    0.14368676    0.00606117    0.00266612    0.00049964
C    2.26946342    0.01034925    0.04956039   -0.01330258   -0.00646231    0.00708335
H    3.37116659   -0.03346725    0.02714602    0.00869356   -0.00846129   -0.00361147
   15
   -420.53936424
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O   -1.89558900   -1.22654885   -0.15000067    0.03190543    0.01413136   -0.00623242
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C   -0.75807894   -0.75280233   -0.00370913    0.00947953   -0.01743959    0.01048173
C    0.29092389    1.62325945   -0.14754495    0.01002394    0.02784041   -0.01660106
C    0.35516612   -1.59552081    0.03830384   -0.03367573    0.01536051   -0.00519848
C    1.67141829    1.25985290   -0.07476733    0.01283519    0.00322155    0.00233134
C    1.69482461   -1.27444923    0.08318004    0.00850930   -0.01029601   -0.00019911
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H    2.33952644    2.09816893   -0.11373701   -0.00878257   -0.00786665    0.00201995
H    2.43525121   -2.06212946    0.13449586    0.00316636    0.00845333    0.00001753
C    2.27273762    0.00774262    0.04768176   -0.00560054   -0.00907443    0.00753641
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   15
   -420.53933171
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O   -1.89821924   -1.22980046   -0.14561506    0.02651378    0.01062087   -0.00665932
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C   -0.75726719   -0.75191220   -0.00329329    0.01448169   -0.01684875    0.01040537
C    0.28930662    1.62419468   -0.13958261    0.00174368    0.03684661   -0.01613048
C    0.35320952   -1.59650702    0.03810211   -0.03788306    0.01294200   -0.00546106
C    1.67413465    1.25919463   -0.07137519    0.00714337   -0.00801502    0.00403744
C    1.69749809   -1.27350021    0.08094485    0.01566004   -0.01024681    0.00009531
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H    2.34814716    2.11880368   -0.12712311   -0.00042611    0.00413934    0.00061713
H    2.43826276   -2.05372403    0.12528410    0.00110444    0.01197080   -0.00033103
C    2.27634414    0.00568901    0.04534964    0.00326252   -0.01250266    0.00753772
H    3.35084342   -0.05552286    0.00029499   -0.00870489   -0.01012333   -0.00359594
   15
   -420.53973645
H   -2.51037555    0.34072038    0.14523014    0.01198353   -0.00339325    0.00231872
O   -2.01658949    1.21691933    0.15947143   -0.00946850    0.01148087    0.00377740
O   -1.90204560   -1.23353194   -0.14092759    0.01929375    0.00649983   -0.00700779
C   -0.77425043    0.73842135    0.03449271   -0.01614777   -0.01099106   -0.00058445
C   -0.75732597   -0.75001413   -0.00350560    0.01842074   -0.01407242    0.01009901
C    0.28758284    1.62294312   -0.13064926   -0.00637469    0.03764652   -0.01475442
C    0.35351631   -1.59827740    0.03822865   -0.03659010    0.01074620   -0.00533362
C    1.67641482    1.25900286   -0.06822714    0.00211631   -0.01578405    0.00571509
C    1.69925158   -1.27195171    0.07870509    0.01751296   -0.00625999    0.00016454
H   -0.04391601    2.63341808   -0.19408226   -0.00565376   -0.01836652    0.00191764
H    0.09656851   -2.64938474    0.06147657    0.00229332    0.00305706    0.00118413
H    2.35716371    2.13660773   -0.14094283    0.00656045    0.01383029   -0.00096770
H    2.44032458   -2.05369324    0.11629939    0.00153457    0.01147415   -0.00049997
C    2.27977145    0.00439294    0.04256287    0.00855298   -0.01618020    0.00729773
H    3.34656962   -0.05581449   -0.00919983   -0.01407249   -0.00965993   -0.00331599
   15
   -420.54145000
H   -2.51977946    0.34648795    0.13564456    0.01015563   -0.00218728    0.00226453
O   -2.01806027    1.21552778    0.15199623   -0.00908828    0.00712572    0.00355753
O   -1.90674440   -1.23755754   -0.13592278    0.01127781    0.00216219   -0.00718694
C   -0.77179501    0.74524573    0.03401369   -0.00745028   -0.00027142   -0.00144081
C   -0.75848976   -0.74727442   -0.00432700    0.02055820   -0.00942870    0.00946431
C    0.28623472    1.61947590   -0.12082936   -0.01265756    0.02663133   -0.01225120
C    0.35600991   -1.60069811    0.03867584   -0.03011702    0.00856355   -0.00482587
C    1.67855141    1.25973138   -0.06542213    0.00012193   -0.01683353    0.00688320
C    1.69997249   -1.27004053    0.07645593    0.01415469    0.00081441    0.00011754
H   -0.03183265    2.63923521   -0.19095984   -0.00558915   -0.01425332    0.00123696
H    0.08461017   -2.65220275    0.06171247    0.00001338    0.00070464    0.00116566
H    2.36169648    2.14480344   -0.15408477    0.00959733    0.01774998   -0.00225509
H    2.44114501   -2.06169936    0.10766885    0.00417306    0.00728388   -0.00057519
C    2.28271684    0.00407289    0.03933461    0.00700209   -0.01936443    0.00706866
H    3.35198277   -0.04918070   -0.01629661   -0.01217788   -0.00864862   -0.00319993
   15
   -420.54373814
H   -2.53635774    0.35391051    0.12443869    0.00607924   -0.00233602    0.00211902
O   -2.01912463    1.21381135    0.14435963   -0.00715879    0.00311744    0.00334414
O   -1.91195564   -1.24168164   -0.13059279    0.00342568   -0.00201518   -0.00711430
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C   -0.76088628   -0.74397094   -0.00571883    0.02060689   -0.00348000    0.00843937
C    0.28564473    1.61444037   -0.11027300   -0.01749339    0.00737571   -0.00887360
C    0.36030507   -1.60363318    0.03941319   -0.01974095    0.00563055   -0.00396858
C    1.68066199    1.26144172   -0.06302915    0.00182676   -0.01068251    0.00720366
C    1.69985282   -1.26818058    0.07419950    0.00772282    0.00827597    0.00009664
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H    0.07265813   -2.65550551    0.06111449   -0.00254714   -0.00190800    0.00105974
H    2.35959811    2.14061867   -0.16564181    0.00797302    0.01497595   -0.00287855
H    2.43894426   -2.07485699    0.09945474    0.00710085    0.00154946   -0.00068275
C    2.28526734    0.00491899    0.03567872   -0.00008750   -0.02154905    0.00685259
H    3.36579452   -0.03635401   -0.02107999   -0.00423099   -0.00707631   -0.00325484
   15
   -420.54505731
H   -2.55724245    0.36305369    0.11171422    0.00089349   -0.00316411    0.00186863
O   -2.01986818    1.21195295    0.13657130   -0.00417053   -0.00083283    0.00312698
O   -1.91732577   -1.24571615   -0.12494114   -0.00351511   -0.00566557   -0.00673506
C   -0.76618511    0.75824847    0.03336271    0.01342890    0.02186608   -0.00273088
C   -0.76451933   -0.74046010   -0.00761905    0.01871609    0.00308769    0.00701121
C    0.28611045    1.60895985   -0.09918076   -0.02177373   -0.01222422   -0.00531349
C    0.36578393   -1.60690160    0.04038909   -0.00736454    0.00124982   -0.00281670
C    1.68264449    1.26376716   -0.06106669    0.00698515    0.00155550    0.00651261
C    1.69926832   -1.26680846    0.07193666    0.00080471    0.01324171    0.00018191
H    0.00517795    2.67268856   -0.18632116   -0.00668243    0.00861507   -0.00165536
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H    2.35201990    2.12602100   -0.17517873    0.00202421    0.00606420   -0.00261541
H    2.43173683   -2.08918743    0.09173786    0.00830105   -0.00325710   -0.00088036
C    2.28782683    0.00706099    0.03160955   -0.00797082   -0.02229638    0.00641187
H    3.38257245   -0.01847379   -0.02352553    0.00509397   -0.00488021   -0.00323206
   15
   -420.54500427
H   -2.57877361    0.37442613    0.09765014   -0.00394219   -0.00341588    0.00150598
O   -2.02042273    1.21013296    0.12864080   -0.00107922   -0.00530965    0.00290831
O   -1.92254199   -1.24949596   -0.11898498   -0.00898300   -0.00856379   -0.00605194
C   -0.76427214    0.76310305    0.03326672    0.02145218    0.03030368   -0.00276769
C   -0.76927661   -0.73713545   -0.00994148    0.01528002    0.00954642    0.00520654
C    0.28788807    1.60418727   -0.08776483   -0.02503625   -0.02568970   -0.00223908
C    0.37170792   -1.61023714    0.04153436    0.00504132   -0.00476872   -0.00146550
C    1.68419620    1.26598438   -0.05949373    0.01367889    0.01643141    0.00501554
C    1.69862797   -1.26621529    0.06966226   -0.00471303    0.01391722    0.00037211
H    0.03071883    2.68457509   -0.18278185   -0.00503205    0.01557065   -0.00291187
H    0.05574111   -2.65717624    0.05779681   -0.00618072   -0.00300643    0.00056452
H    2.34312840    2.10725939   -0.18287224   -0.00622180   -0.00610031   -0.00164204
H    2.41872405   -2.10132616    0.08465861    0.00671000   -0.00550176   -0.00114400
C    2.29085033    0.01054186    0.02715483   -0.01238324   -0.02112008    0.00553386
H    3.39587141    0.00289613   -0.02366184    0.01137613   -0.00227841   -0.00290895
   15
   -420.54455893
H   -2.59757654    0.38817181    0.08250539   -0.00695454   -0.00221782    0.00108282
O   -2.02092468    1.20855767    0.12057838    0.00108599   -0.01085551    0.00264368
O   -1.92735754   -1.25289087   -0.11275530   -0.01260552   -0.01048677   -0.00508204
C   -0.76363586    0.76614275    0.03333544    0.02536009    0.03519985   -0.00228215
C   -0.77495267   -0.73438450   -0.01257735    0.01075978    0.01528104    0.00310546
C    0.29116782    1.60092053   -0.07620867   -0.02590475   -0.02969766   -0.00011204
C    0.37733525   -1.61327869    0.04276781    0.01582274   -0.01187102   -0.00002313
C    1.68493517    1.26722769   -0.05822438    0.01742064    0.02728055    0.00360597
C    1.69826077   -1.26644031    0.06736501   -0.00789726    0.00998036    0.00062918
H    0.05978217    2.68567050   -0.17718253   -0.00171730    0.01553790   -0.00355705
H    0.05336377   -2.65479044    0.05542907   -0.00660175   -0.00087245    0.00022938
H    2.33858467    2.09272252   -0.18937968   -0.01217983   -0.01541456   -0.00076755
H    2.40104302   -2.10968610    0.07840402    0.00243134   -0.00471225   -0.00142065
C    2.29459521    0.01528790    0.02236789   -0.01139398   -0.01752810    0.00417655
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   15
   -420.54469347
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O   -2.02146998    1.20747859    0.11239636    0.00169538   -0.01727787    0.00229332
O   -1.93160894   -1.25581389   -0.10629590   -0.01414338   -0.01137515   -0.00389542
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C   -0.78127582   -0.73255166   -0.01540012    0.00551064    0.01981940    0.00081777
C    0.29599640    1.59939896   -0.06464034   -0.02323814   -0.02364036    0.00094719
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C    1.68465936    1.26687553   -0.05717960    0.01367072    0.02762376    0.00341649
C    1.69835972   -1.26725154    0.06502960   -0.00883177    0.00261031    0.00090574
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C    2.29900301    0.02108098    0.01733009   -0.00521413   -0.01136390    0.00247556
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   15
   -420.54479080
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O   -1.93522667   -1.25822470   -0.09966026   -0.01354244   -0.01121449   -0.00257688
C   -0.76683479    0.76585492    0.03382576    0.01907627    0.03262626   -0.00021133
C   -0.78793035   -0.73190977   -0.01827206   -0.00013355    0.02283440   -0.00152765
C    0.30221160    1.59926740   -0.05312503   -0.01682668   -0.00984798    0.00116292
C    0.38527163   -1.61679533    0.04515415    0.02891015   -0.02404416    0.00270341
C    1.68359304    1.26490593   -0.05634847    0.00295132    0.01764985    0.00457156
C    1.69898670   -1.26821616    0.06263951   -0.00859378   -0.00564195    0.00116105
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H    2.35380291    2.09564045   -0.20026155   -0.00348441   -0.00769289   -0.00278787
H    2.36482937   -2.11875724    0.06911987   -0.00888486    0.00178453   -0.00179715
C    2.30370963    0.02755029    0.01214305    0.00416762   -0.00302179    0.00067751
H    3.38961404    0.06952890   -0.01373601   -0.00061520    0.00438647   -0.00031834
   15
   -420.54398788
H   -2.62466492    0.42942604    0.03349227   -0.00362125    0.00795280    0.00005025
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O   -1.93823755   -1.26013038   -0.09290783   -0.01093607   -0.01005749   -0.00121566
C   -0.77030036    0.76267739    0.03412437    0.01091505    0.02624446    0.00093682
C   -0.79457597   -0.73264045   -0.02105199   -0.00588819    0.02412352   -0.00379134
C    0.30942849    1.59972329   -0.04167900   -0.00720414    0.00542305    0.00118367
C    0.38679124   -1.61655054    0.04614284    0.03074136   -0.02596442    0.00384517
C    1.68235598    1.26188863   -0.05579542   -0.00931461    0.00362091    0.00604838
C    1.70013521   -1.26885080    0.06017953   -0.00868850   -0.01172850    0.00135512
H    0.14143695    2.64747283   -0.14585140    0.01088201   -0.01460467   -0.00211975
H    0.07283225   -2.65188682    0.04830129   -0.00412008    0.00472701   -0.00070318
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H    2.35418559   -2.12386650    0.06635854   -0.01173450    0.00296388   -0.00184589
C    2.30816788    0.03419591    0.00691413    0.01275139    0.00658066   -0.00094886
H    3.38152612    0.08726991   -0.00903560   -0.00915180    0.00547010    0.00053362
   15
   -420.54321609
H   -2.62645628    0.43519815    0.01679474   -0.00230130    0.00886867   -0.00038900
O   -2.02338060    1.20995284    0.08730054   -0.00075500   -0.02812844    0.00128708
O   -1.94075851   -1.26158313   -0.08610023   -0.00666430   -0.00803257    0.00011371
C   -0.77442107    0.75792168    0.03436734    0.00173412    0.01803487    0.00189476
C   -0.80086633   -0.73482117   -0.02360367   -0.01141610    0.02358174   -0.00584737
C    0.31706962    1.59988584   -0.03030776    0.00470316    0.01400277    0.00182128
C    0.38646745   -1.61475464    0.04689994    0.02940630   -0.02413971    0.00478518
C    1.68166415    1.25864229   -0.05560436   -0.01808298   -0.00858142    0.00679308
C    1.70181467   -1.26879664    0.05763804   -0.00979169   -0.01385566    0.00145960
H    0.15685145    2.64445389   -0.13165816    0.01241468   -0.01788965   -0.00207285
H    0.08623891   -2.65670044    0.04666038   -0.00318152    0.00265163   -0.00093654
H    2.37747710    2.11831152   -0.20282681    0.01216660    0.01044564   -0.00601092
H    2.35176906   -2.13089246    0.06492037   -0.01094356    0.00062311   -0.00179247
C    2.31188361    0.04044328    0.00174090    0.01573770    0.01622695   -0.00224832
H    3.37974020    0.10109457   -0.00470670   -0.01296425    0.00616028    0.00117838
   15
   -420.54353235
H   -2.62647966    0.43476968    0.00039230   -0.00273474    0.00674847   -0.00107307
O   -2.02399157    1.21321859    0.07880185    0.00017429   -0.02408793    0.00142740
O   -1.94298121   -1.26267370   -0.07929738   -0.00129740   -0.00540574    0.00134005
C   -0.77864943    0.75207821    0.03449710   -0.00690897    0.00921352    0.00257941
C   -0.80646952   -0.73841898   -0.02580319   -0.01627342    0.02121603   -0.00759893
C    0.32442220    1.59925434   -0.01905119    0.01739324    0.01246658    0.00331932
C    0.38438159   -1.61151377    0.04736881    0.02485214   -0.01940927    0.00548820
C    1.68203676    1.25589079   -0.05581807   -0.02106722   -0.01602859    0.00634736
C    1.70408725   -1.26792123    0.05500883   -0.01104690   -0.01271642    0.00145499
H    0.16347166    2.65366521   -0.11591933    0.01156719   -0.01066114   -0.00285860
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H    2.37885145    2.12149633   -0.19815511    0.01349744    0.01237972   -0.00609442
H    2.35705955   -2.13821811    0.06476681   -0.00731003   -0.00416884   -0.00163651
C    2.31468751    0.04571495   -0.00329789    0.01099087    0.02474894   -0.00323871
H    3.38685005    0.11049313   -0.00121892   -0.00964042    0.00668052    0.00169849
   15
   -420.54426200
H   -2.62447184    0.42960428   -0.01522727   -0.00411979    0.00265448   -0.00194718
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O   -1.94514619   -1.26352008   -0.07255470    0.00437770   -0.00253073    0.00240984
C   -0.78246800    0.74567594    0.03447218   -0.01397608    0.00068286    0.00299775
C   -0.81109497   -0.74329155   -0.02754505   -0.01988194    0.01718159   -0.00896807
C    0.33072937    1.59789786   -0.00799675    0.02878240    0.00522373    0.00510253
C    0.38080836   -1.60710481    0.04750711    0.01720295   -0.01348140    0.00591788
C    1.68365188    1.25407850   -0.05640943   -0.01777768   -0.01747562    0.00466691
C    1.70702050   -1.26628135    0.05229216   -0.01085360   -0.01061907    0.00134515
H    0.16185867    2.67021541   -0.09810810    0.00910211    0.00214906   -0.00387335
H    0.11918393   -2.66925102    0.04552656   -0.00082132   -0.00456205   -0.00125864
H    2.37082066    2.11613003   -0.18916272    0.00958629    0.00822715   -0.00502720
H    2.36756222   -2.14254859    0.06578632   -0.00280089   -0.00888144   -0.00139209
C    2.31685213    0.04950009   -0.00814207    0.00127553    0.03123733   -0.00397038
H    3.40060624    0.11509357    0.00104679   -0.00147431    0.00699627    0.00219300
   15
   -420.54446404
H   -2.61953328    0.42252666   -0.02944685   -0.00491796   -0.00145927   -0.00279291
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O   -1.94750747   -1.26425097   -0.06592058    0.00943308    0.00017300    0.00327558
C   -0.78545182    0.73922736    0.03426697   -0.01895817   -0.00686023    0.00321336
C   -0.81452735   -0.74919645   -0.02874658   -0.02162026    0.01179375   -0.00991765
C    0.33531239    1.59621919    0.00275108    0.03688574   -0.00092369    0.00650941
C    0.37620754   -1.60187834    0.04728893    0.00700760   -0.00795769    0.00605782
C    1.68631448    1.25329182   -0.05727765   -0.00905000   -0.01281259    0.00197082
C    1.71059685   -1.26399350    0.04949446   -0.00804615   -0.00963060    0.00116956
H    0.15371593    2.68532629   -0.07754119    0.00617790    0.01333816   -0.00439729
H    0.13699208   -2.67198445    0.04626510    0.00100445   -0.00657340   -0.00132685
H    2.35616064    2.10515201   -0.17659836    0.00127503   -0.00109819   -0.00315001
H    2.38013916   -2.14062973    0.06780553    0.00077901   -0.01120894   -0.00110212
C    2.31893776    0.05141003   -0.01274763   -0.00814466    0.03492879   -0.00439320
H    3.41542531    0.11468325    0.00173557    0.00674375    0.00687084    0.00264229
   15
   -420.54425590
H   -2.61115957    0.41641180   -0.04167067   -0.00401361   -0.00412227   -0.00337650
O   -2.02602823    1.22816908    0.05283975   -0.00065334   -0.00123288    0.00244689
O   -1.95029097   -1.26498772   -0.05943420    0.01295993    0.00234266    0.00390902
C   -0.78730052    0.73318581    0.03386797   -0.02166030   -0.01283162    0.00331474
C   -0.81666412   -0.75580997   -0.02935050   -0.02095051    0.00547514   -0.01042498
C    0.33768674    1.59457053    0.01310838    0.04052463   -0.00203655    0.00730120
C    0.37119062   -1.59616342    0.04670588   -0.00468793   -0.00379470    0.00590543
C    1.68951197    1.25326159   -0.05826311    0.00202653   -0.00470606   -0.00107168
C    1.71464566   -1.26111282    0.04662610   -0.00241437   -0.01066735    0.00097979
H    0.14109691    2.69120040   -0.05385234    0.00365910    0.01853741   -0.00419620
H    0.15405827   -2.67012964    0.04795525    0.00314010   -0.00624873   -0.00133285
H    2.34067200    2.09507242   -0.16177330   -0.00835210   -0.01208689   -0.00116131
H    2.39227522   -2.13084706    0.07061921    0.00239466   -0.01006869   -0.00082729
C    2.32149356    0.05122463   -0.01708953   -0.01320890    0.03519721   -0.00440397
H    3.42561565    0.10935811    0.00052999    0.01125324    0.00619496    0.00294811
   15
   -420.54465601
H   -2.60000498    0.41313743   -0.05148725   -0.00132087   -0.00467321   -0.00356416
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O   -1.95365413   -1.26582772   -0.05312424    0.01427426    0.00370442    0.00429756
C   -0.78785074    0.72790981    0.03326864   -0.02205449   -0.01671973    0.00339027
C   -0.81754752   -0.76275259   -0.02932613   -0.01757658   -0.00126789   -0.01049622
C    0.33763448    1.59301454    0.02302668    0.03930834    0.00278705    0.00758664
C    0.36645773   -1.59021156    0.04576698   -0.01646807   -0.00106911    0.00549736
C    1.69260354    1.25352992   -0.05918657    0.00986307    0.00061603   -0.00357846
C    1.71882947   -1.25757840    0.04369835    0.00537755   -0.01335679    0.00081746
H    0.12577419    2.68416920   -0.02717582    0.00211625    0.01644994   -0.00340440
H    0.16886656   -2.66391095    0.05060227    0.00523481   -0.00372512   -0.00129020
H    2.33096324    2.09339615   -0.14606338   -0.01402908   -0.01810093    0.00004249
H    2.40281348   -2.11401312    0.07403303    0.00192410   -0.00563042   -0.00062507
C    2.32481779    0.04892928   -0.02116744   -0.01227939    0.03172671   -0.00395019
H    3.42802075    0.09960075   -0.00278516    0.01048029    0.00502569    0.00303343
   15
   -420.54583601
H   -2.58796352    0.41311976   -0.05876006    0.00247786   -0.00344082   -0.00338953
O   -2.02720218    1.23911127    0.03502141   -0.01031889    0.00754797    0.00165513
O   -1.95765558   -1.26683228   -0.04700844    0.01311185    0.00415006    0.00445352
C   -0.78707880    0.72363278    0.03246401   -0.02011124   -0.01816979    0.00352328
C   -0.81738015   -0.76961888   -0.02866898   -0.01177715   -0.00793761   -0.01016348
C    0.33522809    1.59126450    0.03248742    0.03347168    0.01256136    0.00763179
C    0.36271345   -1.58419155    0.04449662   -0.02677803    0.00095357    0.00488202
C    1.69513692    1.25380227   -0.05989820    0.01036750   -0.00189810   -0.00523070
C    1.72268451   -1.25323608    0.04072117    0.01380555   -0.01606798    0.00066530
H    0.10885397    2.66569680    0.00193549    0.00175646    0.00772499   -0.00233686
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H    2.33087690    2.10413571   -0.13032062   -0.01197274   -0.01415424    0.00024103
H    2.41204481   -2.09323738    0.07790281    0.00016696    0.00064670   -0.00051000
C    2.32885636    0.04473330   -0.02500854   -0.00578444    0.02462968   -0.00308108
H    3.42318010    0.08624428   -0.00827206    0.00473003    0.00352905    0.00290589
   15
   -420.54651783
H   -2.57769692    0.41553517   -0.06360366    0.00612555   -0.00148205   -0.00302398
O   -2.02720857    1.24415408    0.02598802   -0.01577187    0.00946703    0.00080465
O   -1.96224331   -1.26802194   -0.04109392    0.00966504    0.00374340    0.00439958
C   -0.78510240    0.72044161    0.03144570   -0.01580047   -0.01701599    0.00377836
C   -0.81650870   -0.77600793   -0.02739894   -0.00434799   -0.01403543   -0.00947359
C    0.33081616    1.58874610    0.04148632    0.02390879    0.02394482    0.00772980
C    0.36057341   -1.57823163    0.04293177   -0.03408953    0.00345735    0.00410490
C    1.69707218    1.25421914   -0.06029498    0.00518714   -0.01011676   -0.00657397
C    1.72571282   -1.24793450    0.03770408    0.02059837   -0.01631239    0.00043715
H    0.09061016    2.64188405    0.03273790    0.00229479   -0.00455065   -0.00139420
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H    2.33905711    2.12461093   -0.11471950   -0.00414086   -0.00272143    0.00003351
H    2.42113481   -2.07289165    0.08214070   -0.00121349    0.00630001   -0.00040679
C    2.33322877    0.03906371   -0.02866475    0.00380259    0.01434995   -0.00192583
H    3.41510139    0.07035355   -0.01584339   -0.00373600    0.00192384    0.00264323
   15
   -420.54603208
H   -2.57174804    0.41905953   -0.06626851    0.00821914   -0.00020138   -0.00267132
O   -2.02650463    1.24876838    0.01691837   -0.01980778    0.01111197   -0.00011224
O   -1.96726313   -1.26937893   -0.03537838    0.00451115    0.00266748    0.00417472
C   -0.78218207    0.71826700    0.03019805   -0.00918567   -0.01334700    0.00419659
C   -0.81537642   -0.78155331   -0.02555739    0.00350887   -0.01908936   -0.00849701
C    0.32496815    1.58480207    0.05001686    0.01243706    0.03078735    0.00797872
C    0.36047374   -1.57248817    0.04111940   -0.03716871    0.00739717    0.00317965
C    1.69869686    1.25524261   -0.06029294   -0.00076667   -0.01745125   -0.00814045
C    1.72751478   -1.24167025    0.03466171    0.02360043   -0.01190434   -0.00002185
H    0.07072955    2.62120803    0.06456538    0.00255888   -0.01432734   -0.00077396
H    0.18700913   -2.63931683    0.06388670    0.00705569    0.00411783   -0.00095905
H    2.35019335    2.14702517   -0.09916182    0.00424898    0.00919302    0.00013238
H    2.43096849   -2.05689859    0.08666367   -0.00048755    0.00893990   -0.00016890
C    2.33737817    0.03253831   -0.03220506    0.01198318    0.00167086   -0.00065628
H    3.40962348    0.05307095   -0.02531670   -0.01068550    0.00042093    0.00235215
   15
   -420.54537269
H   -2.57157307    0.42283209   -0.06700161    0.00793231   -0.00058986   -0.00244602
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   15
   -420.54522064
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   15
   -420.54477228
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O   -1.98242832   -1.27389620   -0.01929724   -0.01359056   -0.00192041    0.00285521
C   -0.77225114    0.71506464    0.02478555    0.01799394    0.00674850    0.00603577
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C    0.30545831    1.56361078    0.07276919   -0.01615063   -0.00471543    0.00569348
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C    1.70428904    1.26448671   -0.05690060    0.00167676   -0.00275278   -0.01301541
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   15
   -420.54359595
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O   -1.98661077   -1.27532125   -0.01422571   -0.01835977   -0.00310556    0.00229917
C   -0.77036373    0.71376430    0.02230240    0.02486269    0.01291539    0.00645023
C   -0.81646148   -0.79067014   -0.01381940    0.01777572   -0.02218580   -0.00301751
C    0.30021686    1.55577314    0.07956060   -0.02315395   -0.01889051    0.00388984
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C    1.70622694    1.26864206   -0.05431634    0.00970521    0.01306617   -0.01372588
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H    2.34522506    2.14624611   -0.04200761   -0.00131537   -0.00087939    0.00216833
H    2.44753852   -2.04185774    0.10190280    0.01111806   -0.00047082    0.00214163
C    2.34747149    0.01352672   -0.04673072   -0.00427887   -0.04411224    0.00406572
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   15
   -420.54240621
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O   -1.98996540   -1.27660703   -0.00925841   -0.02172940   -0.00386818    0.00172342
C   -0.76996086    0.71169407    0.01943089    0.02793342    0.01685548    0.00651942
C   -0.81921596   -0.78944899   -0.01020628    0.01547165   -0.01851104   -0.00143031
C    0.29636760    1.54903878    0.08611470   -0.02850736   -0.02536021    0.00251070
C    0.38699950   -1.55618258    0.03052574    0.01029955    0.01927130   -0.00248448
C    1.70757887    1.27201178   -0.05090549    0.01740238    0.02778685   -0.01374841
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C    2.34964952    0.01401857   -0.05081056   -0.00548786   -0.04668225    0.00461005
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   15
   -420.54233464
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O   -1.99234049   -1.27771909   -0.00436933   -0.02339158   -0.00416027    0.00115377
C   -0.77122377    0.70861967    0.01616741    0.02633348    0.01776956    0.00612510
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C    0.39361822   -1.55647261    0.02858412    0.02369902    0.01394533   -0.00341838
C    1.70790705    1.27374666   -0.04666539    0.01950524    0.03357666   -0.01332452
C    1.71646481   -1.20944741    0.01812897   -0.00306058    0.02248839   -0.00257833
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C    2.35213046    0.01730728   -0.05516607   -0.00100019   -0.04401034    0.00453296
H    3.45239679   -0.02581127   -0.10719552    0.00985587   -0.00629577   -0.00058664
   15
   -420.54320165
H   -2.62260122    0.49291242   -0.04114063   -0.00023061    0.00128166    0.00005694
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O   -1.99366138   -1.27864417    0.00046727   -0.02315251   -0.00398070    0.00061663
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C   -0.82727324   -0.78396670   -0.00281769    0.00656085   -0.00760288    0.00172629
C    0.29397919    1.53988304    0.09877768   -0.03149753   -0.01218542    0.00282179
C    0.39881623   -1.55759993    0.02684870    0.03459776    0.00746870   -0.00425074
C    1.70709692    1.27351634   -0.04162014    0.01367813    0.02675348   -0.01274076
C    1.71366304   -1.20851260    0.01593200   -0.00566695    0.01488884   -0.00162406
H   -0.01532899    2.57513614    0.25921425   -0.00636853   -0.00048626    0.00506285
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H    2.39611215   -2.04407391    0.09997361   -0.00222723    0.00623883    0.00198017
C    2.35464964    0.02323358   -0.05979240    0.00784640   -0.03653364    0.00379485
H    3.44314309   -0.02722226   -0.12155398    0.00287954   -0.00672824   -0.00061996
   15
   -420.54361696
H   -2.62944340    0.51116586   -0.03467996    0.00149690    0.00456911    0.00046654
O   -1.99261158    1.26291635   -0.05241434   -0.00087655   -0.00350234   -0.00518641
O   -1.99393901   -1.27939042    0.00527568   -0.02098705   -0.00333914    0.00013578
C   -0.77809467    0.69943778    0.00859275    0.01069214    0.01013066    0.00377951
C   -0.83204243   -0.78036176    0.00076774    0.00101079   -0.00106737    0.00311868
C    0.29561782    1.53669107    0.10486841   -0.02847320    0.00211318    0.00435744
C    0.40193980   -1.55918253    0.02537014    0.04191952    0.00172053   -0.00504933
C    1.70548098    1.27170856   -0.03580512    0.00361398    0.01193346   -0.01199244
C    1.71120476   -1.20847890    0.01383270   -0.00836658    0.00740685   -0.00056257
H   -0.00582996    2.55394441    0.27422126   -0.00251810   -0.01211982    0.00356770
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H    2.34981515    2.14970995   -0.00626049    0.00208755   -0.00052421    0.00217334
H    2.37673319   -2.05078038    0.09628412   -0.00687468    0.00753880    0.00184487
C    2.35668999    0.03135107   -0.06464577    0.01752403   -0.02535308    0.00257093
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   15
   -420.54333792
H   -2.63725877    0.52625946   -0.02855204    0.00152597    0.00570028    0.00083210
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O   -1.99327097   -1.27998662    0.01007768   -0.01707404   -0.00228433   -0.00027506
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C   -0.83687218   -0.77669303    0.00416584   -0.00466283    0.00561997    0.00425636
C    0.29896029    1.53338990    0.11069719   -0.02186235    0.01273710    0.00558120
C    0.40254916   -1.56088075    0.02419717    0.04500398   -0.00174067   -0.00589341
C    1.70363929    1.26918046   -0.02926657   -0.00514587   -0.00337572   -0.01090169
C    1.70925546   -1.20890870    0.01176815   -0.01160303    0.00289907    0.00036861
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H    2.36212115   -2.06269696    0.09124890   -0.00854849    0.00527791    0.00198390
C    2.35769121    0.04098972   -0.06965415    0.02311307   -0.01173704    0.00126928
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   15
   -420.54336599
H   -2.64603721    0.53739663   -0.02302922   -0.00065182    0.00443288    0.00129170
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O   -1.99183339   -1.28048030    0.01489185   -0.01179238   -0.00090711   -0.00060347
C   -0.78741196    0.68796654    0.00013492   -0.01187457   -0.00534428   -0.00006521
C   -0.84142160   -0.77336216    0.00730814   -0.01001661    0.01189425    0.00507542
C    0.30360670    1.52936806    0.11619562   -0.01170207    0.01382012    0.00543071
C    0.40046011   -1.56248728    0.02338083    0.04340412   -0.00253202   -0.00676590
C    1.70208609    1.26683444   -0.02207075   -0.00944624   -0.01441410   -0.00941170
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C    2.35733407    0.05133266   -0.07474130    0.02104721    0.00298078    0.00035543
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   15
   -420.54365277
H   -2.65429136    0.54542239   -0.01844536   -0.00382716    0.00196251    0.00187298
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O   -1.98986384   -1.28093402    0.01973307   -0.00569407    0.00070205   -0.00084413
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C   -0.84536859   -0.77074566    0.01014513   -0.01463677    0.01713962    0.00556344
C    0.30895097    1.52455481    0.12137219    0.00033470    0.00633107    0.00402473
C    0.39577010   -1.56394961    0.02297310    0.03701680   -0.00157859   -0.00751893
C    1.70107798    1.26532843   -0.01430722   -0.00853234   -0.01912439   -0.00762110
C    1.70762851   -1.21027662    0.00752613   -0.01554619    0.00255937    0.00196769
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H    2.35308531    2.17314226    0.00484535    0.01188109    0.01320008    0.00134728
H    2.35008789   -2.09356211    0.07661989   -0.00486182   -0.00646967    0.00263647
C    2.35573858    0.06149745   -0.07985272    0.01227241    0.01726367   -0.00002636
H    3.43202455    0.01479357   -0.17587450   -0.00361609   -0.00543781   -0.00095835
   15
   -420.54336810
H   -2.65984077    0.55199574   -0.01520931   -0.00618814    0.00011852    0.00242355
O   -1.97129912    1.26548322   -0.08228444    0.02393826   -0.00696361   -0.00480763
O   -1.98763654   -1.28141960    0.02461226    0.00055006    0.00231375   -0.00099602
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C   -0.84843615   -0.76915717    0.01264720   -0.01805927    0.02070109    0.00574575
C    0.31427947    1.51937070    0.12630606    0.01151641   -0.00366498    0.00247476
C    0.38886340   -1.56531768    0.02301854    0.02629141   -0.00037999   -0.00795157
C    1.70056193    1.26494289   -0.00608354   -0.00290520   -0.01668169   -0.00568405
C    1.70817428   -1.21117269    0.00525026   -0.01334085    0.00261614    0.00294032
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H    0.17608378   -2.63484505    0.11559620    0.00019864   -0.00379546    0.00236710
H    2.33739377    2.16272630    0.00616740    0.00560385    0.00513480    0.00064260
H    2.35021173   -2.10435487    0.06658206   -0.00271396   -0.01101204    0.00271469
C    2.35341107    0.07062895   -0.08496389    0.00146342    0.02937952   -0.00015231
H    3.44178528    0.03604634   -0.18840389    0.00463868   -0.00418814   -0.00174950
   15
   -420.54229551
H   -2.66106665    0.55837657   -0.01370744   -0.00637933    0.00001591    0.00278140
O   -1.96799688    1.26698161   -0.08920069    0.02520923   -0.00690354   -0.00469323
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   15
   -420.54134557
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   15
   -420.54138438
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   15
   -420.54189825
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   15
   -420.54173653
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   15
   -420.54113922
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   15
   -420.54106858
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   15
   -420.54135208
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   15
   -420.54130560
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   15
   -420.54098684
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   15
   -420.54115735
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   15
   -420.54220561
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O   -1.98799375   -1.29627391    0.08373854   -0.01381346   -0.00737841    0.00488963
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C    2.32117068    0.05779694   -0.12496073   -0.00031509   -0.02315267   -0.01117359
H    3.40610351    0.09425510   -0.27120743    0.00517044    0.00422551   -0.00165985
   15
   -420.54306135
H   -2.57372876    0.51603976   -0.14252092    0.00798307    0.00065675    0.00028422
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O   -1.98785685   -1.29681092    0.08799079   -0.01525938   -0.00767794    0.00547471
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   15
   -420.54276448
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   15
   -420.54201210
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   15
   -420.54175587
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   15
   -420.54179586
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   15
   -420.54161051
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   15
   -420.54129341
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   15
   -420.54158408
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   15
   -420.54253819
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   15
   -420.54285613
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   15
   -420.54212344
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   15
   -420.54126302
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O   -1.95694396   -1.28570387    0.11786081    0.00856354   -0.00042940    0.00185198
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H    2.37527573   -2.06392466   -0.27260439   -0.00240606    0.00143125    0.00013132
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   15
   -420.54097437
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O   -1.95439036   -1.28406846    0.11947269    0.00862548   -0.00066866    0.00109744
C   -0.75202254    0.71267823   -0.00632195    0.00945527    0.00336033    0.00543349
C   -0.81241268   -0.79080202    0.07492652   -0.00145530   -0.00831393    0.00052749
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   15
   -420.54094234
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   15
   -420.54077187
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   15
   -420.54070061
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   15
   -420.54130153
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   15
   -420.54214184
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   15
   -420.54200534
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   15
   -420.54092515
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   15
   -420.53998818
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O   -1.94258225   -1.26676688    0.13292282   -0.00437572   -0.00926542   -0.00272149
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C    1.66469307    1.25568106    0.15127858   -0.02420428   -0.03335834   -0.00414727
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   15
   -420.53970131
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   15
   -420.53982007
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C    1.66513886    1.25055500    0.15559517   -0.01305419   -0.02913674   -0.00205332
C    1.68116020   -1.24732394   -0.19880437   -0.00576209    0.00483429   -0.00905345
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   15
   -420.54012038
H   -2.49916440    0.36901531   -0.10923945    0.01170257   -0.00416464    0.00423559
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O   -1.93709439   -1.25504957    0.13956120   -0.00713397   -0.01013411   -0.00347355
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C   -0.77998160   -0.74516178    0.11942679    0.00314947    0.01303021    0.00890816
C    0.31369757    1.60298084    0.12677853    0.02573355   -0.00327166    0.00403666
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C    2.27347922    0.05084378   -0.05563798   -0.01679056    0.03337378    0.00217085
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   15
   -420.54079397
H   -2.51090883    0.37569685   -0.10333347    0.01033632   -0.00168041    0.00396229
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O   -1.93465348   -1.25022041    0.14207498   -0.00655209   -0.00906039   -0.00364982
C   -0.75828005    0.74035726   -0.00888974   -0.00920206    0.00527546   -0.00088060
C   -0.77770749   -0.74016352    0.12049943    0.00457431    0.01733062    0.00860309
C    0.30742864    1.60120308    0.12553690    0.01515025   -0.00667622    0.00485708
C    0.37634007   -1.61551009    0.00954291    0.01196545   -0.01297458    0.00385893
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   15
   -420.54201664
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   15
   -420.54291345
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   15
   -420.54243245
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C   -0.76155720    0.73948560   -0.01310272   -0.00042781    0.01408225   -0.00335742
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C    1.67143257    1.25475818    0.16583823   -0.00611032   -0.00018071    0.00460014
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   15
   -420.54111470
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C   -0.77185420   -0.73185905    0.11983616    0.00578259    0.01918506    0.00674285
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   15
   -420.54004934
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C    2.27816042    0.00874753   -0.03382506   -0.00744328   -0.02951929   -0.00711127
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   15
   -420.53940632
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C    0.27841471    1.59428183    0.11169926   -0.03835860   -0.01049932    0.00546926
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C    2.27974413    0.00393263   -0.02921257   -0.01247132   -0.03698940   -0.00762428
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   15
   -420.53900843
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C   -0.77098209   -0.73738168    0.11496404    0.00237476    0.00598341    0.00495969
C    0.28025764    1.59382741    0.10831282   -0.03388969   -0.01513668    0.00609397
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   15
   -420.53883950
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O   -1.91564726   -1.20820136    0.16850508    0.02262794    0.02105059   -0.00410645
C   -0.76727007    0.72327405   -0.01614891   -0.00092775   -0.00324754   -0.00268069
C   -0.77108272   -0.74034719    0.11269168    0.00113220    0.00067379    0.00438096
C    0.28413582    1.59425791    0.10455941   -0.02654632   -0.01382423    0.00642120
C    0.36852725   -1.57837074   -0.03263955   -0.00599311    0.01506929    0.01022922
C    1.68197663    1.25545578    0.16895967    0.01621504    0.03011629    0.00833542
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C    2.28519689    0.00115840   -0.01862365   -0.01069590   -0.03921333   -0.00667286
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   15
   -420.53946053
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O   -1.91595017   -1.20519010    0.17264040    0.02478939    0.02408501   -0.00389595
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C    0.36950055   -1.57466150   -0.04059595   -0.00224171    0.01845821    0.00934559
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C    1.67674026   -1.24838808   -0.17830443   -0.02363714   -0.00491955    0.00000166
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C    2.28895894    0.00333035   -0.01270423   -0.00397237   -0.03331958   -0.00530833
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   15
   -420.54096036
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C   -0.77144691   -0.74611022    0.10738460    0.00022177   -0.00837320    0.00332040
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C    0.37060869   -1.57205847   -0.04911524    0.00166832    0.01983599    0.00801212
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C    1.67801715   -1.25038050   -0.17522119   -0.02229308   -0.01434589   -0.00135199
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C    2.29295630    0.00749759   -0.00646616    0.00365031   -0.02348740   -0.00345636
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   15
   -420.54220184
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C   -0.77066865    0.71345168   -0.01595264   -0.00938897   -0.02362029    0.00060543
C   -0.77165851   -0.74836416    0.10441419    0.00117854   -0.01136596    0.00283157
C    0.30310088    1.59829101    0.09104591    0.00236789    0.01943364    0.00474972
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C    1.68274638    1.24144742    0.16570314    0.01114346   -0.00159281    0.00394358
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C    2.29674778    0.01307298   -0.00002119    0.00832211   -0.01121870   -0.00117466
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   15
   -420.54249241
H   -2.59533467    0.36949973   -0.14676836   -0.00614270   -0.00458641   -0.00111474
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C   -0.77085781    0.71253727   -0.01586062   -0.01009318   -0.02690934    0.00200810
C   -0.77194660   -0.74993713    0.10127258    0.00319549   -0.01305572    0.00235112
C    0.30992964    1.59834713    0.08590164    0.01169238    0.02882358    0.00379229
C    0.37232002   -1.57039319   -0.06749993    0.00772384    0.01730837    0.00437764
C    1.68107770    1.23549984    0.16394508    0.00133300   -0.02346526    0.00105852
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   15
   -420.54242039
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   15
   -420.54243570
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   15
   -420.54237001
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   15
   -420.54200230
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   15
   -420.54149826
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   15
   -420.54156509
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O   -1.95379033   -1.22326351    0.21361835   -0.01736986   -0.00037057    0.00507777
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   15
   -420.54224397
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O   -1.95757392   -1.22780330    0.21771688   -0.02027204   -0.00405266    0.00591982
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C   -0.78824610   -0.74304143    0.07647481    0.01188658    0.00592792    0.00164031
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   15
   -420.54260805
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O   -1.96044365   -1.23216270    0.22154783   -0.02159042   -0.00680291    0.00649830
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C   -0.79361847   -0.74154436    0.07261491    0.00898162    0.01017526    0.00214058
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C    1.67390654    1.24858212    0.14987378   -0.01909076    0.00369720    0.00205289
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   15
   -420.54240687
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   15
   -420.54243550
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C    2.34145889    0.02431927    0.05186683    0.01445440   -0.01063288    0.00230727
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   15
   -420.54281496
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O   -1.96330105   -1.24317579    0.23124129   -0.01701096   -0.00807076    0.00645406
C   -0.77593615    0.74896976   -0.03625480    0.01251207    0.03724128    0.00455300
C   -0.81208171   -0.74156519    0.06012995   -0.00313356    0.01837255    0.00364745
C    0.30464604    1.55926266    0.03082458   -0.02297645   -0.02340209   -0.00826882
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C    2.34335287    0.02159143    0.05448811    0.00908866   -0.01669838    0.00046419
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   15
   -420.54322738
H   -2.59186068    0.41201924   -0.08162888   -0.00015863    0.00079966   -0.00121703
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O   -1.96256627   -1.24609433    0.23387472   -0.01298192   -0.00623804    0.00593968
C   -0.78188612    0.74533248   -0.04051182    0.00052050    0.03323598    0.00289428
C   -0.81820517   -0.74362438    0.05556567   -0.00795516    0.01869001    0.00404626
C    0.30411969    1.56002738    0.02791153   -0.02128059   -0.02555351   -0.00774361
C    0.36404946   -1.58025848   -0.16693195   -0.01048180   -0.00864581   -0.01115473
C    1.68732605    1.26201184    0.14060584   -0.01422123    0.01701408    0.00317017
C    1.72405926   -1.23799208   -0.13174135    0.00646704    0.00826226   -0.00061646
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   15
   -420.54311949
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   15
   -420.54272202
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   15
   -420.54274690
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C   -0.83248428   -0.75619671    0.04033565   -0.02192670    0.01164501    0.00456110
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   15
   -420.54301109
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   15
   -420.54286096
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   15
   -420.54247639
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C    1.71561273    1.25032118    0.12002578    0.01310589   -0.02966569   -0.00191149
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   15
   -420.54240307
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O   -1.95293785   -1.26608656    0.24628564    0.00625483    0.00970566    0.00452724
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C   -0.83364703   -0.78110108    0.01659557   -0.01730735   -0.00726384   -0.00024542
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H    2.38647019   -2.08031041   -0.13194897    0.00011198   -0.00043870    0.00308933
C    2.33552023    0.03474398    0.07944766   -0.00102045    0.01343269   -0.00501691
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   15
   -420.54257885
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O   -1.95255385   -1.27020443    0.24733522    0.00235788    0.00867990    0.00574650
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C    1.71733577    1.24857815    0.11246295    0.01548064   -0.03873975   -0.00375304
C    1.70193905   -1.22681824   -0.10169905   -0.01510916   -0.00059550   -0.00198251
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C    2.33168719    0.03692471    0.08350779   -0.01049713    0.01705369   -0.00636885
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   15
   -420.54253580
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O   -1.95227338   -1.27471296    0.24812303   -0.00244692    0.00677963    0.00723760
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   15
   -420.54194789
H   -2.65319354    0.55162958    0.04449067    0.00150171    0.00630099    0.00104953
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O   -1.95188165   -1.27952683    0.24858215   -0.00731984    0.00425953    0.00881335
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C   -0.82367912   -0.79627448   -0.00121280    0.00518334   -0.02021410   -0.00820217
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   15
   -420.54119029
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O   -1.95116034   -1.28453277    0.24864183   -0.01152846    0.00141388    0.01028140
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C    1.70327198   -1.21326282   -0.08748129    0.00327708    0.01628465    0.00302702
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   15
   -420.54089837
H   -2.64736805    0.54878714    0.05912561   -0.00305070    0.00002867    0.00239433
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O   -1.94992050   -1.28960252    0.24823603   -0.01454885   -0.00149541    0.01147453
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C    0.31900752    1.55416446   -0.00495863    0.00352852    0.00242748    0.00990718
C    0.37658552   -1.55619150   -0.19471841    0.00747804    0.01095071    0.00027978
C    1.70697334    1.26449446    0.09929124    0.01735537    0.01242491   -0.00164501
C    1.70399991   -1.21047127   -0.08297659    0.01326143    0.01463878    0.00428057
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H    2.35289128    2.08896581    0.25197630   -0.01029106   -0.02006168   -0.00124117
H    2.31857215   -2.10019071   -0.13139098   -0.01149323   -0.00172987    0.00034707
C    2.32358865    0.03621659    0.10361045    0.00029087    0.00259038   -0.00312603
H    3.38541889   -0.00485737    0.29811388   -0.00584471   -0.00321080    0.00248915
   15
   -420.54069011
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   15
   -420.54029677
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   15
   -420.54036507
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O   -1.94207365   -1.30393564    0.24378304   -0.01414015   -0.00833601    0.01236220
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   15
   -420.54120662
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C   -0.81864639   -0.79231126   -0.02089820    0.01521184   -0.01588194   -0.01302090
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   15
   -420.54247427
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   15
   -420.54333472
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C    2.31277705    0.03683344    0.13811178   -0.00304301   -0.01435664    0.00451949
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   15
   -420.54323764
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O   -1.92426747   -1.31788185    0.23042791    0.00708699   -0.00915704    0.00715827
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C    1.68746131    1.28135747    0.08624108   -0.00320200    0.03442407   -0.00153648
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C    2.31090774    0.03996864    0.14339648    0.00061989   -0.00983621    0.00673099
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   15
   -420.54239661
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O   -1.91990506   -1.32029111    0.22609436    0.01357272   -0.00828325    0.00541447
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   15
   -420.54124326
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   15
   -420.53942957
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   15
   -420.53756868
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O   -1.91138094   -1.32540555    0.21187960    0.02401496   -0.00668750    0.00189741
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C    1.69141963    1.26599931    0.08364090    0.00482084   -0.02458124    0.00320499
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   15
   -420.53695556
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O   -1.91058426   -1.32648494    0.20691330    0.02314383   -0.00710190    0.00160850
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C   -0.83475544   -0.75597431   -0.01317389   -0.02282419    0.02642468    0.00232802
C    0.31737380    1.53712822   -0.08914666    0.01158680    0.00868898   -0.00722448
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C    1.69150289    1.26271494    0.08264827    0.00599349   -0.03660251    0.00452266
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H    2.43046988   -2.00761369   -0.12424661    0.00205544    0.00989362   -0.00001761
C    2.29645781    0.05592326    0.16162814   -0.00428541    0.02508298    0.01139611
H    3.37954378    0.06325308    0.22813118   -0.00174116    0.00339595   -0.00377538
   15
   -420.53792770
H   -2.64150986    0.61968451    0.03518283    0.00346155    0.00519101   -0.00087853
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   15
   -420.53982053
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   15
   -420.54155614
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O   -1.91388211   -1.32760083    0.19153055    0.01103467   -0.01050386    0.00281282
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   15
   -420.54261917
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O   -1.91627117   -1.32709579    0.18618190    0.00578798   -0.01153352    0.00349647
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C    1.68560062    1.26844730    0.07525919    0.02304964    0.01058189    0.00743513
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   15
   -420.54335788
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C   -0.81248914   -0.77100159   -0.00801517    0.00317646    0.01049106    0.00036043
C    0.30576457    1.55275679   -0.11509606   -0.01018912   -0.01298316   -0.00862730
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   15
   -420.54344645
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C   -0.80714196   -0.77720815   -0.00722140    0.00917502    0.00271669   -0.00053849
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   15
   -420.54226913
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C    1.67066402    1.27311437    0.06542428   -0.01759246    0.00655401    0.00251369
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   15
   -420.54062475
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O   -1.92643799   -1.31973280    0.16295797   -0.00796875   -0.01024498    0.00497138
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   15
   -420.53988963
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   15
   -420.54017323
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   15
   -420.54078622
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O   -1.93115392   -1.30936475    0.14327895   -0.00401749   -0.00413837    0.00392531
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C    1.66567506    1.27328733    0.05056434   -0.02351170    0.01354778   -0.00131750
C    1.70092359   -1.23615912   -0.03665814   -0.00144739    0.02219573    0.00074139
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H    2.36691186   -2.11846136   -0.05546658    0.00135536   -0.01167681    0.00026205
C    2.28470599    0.02026575    0.15060905   -0.00784763   -0.01816885   -0.00162829
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   15
   -420.54107390
H   -2.61432509    0.53490689    0.03585863   -0.00008983   -0.00413453   -0.00217630
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O   -1.93222687   -1.30539956    0.13633461   -0.00047357   -0.00198324    0.00325983
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C    1.66895225    1.27221695    0.04702497   -0.00755583    0.02326139   -0.00007417
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H    2.36905968    2.07092202    0.13921361   -0.00508557   -0.01749895    0.00001899
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   15
   -420.54137248
H   -2.60019254    0.51403301    0.04316382    0.00082050   -0.00710377   -0.00208999
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O   -1.93327928   -1.30134318    0.12924253    0.00331214   -0.00015461    0.00254272
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   15
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   15
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   15
   -420.54283727
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   15
   -420.54236560
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   15
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   15
   -420.54312380
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   15
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   15
   -420.54238325
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   15
   -420.54190656
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   15
   -420.54225912
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   15
   -420.54235405
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   15
   -420.54189797
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C   -0.80079223   -0.73533227    0.01126619   -0.00564906    0.02766576    0.00429906
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   15
   -420.54195697
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   15
   -420.54296701
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   15
   -420.54406400
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   15
   -420.54414395
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   15
   -420.54320016
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   15
   -420.54259115
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   15
   -420.54246719
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   15
   -420.54178687
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   15
   -420.54087170
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   15
   -420.54101144
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   15
   -420.54230113
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C    1.70753604    1.25069548   -0.02370162    0.00828009   -0.02849846    0.00730903
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   15
   -420.54357727
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O   -1.94707999   -1.18782185   -0.03403222    0.01283840    0.02814717    0.00009990
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C   -0.77210398   -0.76134512   -0.00594051    0.02261828   -0.02252762   -0.00066529
C    0.30410216    1.57821505   -0.09817843   -0.00999711    0.00481724   -0.00725137
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C    1.71104916    1.25444685   -0.02783138    0.01940516   -0.01079596    0.00525608
C    1.69437471   -1.24161458    0.02599098   -0.01766982    0.00305381   -0.00313883
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   15
   -420.54372869
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O   -2.01795859    1.18536282    0.08902964   -0.00213021   -0.00488577    0.00570139
O   -1.94882750   -1.18952374   -0.03989774    0.01027817    0.02616103    0.00037356
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C   -0.77540303   -0.75720112   -0.00743207    0.01896024   -0.01612466   -0.00040035
C    0.29939862    1.57461246   -0.08870345   -0.01941342   -0.00629728   -0.00351136
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C    1.71338061    1.25882195   -0.03227419    0.03190281    0.01239077    0.00227525
C    1.69397001   -1.23811393    0.02989294   -0.01768280    0.00907867   -0.00294790
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H    2.40465660   -2.08378452    0.01033238    0.00889778   -0.00508995   -0.00102430
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   15
   -420.54315192
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O   -1.95103911   -1.19240944   -0.04577971    0.00711282    0.02331944    0.00051349
C   -0.77343678    0.72028595    0.01327810   -0.00225471    0.00271150   -0.00357739
C   -0.77984063   -0.75209128   -0.00889961    0.01368905   -0.00785935   -0.00009728
C    0.29586670    1.57137149   -0.07901436   -0.02831903   -0.01361949   -0.00010995
C    0.36967659   -1.56982974   -0.00398983   -0.00693464    0.01432816    0.00408236
C    1.71380838    1.26247244   -0.03685587    0.03914547    0.03054770   -0.00042173
C    1.69461527   -1.23514550    0.03397320   -0.01385430    0.01180377   -0.00275121
H    0.04412625    2.64015637   -0.18605825   -0.00217451    0.00914150   -0.00302494
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H    2.33984700    2.10027091   -0.13266186   -0.01763935   -0.02214702   -0.00021337
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C    2.32615888    0.01011989    0.06777223   -0.00023055   -0.03013880    0.00693386
H    3.41540734    0.01181025    0.06865906    0.00101485    0.00059073   -0.00137497
   15
   -420.54323231
H   -2.60315630    0.37510698    0.00032695   -0.00826591    0.00134847   -0.00309439
O   -2.00699089    1.17758219    0.09272804    0.01150660   -0.02515025    0.00546151
O   -1.95357245   -1.19635062   -0.05168446    0.00368542    0.01979545    0.00052034
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C   -0.78510180   -0.74651109   -0.01036128    0.00757253    0.00138985    0.00020997
C    0.29403704    1.56892956   -0.06931525   -0.03512561   -0.01609564    0.00263241
C    0.37325975   -1.57276117    0.00295675    0.00035758    0.00705267    0.00424519
C    1.71193252    1.26435701   -0.04142035    0.03414344    0.03312012   -0.00154254
C    1.69608460   -1.23287501    0.03821948   -0.00732120    0.01141842   -0.00247821
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C    2.32641621    0.00903877    0.05939511    0.00455242   -0.03474906    0.00603986
H    3.40776029    0.00423390    0.06348617   -0.00440914   -0.00035691   -0.00091476
   15
   -420.54344138
H   -2.60589197    0.39242757   -0.00707647   -0.00545712    0.00678896   -0.00264522
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O   -1.95627351   -1.20118842   -0.05761239    0.00039242    0.01585953    0.00041682
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C   -0.79082005   -0.74101503   -0.01183573    0.00130196    0.01067350    0.00052116
C    0.29431353    1.56743990   -0.05977155   -0.03831611   -0.01445332    0.00463705
C    0.37682116   -1.57612451    0.00964665    0.00769346    0.00082568    0.00438647
C    1.70804650    1.26431168   -0.04589881    0.01856621    0.02156791   -0.00125124
C    1.69799472   -1.23128730    0.04261496   -0.00041362    0.00953586   -0.00207442
H    0.06402848    2.61987566   -0.18182104    0.00240491   -0.00320207   -0.00347227
H    0.19482705   -2.64297481   -0.04830160    0.00768081    0.00140063   -0.00202760
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H    2.36783547   -2.07685630    0.04457291   -0.00572554    0.00573599   -0.00078709
C    2.32640905    0.01003853    0.05065357    0.00721199   -0.03524797    0.00496871
H    3.40315340   -0.00306928    0.05896993   -0.00758934   -0.00157823   -0.00041667
   15
   -420.54286636
H   -2.60471836    0.40491846   -0.01258206   -0.00229489    0.01115899   -0.00213064
O   -1.99797016    1.17436192    0.09545815    0.01677281   -0.04433754    0.00391173
O   -1.95899420   -1.20674518   -0.06355893   -0.00242051    0.01177460    0.00022713
C   -0.77048155    0.73636074    0.01009369    0.00052700    0.03027600   -0.00607958
C   -0.79661912   -0.73616036   -0.01334184   -0.00458124    0.01914074    0.00084225
C    0.29688390    1.56681662   -0.05050576   -0.03684392   -0.01132308    0.00614160
C    0.37992040   -1.57954670    0.01607131    0.01442985   -0.00372729    0.00448536
C    1.70304773    1.26297895   -0.05030251    0.00081582    0.00634721   -0.00072659
C    1.69994247   -1.23028155    0.04713533    0.00403506    0.00866770   -0.00155879
H    0.07226209    2.61055804   -0.17597958    0.00415506   -0.00967041   -0.00338536
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H    2.37740604    2.13685179   -0.14054699    0.00901942    0.00901893   -0.00259967
H    2.35812212   -2.07833717    0.05715944   -0.00944419    0.00766518   -0.00083488
C    2.32598591    0.01314915    0.04161251    0.00595843   -0.03158249    0.00370001
H    3.40376223   -0.00922501    0.05475067   -0.00668508   -0.00297738    0.00013343
   15
   -420.54228422
H   -2.60176972    0.40958502   -0.01652879   -0.00108740    0.01204788   -0.00199658
O   -1.99455532    1.17555645    0.09653741    0.01903335   -0.04698971    0.00362863
O   -1.96160773   -1.21283675   -0.06951551   -0.00452711    0.00783507   -0.00002598
C   -0.76955891    0.73864057    0.00971712   -0.00098780    0.03191747   -0.00641226
C   -0.80214442   -0.73245567   -0.01489888   -0.00978733    0.02610173    0.00116700
C    0.30165716    1.56688752   -0.04161087   -0.03032258   -0.00995820    0.00753071
C    0.38215278   -1.58275057    0.02222545    0.01996575   -0.00688613    0.00443609
C    1.69797802    1.26124241   -0.05465973   -0.01284140   -0.00514032   -0.00068143
C    1.70166689   -1.22981348    0.05174982    0.00445538    0.01035695   -0.00101672
H    0.07758386    2.60792833   -0.16767891    0.00460669   -0.01164537   -0.00363141
H    0.17896536   -2.65254563   -0.01640679    0.00483358   -0.00255250   -0.00213605
H    2.38883567    2.15045690   -0.14060431    0.01681744    0.01829586   -0.00302476
H    2.35497594   -2.08506465    0.07034297   -0.00935954    0.00516257   -0.00082072
C    2.32521930    0.01815092    0.03234867    0.00143472   -0.02413977    0.00223218
H    3.40896992   -0.01323606    0.05043144   -0.00227956   -0.00439230    0.00074164
   15
   -420.54286997
H   -2.59787610    0.40583112   -0.01900198   -0.00248233    0.00877267   -0.00243442
O   -1.99200668    1.17885837    0.09744931    0.02187086   -0.04318927    0.00405601
O   -1.96401888   -1.21928488   -0.07547076   -0.00584590    0.00418616   -0.00031832
C   -0.76857420    0.73901048    0.00972785   -0.00296185    0.02949539   -0.00664116
C   -0.80708225   -0.73031949   -0.01652652   -0.01409014    0.03105282    0.00149089
C    0.30824183    1.56757669   -0.03317165   -0.01934721   -0.01161872    0.00893959
C    0.38318735   -1.58554223    0.02811218    0.02360698   -0.00922774    0.00419493
C    1.69365331    1.25978615   -0.05897280   -0.02021176   -0.01054528   -0.00122141
C    1.70313850   -1.22997983    0.05642607    0.00165584    0.01357719   -0.00052027
H    0.07967799    2.61333771   -0.15673540    0.00359588   -0.00798875   -0.00431405
H    0.16523976   -2.65536701    0.00183024    0.00292120   -0.00407932   -0.00199459
H    2.38854724    2.15136615   -0.13853559    0.01806205    0.01955965   -0.00259040
H    2.35837910   -2.09530346    0.08410746   -0.00614083   -0.00068025   -0.00064645
C    2.32436927    0.02459764    0.02295055   -0.00376311   -0.01371357    0.00062187
H    3.41576317   -0.01409624    0.04557739    0.00307016   -0.00560045    0.00136028
   15
   -420.54442234
H   -2.59213024    0.39590767   -0.01970418   -0.00491945    0.00303950   -0.00316522
O   -1.99044669    1.18410182    0.09817537    0.02370401   -0.03462147    0.00495562
O   -1.96616726   -1.22592457   -0.08141145   -0.00651031    0.00095308   -0.00064659
C   -0.76741088    0.73761378    0.01014000   -0.00485995    0.02367568   -0.00681819
C   -0.81117357   -0.73004952   -0.01824414   -0.01724390    0.03364707    0.00178726
C    0.31598209    1.56897521   -0.02527192   -0.00554044   -0.01449650    0.01009394
C    0.38280663   -1.58777691    0.03374641    0.02479480   -0.01131261    0.00372102
C    1.69051611    1.25893406   -0.06320961   -0.02061122   -0.00922505   -0.00224589
C    1.70451375   -1.23096138    0.06113378   -0.00190722    0.01565246   -0.00002180
H    0.07923581    2.62429789   -0.14268160    0.00165990   -0.00099768   -0.00507430
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H    2.37565228    2.13868114   -0.13464419    0.01255913    0.01262023   -0.00143683
H    2.36614420   -2.10503669    0.09832811   -0.00190307   -0.00680883   -0.00032649
C    2.32373653    0.03186499    0.01351488   -0.00696712   -0.00153740   -0.00100407
H    3.42045476   -0.01094876    0.03974811    0.00665566   -0.00635496    0.00189769
   15
   -420.54555000
H   -2.58291824    0.38378758   -0.01813717   -0.00611379   -0.00262109   -0.00373041
O   -1.98995115    1.19090895    0.09867665    0.02265162   -0.02409294    0.00584708
O   -1.96802188   -1.23260912   -0.08732265   -0.00676291   -0.00181878   -0.00100807
C   -0.76595597    0.73479671    0.01096432   -0.00630942    0.01556491   -0.00694569
C   -0.81422894   -0.73180173   -0.02006978   -0.01899625    0.03369862    0.00205986
C    0.32405466    1.57124082   -0.01797927    0.00882588   -0.01549780    0.01058290
C    0.38094009   -1.58932857    0.03915646    0.02322718   -0.01318543    0.00304732
C    1.68859099    1.25860643   -0.06730891   -0.01423512   -0.00139189   -0.00358225
C    1.70599630   -1.23287256    0.06584214   -0.00392839    0.01440976    0.00060628
H    0.07760334    2.63600500   -0.12499732   -0.00038860    0.00558558   -0.00545437
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H    2.35408111    2.11735398   -0.12974283    0.00103600   -0.00160476    0.00016616
H    2.37534445   -2.11001801    0.11278273    0.00130551   -0.01049078    0.00001536
C    2.32350767    0.03922414    0.00413928   -0.00674021    0.01088195   -0.00250252
H    3.42055592   -0.00326486    0.03256176    0.00690837   -0.00644116    0.00226948
   15
   -420.54549167
H   -2.56946031    0.37344358   -0.01391264   -0.00474761   -0.00646466   -0.00381972
O   -1.99046972    1.19881073    0.09891425    0.01801990   -0.01391235    0.00633605
O   -1.96957000   -1.23921301   -0.09318797   -0.00691872   -0.00408152   -0.00140634
C   -0.76412287    0.73104330    0.01220816   -0.00708433    0.00645627   -0.00696143
C   -0.81614389   -0.73557909   -0.02201990   -0.01906433    0.03117893    0.00231230
C    0.33160134    1.57442404   -0.01132226    0.02164018   -0.01264277    0.01022256
C    0.37768246   -1.59008587    0.04438302    0.01893235   -0.01442122    0.00220574
C    1.68750862    1.25834918   -0.07119201   -0.00448388    0.00882462   -0.00480185
C    1.70770200   -1.23563512    0.07051265   -0.00313152    0.00918948    0.00147532
H    0.07620939    2.64388976   -0.10342405   -0.00177834    0.00892077   -0.00519683
H    0.11660419   -2.64719976    0.06426400   -0.00180297   -0.00084229   -0.00096677
H    2.33190889    2.09734376   -0.12495771   -0.01260966   -0.01819571    0.00171660
H    2.38372997   -2.10767706    0.12723647    0.00240620   -0.01036103    0.00021512
C    2.32366936    0.04593137   -0.00508619   -0.00317176    0.02207712   -0.00375797
H    3.41589108    0.00901138    0.02375504    0.00373437   -0.00576667    0.00242387
   15
   -420.54519014
H   -2.55273330    0.36760935   -0.00696825   -0.00086738   -0.00787752   -0.00338867
O   -1.99179463    1.20734954    0.09886625    0.01041032   -0.00534738    0.00629381
O   -1.97080357   -1.24563384   -0.09898936   -0.00722849   -0.00579070   -0.00183816
C   -0.76186541    0.72689775    0.01387198   -0.00703273   -0.00233699   -0.00676965
C   -0.81691540   -0.74122996   -0.02410989   -0.01723305    0.02622825    0.00256730
C    0.33785520    1.57835069   -0.00527972    0.03128789   -0.00562501    0.00911957
C    0.37329130   -1.58997866    0.04947693    0.01234334   -0.01412770    0.00121126
C    1.68672028    1.25759628   -0.07478854    0.00079163    0.01152898   -0.00527692
C    1.70958221   -1.23893682    0.07509255    0.00059887    0.00068536    0.00261945
H    0.07602992    2.64561377   -0.07814343   -0.00208458    0.00790949   -0.00434818
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H    2.31844714    2.08994465   -0.12136288   -0.02014352   -0.02663127    0.00252485
H    2.39052125   -2.09809889    0.14155043    0.00121614   -0.00651605    0.00016052
C    2.32401366    0.05131527   -0.01408587    0.00217255    0.03090866   -0.00471567
H    3.40866149    0.02539834    0.01321330   -0.00146529   -0.00438777    0.00239841
   15
   -420.54567281
H   -2.53547716    0.36731639    0.00239373    0.00454283   -0.00706674   -0.00255834
O   -1.99358571    1.21613950    0.09853455    0.00116925    0.00099632    0.00573110
O   -1.97170824   -1.25179400   -0.10470727   -0.00778386   -0.00695892   -0.00228579
C   -0.75918752    0.72288635    0.01594372   -0.00597966   -0.00970773   -0.00627866
C   -0.81665411   -0.74845642   -0.02635519   -0.01349375    0.01914063    0.00283774
C    0.34223802    1.58260230    0.00021344    0.03673994    0.00434783    0.00759644
C    0.36816174   -1.58902913    0.05449844    0.00418833   -0.01147059    0.00004294
C    1.68593619    1.25622143   -0.07807070   -0.00375188   -0.00001802   -0.00484606
C    1.71141667   -1.24227292    0.07951305    0.00620452   -0.00919405    0.00394642
H    0.07728597    2.64187656   -0.04975142   -0.00130316    0.00309360   -0.00316638
H    0.08877576   -2.63665161    0.10981809   -0.00378798    0.00262555   -0.00017037
H    2.31875793    2.10074972   -0.11952624   -0.01598631   -0.01954339    0.00237191
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C    2.32423084    0.05484568   -0.02280189    0.00664739    0.03655758   -0.00537200
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   15
   -420.54586938
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   15
   -420.54492710
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   15
   -420.54393584
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   15
   -420.54382927
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   15
   -420.54431191
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   15
   -420.54423119
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   15
   -420.54343720
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   15
   -420.54336862
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C    1.70654447   -1.23843026    0.10426233    0.00445554   -0.00102008    0.00262509
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   15
   -420.54425097
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   15
   -420.54442571
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   15
   -420.54335269
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O   -1.95673296   -1.29918103   -0.15872008    0.00081410   -0.00204917   -0.00055986
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   15
   -420.54217652
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O   -1.95405034   -1.30229124   -0.16301401    0.00248958   -0.00201720    0.00003307
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C    1.70466575    1.28920681   -0.09751365   -0.00996998    0.00091774    0.00009553
C    1.69562173   -1.22786227    0.11153852   -0.00050948    0.00212494    0.00081706
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H    2.36294950   -2.06086808    0.29364794   -0.00709701    0.00132102    0.00206821
C    2.31048446    0.02404401   -0.10704903   -0.00120203   -0.02303361   -0.00156210
H    3.39929418   -0.00810231   -0.21128803    0.00416153   -0.00267101   -0.00097423
   15
   -420.54153925
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   15
   -420.54104148
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   15
   -420.54000068
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   15
   -420.53893171
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   15
   -420.53933185
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   15
   -420.54096895
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   15
   -420.54210684
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   15
   -420.54243667
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   15
   -420.54254626
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   15
   -420.54251142
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   15
   -420.54163858
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   15
   -420.53944748
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O   -1.92629228   -1.31970034   -0.21655958    0.00157134   -0.00835289   -0.00107598
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   15
   -420.53721670
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   15
   -420.53674400
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   15
   -420.53749854
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   15
   -420.53828715
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   15
   -420.53928883
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   15
   -420.54084599
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   15
   -420.54242300
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   15
   -420.54275850
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   15
   -420.54152220
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   15
   -420.54019800
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   15
   -420.54002580
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   15
   -420.53992398
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C    2.30818901    0.02801022   -0.18036243    0.00744459    0.02294003   -0.00733643
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   15
   -420.53929580
H   -2.65475542    0.58548619   -0.09880919   -0.00541375    0.00281606   -0.00300008
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O   -1.92163416   -1.29230751   -0.26551342   -0.00724529   -0.00909344   -0.00912462
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   15
   -420.53912535
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   15
   -420.53998998
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   15
   -420.54102252
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   15
   -420.54105538
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   15
   -420.54016673
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   15
   -420.54003930
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   15
   -420.54084158
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   15
   -420.54090953
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   15
   -420.54024310
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   15
   -420.53994886
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   15
   -420.54048423
H   -2.56324577    0.38205620    0.00166249    0.00376326   -0.00681029    0.00298260
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C   -0.79134034   -0.76559189   -0.00335673    0.00271944   -0.02901880   -0.00226487
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C    1.68911314    1.23407929   -0.11167389   -0.01789180   -0.02597885   -0.00091691
C    1.70972184   -1.25333903    0.07181588    0.00003816   -0.00105289   -0.00659063
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C    2.32139736    0.01093141   -0.16549126    0.00198021    0.00119166   -0.00136820
H    3.40264598    0.06709879   -0.33524240    0.00577144    0.00717731   -0.00120075
   15
   -420.54085724
H   -2.56136585    0.38014582    0.00569076    0.00592534   -0.00306448    0.00344038
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O   -1.91418350   -1.23817425   -0.26277362    0.00139121    0.00688656   -0.00629284
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C   -0.78822459   -0.76097645   -0.00442497    0.00450640   -0.02441175   -0.00328691
C    0.34971553    1.58098015    0.08643114    0.04150099    0.00299268   -0.00171656
C    0.36629787   -1.56375756    0.26076200   -0.00853414    0.00553196    0.01033999
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   15
   -420.54019520
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   15
   -420.53918693
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   15
   -420.53952810
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   15
   -420.54045972
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   15
   -420.54042655
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   15
   -420.53992807
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   15
   -420.54014442
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   15
   -420.54101541
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   15
   -420.54153274
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   15
   -420.54106099
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C    2.29921503   -0.00364478   -0.13363215   -0.00421960   -0.02133500   -0.00403723
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   15
   -420.54080191
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O   -1.89745218   -1.20732109   -0.22092733    0.00953425    0.00920159   -0.00282231
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C   -0.77292427   -0.71575624    0.00107140   -0.00885731    0.02475617    0.00099494
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   15
   -420.54181393
H   -2.56552272    0.37501933   -0.07294881    0.00044557    0.00035630   -0.00221632
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C   -0.77113561   -0.72030219    0.00249049   -0.01005745    0.01773509    0.00264141
C    0.29514170    1.59023144    0.05222505   -0.03574620   -0.01453136    0.00667775
C    0.37264444   -1.59108081    0.19085390    0.00244634   -0.00870961    0.00265182
C    1.70060319    1.26093171   -0.08491819    0.02597899    0.04096461    0.00017771
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   15
   -420.54274101
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   15
   -420.54224771
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   15
   -420.54142026
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   15
   -420.54129002
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   15
   -420.54178736
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   15
   -420.54194788
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   15
   -420.54155804
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   15
   -420.54208754
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   15
   -420.54383329
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   15
   -420.54490428
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   15
   -420.54458257
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   15
   -420.54403542
H   -2.59180111    0.43249674    0.03020980   -0.00738928   -0.00135211   -0.00042630
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O   -1.93047614   -1.23654514   -0.14496184   -0.00939557   -0.00260297   -0.00482815
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C    1.71001664   -1.26960949    0.09805242    0.00910506   -0.00524181    0.00289568
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   15
   -420.54411070
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   15
   -420.54436893
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   15
   -420.54394013
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C    1.65726257    1.26411652   -0.08725058   -0.01397184    0.02043489   -0.00393635
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   15
   -420.54316020
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O   -1.94355850   -1.25436331   -0.11521924   -0.00415400   -0.00833585   -0.00119580
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   15
   -420.54355358
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   15
   -420.54476011
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C    0.31055736    1.59899382   -0.01725320   -0.01297654   -0.00085597    0.00278439
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   15
   -420.54496607
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O   -1.95117468   -1.26408202   -0.09216697    0.00470261   -0.00670676    0.00128181
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C   -0.81038124   -0.75683107   -0.06458051   -0.02232119    0.01937814   -0.01160537
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C    2.29298176    0.03460105   -0.00453146    0.00218580   -0.00225324   -0.00131928
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   15
   -420.54419297
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O   -1.95398040   -1.26666683   -0.08455287    0.00569848   -0.00574636    0.00193577
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   15
   -420.54374307
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O   -1.95703903   -1.26899101   -0.07702638    0.00521045   -0.00478236    0.00253421
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C    2.29720677    0.03657465    0.00929665   -0.00702635    0.00007583   -0.00228884
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   15
   -420.54410728
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O   -1.96032902   -1.27109791   -0.06961465    0.00337909   -0.00390886    0.00307957
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C    0.32398452    1.59621378   -0.02485530    0.01538182    0.00925377    0.00759372
C    0.37324806   -1.61767009    0.01519195   -0.01018106   -0.00249767    0.00092580
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C    1.70788164   -1.25064708    0.08430561   -0.00065506   -0.00982336    0.00233035
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   15
   -420.54458621
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O   -1.96376863   -1.27302684   -0.06234245    0.00055386   -0.00317778    0.00356637
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C    0.32607708    1.59407939   -0.02774172    0.01895340    0.00886878    0.00833334
C    0.37311475   -1.61629293    0.00653792   -0.01144514   -0.00258935    0.00044496
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C    1.70706866   -1.24500770    0.08203793   -0.00215059   -0.00412959    0.00169120
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   15
   -420.54417441
H   -2.55577423    0.48894226    0.16215307    0.00895724    0.00052892    0.00305066
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O   -1.96723133   -1.27481096   -0.05523178   -0.00282048   -0.00260248    0.00397754
C   -0.76340401    0.71588864    0.01536678   -0.02533071   -0.00137625    0.00583575
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C    0.32704187    1.59139949   -0.03113008    0.01887933    0.01024229    0.00867876
C    0.37366719   -1.61475629   -0.00214312   -0.01135414   -0.00330607    0.00000858
C    1.70428393    1.27540290   -0.07993755    0.01900447    0.00508765   -0.00688649
C    1.70637369   -1.23911269    0.07966687   -0.00128337    0.00043824    0.00125848
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H    2.32011285    2.13942877   -0.12070945   -0.01601293   -0.01278672    0.00105020
H    2.47848579   -2.01627902    0.18894175    0.01315703    0.00232232    0.00072360
C    2.30688759    0.03953393    0.03109424   -0.00793697   -0.00072623   -0.00218703
H    3.39592437    0.01203765    0.14323810    0.00403579   -0.00449408    0.00458488
   15
   -420.54347087
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   15
   -420.54393723
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O   -1.97361439   -1.27804532   -0.04156602   -0.00955485   -0.00172848    0.00455367
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   15
   -420.54450269
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O   -1.97623186   -1.27953542   -0.03503700   -0.01221794   -0.00131735    0.00470352
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   15
   -420.54377038
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C   -0.80840096   -0.81365563   -0.07344308    0.01920354   -0.02788096   -0.01242949
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C    1.71911793    1.28522797   -0.06645714   -0.00280518   -0.00940466   -0.00237507
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   15
   -420.54252395
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C    0.32103486    1.56596179   -0.05548413   -0.00965574    0.00561347    0.00570605
C    0.38299611   -1.60498197   -0.04500318    0.01067178    0.00247715   -0.00232994
C    1.72129684    1.28732407   -0.06244425   -0.01138365   -0.01402518   -0.00080004
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C    2.32740708    0.04688742    0.06893820    0.00283210   -0.00716633    0.00257332
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   15
   -420.54208411
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C   -0.81465387   -0.81441996   -0.06604317    0.01510949   -0.02594085   -0.00874511
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C    1.72412782    1.29022508   -0.05837897   -0.01268812   -0.01002342   -0.00001347
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   15
   -420.54254911
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O   -1.98066793   -1.28512685   -0.01103064   -0.01156948    0.00095673    0.00391378
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C    1.72768765    1.29369187   -0.05430843   -0.00628494    0.00205275   -0.00010491
C    1.69435526   -1.20752777    0.06170383   -0.00212341    0.02248912   -0.00215258
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C    2.33416509    0.05237951    0.08333639   -0.00244582   -0.00646728    0.00433104
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   15
   -420.54293951
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O   -1.98030410   -1.28656138   -0.00551162   -0.00801988    0.00166931    0.00334297
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C    0.32096497    1.54569244   -0.07453192   -0.01744320   -0.01814428    0.00165739
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C    1.73159104    1.29700020   -0.05022741    0.00720953    0.02075409   -0.00099310
C    1.69158004   -1.20670770    0.05929017   -0.00635027    0.02126924   -0.00268532
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   15
   -420.54250397
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O   -1.97957974   -1.28807144   -0.00014396   -0.00358407    0.00231444    0.00269272
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C    1.73504698    1.29904938   -0.04608517    0.02264404    0.03978347   -0.00204633
C    1.68917993   -1.20715254    0.05703684   -0.00881323    0.01582794   -0.00281267
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   15
   -420.54234950
H   -2.66698641    0.59205648    0.05479213   -0.00698797    0.00230351   -0.00155382
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O   -1.97869382   -1.28968588    0.00510164    0.00112970    0.00277423    0.00201060
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C   -0.83529529   -0.79940964   -0.04604777   -0.00743272   -0.00603687    0.00066840
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C    0.37912879   -1.59447342   -0.08427027    0.01456897   -0.00974356   -0.00564407
C    1.73717753    1.29875629   -0.04182501    0.02952536    0.04627778   -0.00196915
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   15
   -420.54334115
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C   -0.84023708   -0.79386508   -0.04078584   -0.01221579    0.00014221    0.00290182
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   15
   -420.54369475
H   -2.66174068    0.58700445    0.03446208   -0.00741772    0.00006785   -0.00276205
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O   -1.97726414   -1.29329275    0.01534838    0.00871564    0.00250238    0.00077729
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C   -0.84444844   -0.78832658   -0.03569805   -0.01537973    0.00583535    0.00486021
C    0.33431996    1.52992013   -0.10062618   -0.00439898    0.00453710   -0.00604552
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C    1.73667882    1.29083893   -0.03307118    0.00929454    0.00895094    0.00194738
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H    2.32945316   -2.07581961    0.12727006   -0.00947324    0.00159844    0.00114255
C    2.34946515    0.06972684    0.11337078    0.01357839    0.01334414    0.00936338
H    3.42743556    0.07616802    0.16118355   -0.00559212    0.00446506   -0.00261407
   15
   -420.54251838
H   -2.65089514    0.58421638    0.02707608   -0.00343561    0.00210858   -0.00302603
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O   -1.97706065   -1.29527197    0.02040513    0.01056412    0.00152663    0.00032010
C   -0.77034597    0.67875583   -0.03279586   -0.01360628   -0.02429454   -0.00557232
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   15
   -420.54103785
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   15
   -420.54055706
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O   -1.97808739   -1.29936110    0.03048729    0.00969474   -0.00211634   -0.00012821
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   15
   -420.54094872
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C    1.73171055    1.27564384   -0.01725018    0.00202948   -0.01831208    0.00223215
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   15
   -420.54102590
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C    0.35363831   -1.56621012   -0.12400751   -0.02329192   -0.00482816   -0.00885844
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   15
   -420.54039122
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   15
   -420.54077017
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   15
   -420.54232315
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   15
   -420.54271770
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O   -1.98690433   -1.30555412    0.06056957   -0.01239281   -0.01538698    0.00173252
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   15
   -420.54157957
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C    2.34940712    0.04438852    0.13706714    0.00466644   -0.01178167    0.00113257
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   15
   -420.54058154
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O   -1.98737939   -1.30296040    0.07017541   -0.01799255   -0.01554626    0.00246839
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   15
   -420.54087723
H   -2.56088061    0.48827869    0.10897551    0.00648689    0.00144648   -0.00040501
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O   -1.98645073   -1.30060294    0.07481848   -0.01892126   -0.01450972    0.00266955
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C   -0.83776974   -0.77520030   -0.00738690   -0.00083200   -0.00533317   -0.00021247
C    0.33274761    1.51564736   -0.14035938   -0.01426984   -0.02813587   -0.00048827
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C    1.70678397    1.25864648    0.01232608   -0.02344840   -0.01850551   -0.00514529
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H    2.38786965   -2.04834960   -0.04097628    0.00258084   -0.00155235   -0.00253465
C    2.34567469    0.03694122    0.13856526   -0.00409370   -0.01827157   -0.00283161
H    3.42770617    0.00227342    0.29965741    0.00504542   -0.00421570    0.00157167
   15
   -420.54175030
H   -2.56254924    0.48316098    0.12714076    0.00450316   -0.00103920    0.00062967
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O   -1.98466884   -1.29758965    0.07934098   -0.01845080   -0.01279799    0.00271757
C   -0.74060847    0.70428100   -0.03261580    0.03875700    0.01607313   -0.00667276
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   15
   -420.54181308
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   15
   -420.54125531
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   15
   -420.54192128
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   15
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   15
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   15
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   15
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   15
   -420.54115423
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   15
   -420.54200299
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   15
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   15
   -420.54182841
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H    2.40301016   -2.10186376   -0.09135038    0.00273940   -0.00280385    0.00174564
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   15
   -420.54334551
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O   -1.93700114   -1.25040085    0.12808332    0.00852204    0.00658484   -0.00083137
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C    0.32523369    1.57552407   -0.14206853   -0.00030848    0.00704841   -0.00904285
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   15
   -420.54474201
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   15
   -420.54418726
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C   -0.79028215   -0.75399102    0.02035528   -0.00310080   -0.00105502    0.00115640
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   15
   -420.54279554
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O   -1.93029418   -1.24406309    0.14040486   -0.00117814   -0.00013305    0.00037542
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C   -0.78609656   -0.75068152    0.02305445   -0.00296789    0.00149231    0.00191778
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   15
   -420.54214375
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C    1.68573166    1.25768783    0.07424987   -0.01937643   -0.01078638    0.00077867
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   15
   -420.54225017
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C   -0.77719659   -0.74449880    0.02806330   -0.00256362    0.00682259    0.00322818
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   15
   -420.54185506
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C   -0.77250833   -0.74194571    0.03029418   -0.00196906    0.00916538    0.00369220
C    0.31938670    1.57412922   -0.11761110   -0.01158843   -0.03140035   -0.00619569
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C    1.72288333   -1.25835129   -0.09389375    0.00758407    0.01810443   -0.00763333
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   15
   -420.54032348
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O   -1.92029161   -1.23526281    0.15644759   -0.00824969   -0.00527255    0.00267161
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C   -0.76770405   -0.73994513    0.03230270   -0.00076903    0.01113685    0.00397417
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   15
   -420.53949390
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C    0.32346324    1.58493407   -0.10612602    0.00150054   -0.01502825   -0.00658848
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   15
   -420.54056385
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C    0.32557868    1.59199904   -0.09979357    0.00891785   -0.00269508   -0.00657720
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   15
   -420.54141362
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O   -1.90927943   -1.22654001    0.16733575   -0.00559129   -0.00136929    0.00332215
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C    0.32715961    1.59923610   -0.09306519    0.01540721    0.00783418   -0.00619763
C    0.39279521   -1.64074315   -0.15990642    0.01653464   -0.02850940   -0.00692728
C    1.67551972    1.24773041    0.08183662   -0.01090907   -0.01080832   -0.00446570
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C    2.27940222    0.02191482    0.15406647   -0.00066623    0.02091630    0.01343193
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   15
   -420.54117615
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O   -1.90501868   -1.22339902    0.17066924   -0.00299784    0.00131838    0.00311058
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C    0.39089363   -1.63811660   -0.15707032    0.01486096   -0.01863391   -0.00458635
C    1.67386916    1.24377126    0.08338150   -0.02096357   -0.02981894   -0.00703819
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C    2.27629031    0.02230444    0.14882624   -0.00521761    0.02577904    0.01214357
H    3.35591792   -0.01095434    0.25722766   -0.00154981   -0.00497688   -0.00192861
   15
   -420.54119532
H   -2.52447295    0.38360047   -0.06731795    0.01200393   -0.00184489   -0.00508871
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O   -1.90062538   -1.22031950    0.17386234    0.00051114    0.00444978    0.00269461
C   -0.76696318    0.74488925   -0.04337363   -0.01842827   -0.01975857    0.00122426
C   -0.74601828   -0.74103760    0.03876513    0.01356057    0.00873189    0.00332421
C    0.32727345    1.61199306   -0.07853517    0.02229609    0.01519942   -0.00437740
C    0.38810605   -1.63435529   -0.15395662    0.01069005   -0.01026316   -0.00225900
C    1.67344815    1.24156119    0.08534489   -0.02348707   -0.03815410   -0.00824472
C    1.71003179   -1.28021727   -0.09757641   -0.00111210   -0.00866435   -0.00281343
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   15
   -420.54228877
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O   -1.89625826   -1.21744272    0.17693378    0.00478540    0.00782315    0.00210707
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C   -0.74338234   -0.74328584    0.03939948    0.01574942    0.00454464    0.00310652
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C    0.38468372   -1.62995758   -0.15070444    0.00422270   -0.00499251   -0.00030365
C    1.67440986    1.24160199    0.08779900   -0.01844035   -0.03514167   -0.00787141
C    1.70691582   -1.28328310   -0.09722243   -0.00692515   -0.00848530   -0.00110354
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C    2.27128776    0.01837746    0.13625273   -0.01279674    0.02468574    0.00848132
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   15
   -420.54358169
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O   -1.89210983   -1.21492095    0.17991015    0.00947859    0.01120964    0.00138029
C   -0.76642830    0.73941582   -0.05135649   -0.01805812   -0.02324680   -0.00120989
C   -0.74169377   -0.74580470    0.03984549    0.01692671   -0.00048467    0.00295096
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C    0.38101382   -1.62524132   -0.14743101   -0.00368982   -0.00301640    0.00109081
C    1.67644999    1.24371169    0.09072037   -0.00604697   -0.02090917   -0.00576725
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C    2.26984099    0.01412768    0.12913895   -0.01288262    0.01856137    0.00650149
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   15
   -420.54332607
H   -2.60729598    0.42335918   -0.07171281   -0.00736624   -0.00508927   -0.00419487
O   -2.01622592    1.23676179   -0.07249842   -0.00714604    0.00858820    0.00457933
O   -1.88839141   -1.21290683    0.18282421    0.01416251    0.01431987    0.00057610
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C   -0.74102338   -0.74829291    0.04011270    0.01698751   -0.00578628    0.00284941
C    0.31801428    1.62482291   -0.05494638    0.01108901    0.01112885   -0.00107640
C    0.37756717   -1.62033192   -0.14422119   -0.01159917   -0.00308486    0.00202191
C    1.67882634    1.24704068    0.09398272    0.01195166    0.00200123   -0.00217181
C    1.70215401   -1.28786237   -0.09640509   -0.01220369   -0.00974007    0.00159742
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C    2.26916080    0.00876938    0.12163207   -0.01049264    0.00965444    0.00451878
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   15
   -420.54144436
H   -2.63081731    0.44309320   -0.06670923   -0.01107741   -0.00275747   -0.00348488
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O   -1.88531381   -1.21154058    0.18571214    0.01840058    0.01688184   -0.00021603
C   -0.76167681    0.73934304   -0.05903841   -0.01005563   -0.01580625   -0.00403590
C   -0.74137510   -0.75043297    0.04020729    0.01594260   -0.01074012    0.00279796
C    0.31313476    1.62766373   -0.04686989    0.00293049    0.01225668   -0.00029491
C    0.37481399   -1.61523831   -0.14113308   -0.01790377   -0.00268065    0.00284944
C    1.68048831    1.25025212    0.09737588    0.02794660    0.02384853    0.00142554
C    1.70082172   -1.28929531   -0.09610314   -0.01052135   -0.01206405    0.00220384
H    0.10765112    2.70300026   -0.09456993    0.00289991    0.00679972   -0.00080562
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H    2.35468132    2.03674855    0.23521885   -0.01902052   -0.02748485   -0.00241453
H    2.42133817   -2.09562331   -0.27427314    0.00356894   -0.00241453   -0.00441763
C    2.26910936    0.00283423    0.11385210   -0.00695903   -0.00064651    0.00250651
H    3.34724997    0.06079300    0.24649243   -0.00136792    0.00662843    0.00123733
   15
   -420.54038711
H   -2.64658303    0.46464207   -0.05919510   -0.01115151    0.00237276   -0.00279380
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O   -1.88306804   -1.21093724    0.18860946    0.02181993    0.01863365   -0.00089683
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C   -0.74268576   -0.75192813    0.04013250    0.01385304   -0.01476599    0.00277943
C    0.30807956    1.62975755   -0.03877501   -0.00554139    0.01451555    0.00036335
C    0.37312864   -1.60999716   -0.13821902   -0.02125568    0.00051654    0.00399995
C    1.68053058    1.25210044    0.10069541    0.03041970    0.03055680    0.00262240
C    1.70011622   -1.28999744   -0.09593245   -0.00694416   -0.01461821    0.00242082
H    0.10897686    2.69927048   -0.08503086    0.00441705    0.00238617   -0.00081524
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H    2.35581201    2.03523367    0.23781744   -0.01995954   -0.02857574   -0.00277620
H    2.40820474   -2.09676486   -0.27539229   -0.00011960    0.00092439   -0.00377582
C    2.26948221   -0.00306247    0.10592112   -0.00407277   -0.01082669    0.00039752
H    3.34258168    0.06750451    0.24303325   -0.00422984    0.00793817    0.00151715
   15
   -420.54064441
H   -2.65449619    0.48438992   -0.04965591   -0.00834787    0.00897012   -0.00232049
O   -2.00779032    1.22454823   -0.09011480   -0.00730554   -0.01656516    0.00459022
O   -1.88180810   -1.21117573    0.19154673    0.02411402    0.01941884   -0.00137463
C   -0.75456519    0.74297657   -0.06574591    0.00156856   -0.00258153   -0.00675316
C   -0.74482977   -0.75253743    0.03988958    0.01088899   -0.01736615    0.00276954
C    0.30335517    1.63097579   -0.03070186   -0.01317245    0.01631545    0.00097114
C    0.37271056   -1.60480306   -0.13554875   -0.02099979    0.00673159    0.00550329
C    1.67881154    1.25219082    0.10387059    0.01793309    0.02007816    0.00111512
C    1.69983011   -1.28982203   -0.09590792   -0.00326388   -0.01585807    0.00259419
H    0.10714717    2.69384470   -0.07490559    0.00550408   -0.00238605   -0.00081440
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H    2.37046012    2.05328269    0.24224598   -0.00723703   -0.01346400   -0.00044547
H    2.39515762   -2.09855904   -0.27379916   -0.00380353    0.00403043   -0.00303280
C    2.27011194   -0.00831078    0.09796637   -0.00319646   -0.01973762   -0.00177793
H    3.34084785    0.06855017    0.23847298   -0.00537174    0.00845267    0.00188228
   15
   -420.54037408
H   -2.65641650    0.49775308   -0.03843322   -0.00525447    0.01427447   -0.00204460
O   -2.00441655    1.22138902   -0.09639779   -0.00916294   -0.02463025    0.00488028
O   -1.88163717   -1.21229136    0.19454531    0.02504252    0.01915863   -0.00156903
C   -0.75096936    0.74523674   -0.06852775    0.00756755    0.00417318   -0.00783679
C   -0.74762935   -0.75210538    0.03947929    0.00733014   -0.01818811    0.00272938
C    0.29941922    1.63121962   -0.02268754   -0.01916637    0.01571050    0.00159922
C    0.37354473   -1.60002025   -0.13321087   -0.01722016    0.01374789    0.00691858
C    1.67602819    1.25109180    0.10698095    0.00116444    0.00434587   -0.00096800
C    1.69975064   -1.28870220   -0.09604194   -0.00138088   -0.01423188    0.00308399
H    0.10140880    2.69000729   -0.06418851    0.00567816   -0.00502717   -0.00090137
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H    2.39015091    2.08080927    0.24696830    0.00856737    0.00557912    0.00239596
H    2.38474695   -2.10312659   -0.27000289   -0.00581845    0.00501324   -0.00260751
C    2.27094678   -0.01237515    0.09011902   -0.00458949   -0.02669018   -0.00393497
H    3.34284812    0.06356091    0.23254835   -0.00436764    0.00811759    0.00235923
   15
   -420.53968982
H   -2.65439083    0.50109769   -0.02574629   -0.00477587    0.01536654   -0.00163965
O   -2.00064005    1.21932822   -0.10290116   -0.00766469   -0.02771012    0.00489262
O   -1.88259680   -1.21427235    0.19761389    0.02446812    0.01784694   -0.00144723
C   -0.74782739    0.74724966   -0.07083715    0.01277972    0.00990285   -0.00861868
C   -0.75087121   -0.75058298    0.03890430    0.00355628   -0.01708313    0.00260928
C    0.29663146    1.63053001   -0.01477008   -0.02296949    0.01189993    0.00224939
C    0.37540610   -1.59605779   -0.13128802   -0.01061291    0.01861139    0.00766224
C    1.67315047    1.24970572    0.11014423   -0.01116662   -0.00696336   -0.00199774
C    1.69976849   -1.28673814   -0.09636455   -0.00216468   -0.00938642    0.00396859
H    0.09165096    2.68957130   -0.05281441    0.00470980   -0.00412289   -0.00111133
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H    2.40401573    2.10469291    0.25003854    0.01897520    0.01872169    0.00409009
H    2.37837953   -2.11111957   -0.26429865   -0.00542637    0.00299566   -0.00266840
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H    3.34790055    0.05277718    0.22492241   -0.00187072    0.00692113    0.00284664
   15
   -420.54015251
H   -2.64872669    0.49366637   -0.01191292   -0.00746818    0.01174342   -0.00070732
O   -1.99653136    1.21850288   -0.10962372   -0.00219729   -0.02514773    0.00418780
O   -1.88466099   -1.21705939    0.20074693    0.02239522    0.01551110   -0.00100360
C   -0.74545011    0.74867270   -0.07262715    0.01637195    0.01382223   -0.00904145
C   -0.75432923   -0.74803673    0.03817221    0.00000894   -0.01412946    0.00235081
C    0.29522039    1.62913080   -0.00698863   -0.02428220    0.00617338    0.00287830
C    0.37790101   -1.59320006   -0.12982333   -0.00236191    0.01937645    0.00737362
C    1.67091330    1.24870514    0.11342142   -0.01661687   -0.01123594   -0.00165925
C    1.69992692   -1.28421560   -0.09692769   -0.00483700   -0.00274267    0.00494128
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H    2.40467793    2.11561243    0.25025381    0.02173122    0.02323068    0.00427885
H    2.37581365   -2.12114199   -0.25665929   -0.00329268   -0.00111522   -0.00296239
C    2.27362849   -0.01543718    0.07524863   -0.00989267   -0.03236913   -0.00723101
H    3.35428018    0.03706197    0.21525334    0.00085271    0.00489453    0.00316392
   15
   -420.54216802
H   -2.63764106    0.47792504    0.00239853   -0.01084955    0.00567715    0.00075275
O   -1.99232887    1.21880500   -0.11653327    0.00482345   -0.01905815    0.00271025
O   -1.88773613   -1.22054674    0.20392440    0.01894843    0.01221409   -0.00026987
C   -0.74405139    0.74927194   -0.07387227    0.01765066    0.01532751   -0.00908341
C   -0.75779130   -0.74464371    0.03729885   -0.00284710   -0.00962329    0.00191634
C    0.29526551    1.62735435    0.00061925   -0.02311662    0.00122103    0.00341013
C    0.38053808   -1.59149136   -0.12879943    0.00604967    0.01564291    0.00606268
C    1.66964578    1.24834779    0.11679267   -0.01497834   -0.00821070   -0.00005783
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H    0.06353101    2.69447637   -0.02748693    0.00025931    0.00409669   -0.00153522
H    0.14275891   -2.64628106   -0.31021241    0.00416816   -0.00590061   -0.00469412
H    2.39014782    2.11032921    0.24747030    0.01680752    0.01886316    0.00306917
H    2.37560283   -2.13036005   -0.24689831   -0.00091247   -0.00529912   -0.00307994
C    2.27578136   -0.01409505    0.06842255   -0.01092520   -0.03036292   -0.00789933
H    3.36010719    0.01786498    0.20332238    0.00255591    0.00215464    0.00317117
   15
   -420.54432594
H   -2.61888953    0.45806105    0.01616143   -0.01184104    0.00010834    0.00233909
O   -1.98833946    1.21996992   -0.12356420    0.01039433   -0.01237471    0.00082234
O   -1.89166681   -1.22458514    0.20711326    0.01438325    0.00808211    0.00068952
C   -0.74370637    0.74895742   -0.07456989    0.01620469    0.01421267   -0.00875280
C   -0.76108633   -0.74067432    0.03631057   -0.00467267   -0.00398618    0.00129402
C    0.29669804    1.62548784    0.00802168   -0.01978200   -0.00058637    0.00380942
C    0.38281552   -1.59071142   -0.12813848    0.01325013    0.00851405    0.00403714
C    1.66924851    1.24844896    0.12016178   -0.00631348    0.00230601    0.00264353
C    1.70128486   -1.27901830   -0.09897862   -0.00894174    0.00670923    0.00540659
H    0.04831363    2.69418319   -0.01323884   -0.00215821    0.00686678   -0.00156741
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H    2.36396089    2.09199959    0.24255327    0.00449710    0.00560110    0.00060595
H    2.37611932   -2.13586551   -0.23494679    0.00033821   -0.00777085   -0.00274927
C    2.27858434   -0.01093204    0.06207032   -0.00985218   -0.02530896   -0.00780856
H    3.36419094   -0.00286691    0.18913477    0.00264214   -0.00100807    0.00278801
   15
   -420.54476397
H   -2.59184909    0.43798326    0.02826103   -0.00893170   -0.00324813    0.00358382
O   -1.98481032    1.22170139   -0.13063257    0.01301408   -0.00696392   -0.00104326
O   -1.89624723   -1.22898795    0.21027026    0.00905297    0.00334127    0.00179612
C   -0.74432804    0.74779515   -0.07473985    0.01213048    0.01076495   -0.00807526
C   -0.76410486   -0.73646716    0.03524490   -0.00529767    0.00231730    0.00051287
C    0.29931882    1.62363597    0.01519436   -0.01481340    0.00167302    0.00409682
C    0.38430195   -1.59044097   -0.12772067    0.01840689    0.00034565    0.00182038
C    1.66920960    1.24838520    0.12336792    0.00667120    0.01749182    0.00585262
C    1.70271938   -1.27690070   -0.10049283   -0.00779618    0.00663761    0.00454950
H    0.03462132    2.68912643    0.00212981   -0.00403717    0.00671549   -0.00145514
H    0.09364094   -2.62286210   -0.27797735   -0.00027366    0.00402563   -0.00230861
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   15
   -420.54379437
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   15
   -420.54339853
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   15
   -420.54315315
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   15
   -420.54164029
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   15
   -420.54006544
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   15
   -420.54012931
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   15
   -420.54199373
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   15
   -420.54382744
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   15
   -420.54396880
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   15
   -420.54345257
H   -2.56290465    0.43178295   -0.03536762   -0.00210525   -0.00559949    0.00324996
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   15
   -420.54390334
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   15
   -420.54394410
H   -2.61622102    0.49253511   -0.08906387   -0.00241699    0.00734115   -0.00061805
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C   -0.80327689   -0.75666843    0.03211308    0.00224817   -0.00642140   -0.00251619
C    0.32699785    1.56130265    0.08612908   -0.00822700   -0.01034572   -0.00236813
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C    1.70896140   -1.24415733   -0.11781622    0.01211166   -0.00924045   -0.00371712
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H    2.41503640   -2.06151193   -0.12726166    0.00008948    0.00807985    0.00385193
C    2.32889139    0.02759711   -0.00219097    0.00430078   -0.01284065    0.00062062
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   15
   -420.54250383
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   15
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   15
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   15
   -420.54244260
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   15
   -420.54305888
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   15
   -420.54218591
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   15
   -420.54158383
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   15
   -420.54215120
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   15
   -420.54191544
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   15
   -420.54034801
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   15
   -420.53906471
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   15
   -420.53919599
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   15
   -420.54012684
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   15
   -420.54011215
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   15
   -420.53916793
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   15
   -420.53950756
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   15
   -420.54107065
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   15
   -420.54156832
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   15
   -420.54096626
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   15
   -420.54081851
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   15
   -420.54148619
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   15
   -420.54185111
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   15
   -420.54049947
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   15
   -420.53860569
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O   -1.98681515   -1.28316868    0.15293463    0.00669672    0.00091588   -0.00309935
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C    2.35030670    0.07557352   -0.06528138    0.00336843    0.02650823    0.00566289
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   15
   -420.53858589
H   -2.63476456    0.62870090   -0.10826313    0.00223041    0.01079096    0.00128328
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O   -1.98689251   -1.28502360    0.14746584    0.00152973   -0.00159072   -0.00360082
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   15
   -420.53947359
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   15
   -420.53942296
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   15
   -420.53919073
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   15
   -420.54013080
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   15
   -420.54198854
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   15
   -420.54278041
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   15
   -420.54149997
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   15
   -420.54014316
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   15
   -420.54044492
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   15
   -420.54079029
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O   -1.95748309   -1.28311382    0.10342603   -0.00437665   -0.00577587   -0.00299767
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   15
   -420.54022659
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C    0.30720491    1.57375910    0.13056322   -0.03267377   -0.00481981   -0.00102238
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C    2.30429769    0.01221243   -0.08897128   -0.00765090   -0.04421596   -0.00628705
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   15
   -420.54013350
H   -2.54992909    0.48492931   -0.16623225   -0.00092882   -0.00839252    0.00133971
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O   -1.94405909   -1.27756166    0.09676438    0.01218957    0.00073290   -0.00135866
C   -0.73714453    0.71265778    0.03591346    0.01210088    0.00901708    0.01091202
C   -0.80085867   -0.78663878    0.10129844    0.00023590   -0.02550062    0.00249599
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   15
   -420.54155148
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   15
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   15
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   15
   -420.54338578
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   15
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   15
   -420.54327772
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   15
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   15
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   15
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   15
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   15
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   15
   -420.54121693
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   15
   -420.54109600
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   15
   -420.54254398
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   15
   -420.54469522
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   15
   -420.54545115
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   15
   -420.54483398
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   15
   -420.54426438
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C    1.70677190    1.27025113    0.05536161   -0.02348103   -0.00752401    0.00327765
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   15
   -420.54408693
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   15
   -420.54354169
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   15
   -420.54201695
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   15
   -420.54089404
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   15
   -420.54187184
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   15
   -420.54348684
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C   -0.76377227   -0.74947860    0.02043126    0.01123310   -0.00946065    0.00823088
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C    1.71468049    1.24290505    0.02259795    0.02423654   -0.01396096   -0.00117458
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   15
   -420.54400663
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   15
   -420.54401619
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   15
   -420.53046588
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   15
   -420.52879705
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   15
   -420.52513303
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   15
   -420.52155330
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   15
   -420.51887110
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   15
   -420.51717548
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   15
   -420.51719306
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   15
   -420.51878788
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   15
   -420.52045567
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   15
   -420.52075383
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   15
   -420.51963865
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O   -1.96722619   -1.30108687   -0.09704862   -0.03101199    0.01394413   -0.00125407
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C   -0.80726934   -0.82311771   -0.04400330    0.02487411   -0.00401244   -0.00228627
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C    0.44268360   -1.58288450    0.06722031    0.01995749    0.01640991    0.00236807
C    1.62914241    1.31895755   -0.08424339   -0.01754173    0.04344687   -0.01418870
C    1.76152565   -1.22372713    0.04324739   -0.00114130   -0.01089307   -0.00573328
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C    2.30836363    0.08537133    0.01254851    0.00168981   -0.02574587    0.00952242
H    3.39942925    0.16601326    0.05787386    0.00442313    0.00222661    0.00070402
   15
   -420.51793027
H   -1.95723276    2.12624032   -0.09515162    0.00559997    0.00340140   -0.00591372
O   -2.02451822    1.17913313    0.13511587    0.00399530   -0.00330365    0.01078577
O   -1.97106758   -1.29969076   -0.10668715   -0.03675931    0.00972845   -0.00161431
C   -0.79137640    0.64976897   -0.01641119   -0.00116729   -0.00935555   -0.00687082
C   -0.80771785   -0.81549352   -0.04784167    0.02629786    0.00896316   -0.00265662
C    0.25334517    1.53541366   -0.04547511    0.01017643   -0.00648525    0.00340074
C    0.44450661   -1.59027495    0.07357512    0.02340728    0.01206041    0.00319373
C    1.61930148    1.32305137   -0.08793452   -0.03465137    0.05331786   -0.01260187
C    1.75909386   -1.22238925    0.04906270   -0.00675704   -0.01093761   -0.00585723
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H    2.49736305   -2.01979260    0.14673022    0.00305436    0.00088563    0.00062024
C    2.31172800    0.08320028    0.01119809    0.00766656   -0.03273421    0.00901598
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   15
   -420.51622907
H   -1.93951678    2.10775427   -0.08844038    0.00772410   -0.00995748   -0.00352698
O   -2.02483020    1.17663382    0.14572705    0.00022713    0.00569582    0.00929866
O   -1.97325264   -1.29873968   -0.11625293   -0.03944396    0.00648419   -0.00184311
C   -0.78911961    0.65250837   -0.01649099    0.00031118   -0.00482058   -0.00799668
C   -0.80974279   -0.80840353   -0.05151900    0.02491882    0.02037744   -0.00310839
C    0.25954559    1.53380762   -0.05138511    0.02463619   -0.01014880    0.00194958
C    0.44492868   -1.59837967    0.07973533    0.02392722    0.00474211    0.00433143
C    1.61156986    1.32398159   -0.09086417   -0.05415850    0.05133857   -0.01087640
C    1.75705431   -1.22039131    0.05523150   -0.00914879   -0.01066469   -0.00582193
H   -0.06941042    2.56702292    0.01695193   -0.00427038   -0.00632611    0.00125565
H    0.28366000   -2.67480778    0.20012015    0.00581741   -0.00511743    0.00257601
H    2.26421870    2.17629669   -0.04269327   -0.00165086   -0.01078186    0.00314984
H    2.49910310   -2.01299983    0.15742472    0.00287963    0.00164662    0.00051369
C    2.31462806    0.08298859    0.00930443    0.01372771   -0.03568393    0.00810665
H    3.40285975    0.17862771    0.07300893    0.00453036    0.00325303    0.00198312
   15
   -420.51492378
H   -1.92732591    2.09612321   -0.07912600    0.00925492   -0.01808793   -0.00215966
O   -2.02515678    1.17389362    0.15591351   -0.00244795    0.01012026    0.00857263
O   -1.97365993   -1.29808747   -0.12573572   -0.03895117    0.00448151   -0.00189848
C   -0.78688331    0.65554428   -0.01608833    0.00212406   -0.00127542   -0.00889828
C   -0.81326098   -0.80253383   -0.05500782    0.02079351    0.02936762   -0.00366705
C    0.26427527    1.53281664   -0.05741275    0.03522470   -0.01404605    0.00044871
C    0.44391785   -1.60675955    0.08563261    0.02165805   -0.00485780    0.00568264
C    1.60709638    1.32184722   -0.09313946   -0.07018587    0.04132874   -0.00848532
C    1.75555128   -1.21775134    0.06175164   -0.00819806   -0.00980573   -0.00563528
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H    2.26378330    2.19380299   -0.07072346    0.00468965   -0.00066232    0.00231473
H    2.49879925   -2.00738199    0.16775107    0.00221620    0.00224870    0.00037228
C    2.31670177    0.08491557    0.00692217    0.01896686   -0.03474534    0.00684995
H    3.39945151    0.18155735    0.07865500    0.00150402    0.00302468    0.00243354
   15
   -420.51475016
H   -1.92179985    2.09679894   -0.06809135    0.01073880   -0.01470217   -0.00338912
O   -2.02537501    1.17073470    0.16570206   -0.00438287    0.00425559    0.01008741
O   -1.97231168   -1.29764390   -0.13513317   -0.03530841    0.00390481   -0.00173763
C   -0.78477679    0.65866480   -0.01514942    0.00419474    0.00080535   -0.00942908
C   -0.81802391   -0.79842446   -0.05827425    0.01410207    0.03519560   -0.00435533
C    0.26690850    1.53266804   -0.06346837    0.03911357   -0.01652599   -0.00089266
C    0.44160750   -1.61484243    0.09118640    0.01730851   -0.01502442    0.00702192
C    1.60681780    1.31722788   -0.09490587   -0.07640029    0.02827716   -0.00526285
C    1.75452993   -1.21452271    0.06861198   -0.00444963   -0.00808462   -0.00532408
H   -0.06163366    2.57383081    0.01531037   -0.00583254   -0.00154687    0.00246235
H    0.31782351   -2.68597753    0.21379143    0.01069785    0.00028048    0.00170347
H    2.26010050    2.21185314   -0.10038349    0.00900092    0.00844369    0.00088716
H    2.49690850   -2.00335841    0.17780886    0.00138053    0.00243344    0.00023610
C    2.31764058    0.08892567    0.00412749    0.02173739   -0.03016414    0.00521702
H    3.39498673    0.18232854    0.08255886   -0.00195186    0.00248145    0.00276381
   15
   -420.51589430
H   -1.92398320    2.10755371   -0.05451617    0.01179115   -0.00305960   -0.00622660
O   -2.02539824    1.16740940    0.17502802   -0.00524893   -0.00844817    0.01284595
O   -1.96937251   -1.29738328   -0.14445272   -0.02869810    0.00486318   -0.00132396
C   -0.78292450    0.66174396   -0.01364231    0.00636361    0.00144277   -0.00955267
C   -0.82362837   -0.79642495   -0.06127654    0.00514931    0.03729417   -0.00518938
C    0.26721540    1.53350526   -0.06947151    0.03526488   -0.01631429   -0.00194532
C    0.43825564   -1.62202561    0.09631704    0.01188029   -0.02342091    0.00805542
C    1.61109495    1.31089815   -0.09635670   -0.06982469    0.01518277   -0.00150479
C    1.75376879   -1.21081030    0.07579391    0.00107421   -0.00534426   -0.00493109
H   -0.05171130    2.57988466    0.01205170   -0.00542126    0.00034364    0.00289560
H    0.32417949   -2.69069656    0.21860669    0.01170725    0.00245895    0.00131291
H    2.25018827    2.22407957   -0.13066390    0.00916396    0.01331996   -0.00084327
H    2.49401361   -2.00104895    0.18769352    0.00070332    0.00199132    0.00014904
C    2.31728641    0.09474298    0.00101955    0.02020509   -0.02216135    0.00313956
H    3.39184705    0.18131603    0.08447106   -0.00408576    0.00186108    0.00312070
   15
   -420.51776824
H   -1.93457445    2.12054882   -0.03650283    0.01146622    0.00814871   -0.00837195
O   -2.02519029    1.16446047    0.18377509   -0.00429008   -0.01946776    0.01461631
O   -1.96514075   -1.29734921   -0.15371321   -0.01954389    0.00735500   -0.00064130
C   -0.78145627    0.66474101   -0.01155928    0.00837183    0.00107304   -0.00931687
C   -0.82953540   -0.79666102   -0.06396425   -0.00555492    0.03542887   -0.00616985
C    0.26542209    1.53531385   -0.07535849    0.02495810   -0.01313101   -0.00271101
C    0.43418586   -1.62781104    0.10096331    0.00633980   -0.02817730    0.00854766
C    1.61953528    1.30364409   -0.09771696   -0.05138721    0.00329372    0.00233372
C    1.75293939   -1.20677891    0.08327379    0.00725551   -0.00176545   -0.00447938
H   -0.03795089    2.58577711    0.00672172   -0.00398085    0.00084702    0.00307900
H    0.32218304   -2.69703119    0.22246093    0.01145622    0.00214265    0.00118788
H    2.23394061    2.22703736   -0.16035066    0.00495801    0.01278153   -0.00236029
H    2.49059309   -2.00013389    0.19746723    0.00036203    0.00091839    0.00012577
C    2.31573672    0.10188351   -0.00227568    0.01346663   -0.01082255    0.00058368
H    3.39150388    0.17894708    0.08413590   -0.00382104    0.00138965    0.00355477
   15
   -420.51947732
H   -1.95331619    2.12808178   -0.01258592    0.00940900    0.01274976   -0.00846980
O   -2.02479495    1.16236575    0.19186749   -0.00142422   -0.02291558    0.01418149
O   -1.96002895   -1.29765359   -0.16294557   -0.00863037    0.01110184    0.00029733
C   -0.78049235    0.66767543   -0.00891413    0.00996487    0.00023708   -0.00880788
C   -0.83510195   -0.79902109   -0.06627824   -0.01714985    0.02984427   -0.00726002
C    0.26213741    1.53790583   -0.08108253    0.01105455   -0.00780573   -0.00328172
C    0.42972918   -1.63191247    0.10509550    0.00148078   -0.02898505    0.00847632
C    1.63104214    1.29618243   -0.09921653   -0.02475887   -0.00695343    0.00579146
C    1.75167282   -1.20264238    0.09102430    0.01310807    0.00214562   -0.00396906
H   -0.02136165    2.59113632   -0.00081066   -0.00181563    0.00007882    0.00301377
H    0.31200775   -2.70475440    0.22544446    0.01001863   -0.00068768    0.00132500
H    2.21432268    2.22110045   -0.18837761   -0.00255989    0.00710534   -0.00321072
H    2.48689179   -1.99985997    0.20714754    0.00036429   -0.00048473    0.00014244
C    2.31339441    0.10966347   -0.00560459    0.00244634    0.00352015   -0.00229512
H    3.39378413    0.17557296    0.08123603   -0.00148188    0.00104337    0.00407228
   15
   -420.52001094
H   -1.97876394    2.12693944    0.01731654    0.00619366    0.00898723   -0.00662509
O   -2.02433958    1.16127580    0.19932434    0.00266404   -0.01717518    0.01167528
O   -1.95452791   -1.29846453   -0.17219185    0.00280636    0.01555664    0.00139507
C   -0.78012812    0.67059605   -0.00573736    0.01095271   -0.00072204   -0.00809357
C   -0.83963315   -0.80317133   -0.06815303   -0.02833719    0.02133729   -0.00837125
C    0.25818632    1.54096733   -0.08660868   -0.00331984   -0.00195079   -0.00377634
C    0.42517696   -1.63427457    0.10871725   -0.00219319   -0.02709902    0.00799701
C    1.64403253    1.28913589   -0.10106295    0.00457296   -0.01619222    0.00859316
C    1.74961883   -1.19863327    0.09901413    0.01788677    0.00566352   -0.00334974
H   -0.00348030    2.59646823   -0.01050087    0.00060979   -0.00117915    0.00276483
H    0.29467512   -2.71191277    0.22747044    0.00763561   -0.00463271    0.00154529
H    2.19661294    2.21023310   -0.21414322   -0.01110138   -0.00151887   -0.00323198
H    2.48292923   -1.99924484    0.21672367    0.00045939   -0.00175771    0.00015485
C    2.31091259    0.11722010   -0.00879457   -0.01023072    0.01989114   -0.00519090
H    3.39709674    0.17144209    0.07540942    0.00142594    0.00078802    0.00448823
   15
   -420.51920958
H   -2.00863158    2.11971488    0.05192379    0.00254857   -0.00102805   -0.00376775
O   -2.02400479    1.16093935    0.20625498    0.00683240   -0.00463478    0.00821631
O   -1.94914956   -1.29998111   -0.18150113    0.01300795    0.01988043    0.00249813
C   -0.78042222    0.67355993   -0.00207174    0.01114808   -0.00163345   -0.00725120
C   -0.84246144   -0.80860363   -0.06952225   -0.03733324    0.01116447   -0.00933589
C    0.25442613    1.54415300   -0.09190650   -0.01581331    0.00267111   -0.00427045
C    0.42075012   -1.63500161    0.11185612   -0.00445074   -0.02441408    0.00735804
C    1.65676496    1.28307358   -0.10342643    0.03022167   -0.02641133    0.01090210
C    1.74649126   -1.19496187    0.10720591    0.02103107    0.00822766   -0.00260034
H    0.01397009    2.60262002   -0.02217940    0.00282081   -0.00191594    0.00248818
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H    2.18676061    2.20036661   -0.23760493   -0.01735552   -0.00853670   -0.00287125
H    2.47863890   -1.99739855    0.22619294    0.00049296   -0.00245058    0.00009717
C    2.30904106    0.12357375   -0.01167262   -0.02122926    0.03618961   -0.00769110
H    3.39944984    0.16673830    0.06636880    0.00323069    0.00061084    0.00461196
   15
   -420.51810304
H   -2.04036440    2.11320837    0.08928010   -0.00066487   -0.01058234   -0.00148250
O   -2.02397733    1.16081271    0.21281044    0.01036737    0.00789585    0.00536708
O   -1.94434952   -1.30239566   -0.19092275    0.02005851    0.02310995    0.00336054
C   -0.78138622    0.67662208    0.00203217    0.01040256   -0.00242041   -0.00634894
C   -0.84305275   -0.81471028   -0.07032901   -0.04216762    0.00079063   -0.00988859
C    0.25160491    1.54719057   -0.09694563   -0.02507742    0.00475439   -0.00479397
C    0.41658563   -1.63424873    0.11454972   -0.00534568   -0.02237738    0.00672926
C    1.66771553    1.27862131   -0.10644956    0.04684416   -0.03892146    0.01322735
C    1.74210213   -1.19178156    0.11555421    0.02210538    0.00952127   -0.00171313
H    0.02940268    2.61006709   -0.03564162    0.00455783   -0.00131328    0.00219744
H    0.24570313   -2.71421411    0.22814983    0.00162656   -0.00863687    0.00146579
H    2.18909514    2.19626509   -0.25896897   -0.01853245   -0.00936992   -0.00299813
H    2.47400482   -1.99383852    0.23559770    0.00035518   -0.00229874   -0.00005495
C    2.30842982    0.12775459   -0.01408931   -0.02755425    0.04927820   -0.00942540
H    3.39960518    0.16158896    0.05403118    0.00292105    0.00055796    0.00434034
   15
   -420.51802337
H   -2.07162763    2.11379106    0.12779392   -0.00361980   -0.01160611   -0.00063906
O   -2.02441816    1.16036109    0.21911564    0.01340210    0.01200274    0.00413230
O   -1.94044180   -1.30585149   -0.20049501    0.02240549    0.02443538    0.00372290
C   -0.78297370    0.67982900    0.00652009    0.00851057   -0.00289267   -0.00544695
C   -0.84112287   -0.82087017   -0.07054132   -0.04123769   -0.00853138   -0.00973962
C    0.25028218    1.54995416   -0.10169512   -0.03074334    0.00419510   -0.00526001
C    0.41273848   -1.63213594    0.11683599   -0.00506951   -0.02154081    0.00614915
C    1.67588954    1.27652144   -0.11027327    0.05232783   -0.05091190    0.01561961
C    1.73638832   -1.18917111    0.12400573    0.02074183    0.00959440   -0.00073213
H    0.04159308    2.61838440   -0.05068797    0.00562486    0.00055397    0.00194743
H    0.21835198   -2.70658922    0.22687132   -0.00121838   -0.00682963    0.00099072
H    2.20445012    2.19850793   -0.27811835   -0.01440425   -0.00366740   -0.00401452
H    2.46911664   -1.98867194    0.24504867    0.00013448   -0.00133168   -0.00029804
C    2.30945212    0.12898770   -0.01594120   -0.02738550    0.05585941   -0.01012215
H    3.39778676    0.15602736    0.03859108    0.00049524    0.00069340    0.00369504
   15
   -420.51912881
H   -2.10026026    2.12213203    0.16681409   -0.00686511   -0.00301332   -0.00055997
O   -2.02546696    1.15940432    0.22522969    0.01636878    0.00612794    0.00383654
O   -1.93753081   -1.31040751   -0.21023359    0.01949974    0.02349540    0.00339199
C   -0.78506987    0.68320794    0.01133775    0.00543660   -0.00279317   -0.00459719
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   15
   -420.52063776
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   15
   -420.52207138
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   15
   -420.52307013
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   15
   -420.52300065
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   15
   -420.52157390
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   15
   -420.51969152
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   15
   -420.51872177
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   15
   -420.51873353
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   15
   -420.51911701
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   15
   -420.51964806
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O   -1.89634936   -1.38213205   -0.30485956   -0.01140027   -0.01210113   -0.00530456
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   15
   -420.52002651
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C   -0.82735990   -0.79284348   -0.06514777    0.00734372   -0.00059085    0.00657749
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H    2.38181735    2.17588721   -0.32616465    0.01124464    0.00819619    0.00279525
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C    2.31761851    0.06153882   -0.02067581    0.01614529   -0.02489159    0.00656088
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   15
   -420.51952953
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O   -1.87810283   -1.39340673   -0.32097073    0.01042791   -0.00995875   -0.00137884
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   15
   -420.51782120
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   15
   -420.51563050
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O   -1.86169024   -1.40288447   -0.33683076    0.02839240   -0.00727199    0.00242907
C   -0.77775338    0.70416008    0.08517615    0.01489972   -0.00870696    0.00907297
C   -0.85575246   -0.76599122   -0.07198215   -0.04174497    0.01770467   -0.00014063
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C    2.29620363    0.07214000   -0.02778360   -0.02244858    0.00988253    0.00146130
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   15
   -420.51379613
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O   -1.85522202   -1.40709847   -0.34488392    0.03252826   -0.00737530    0.00335721
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C    0.28589829    1.58890855   -0.12989840   -0.00332413    0.02955704   -0.00172566
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C    1.68663011   -1.19015098    0.23675821    0.01640519   -0.00017284    0.00682048
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C    2.29072180    0.07550427   -0.03049952   -0.03103821    0.02175856   -0.00133000
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   15
   -420.51289451
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O   -1.85021403   -1.41097193   -0.35308562    0.03250899   -0.00903441    0.00329255
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C   -0.86397682   -0.75282073   -0.07677491   -0.05367516    0.02716189   -0.00137973
C    0.28139886    1.58548259   -0.12924889   -0.01023344    0.02688928   -0.00034001
C    0.36492410   -1.53324372    0.15420364   -0.00897835    0.00547670   -0.00655738
C    1.72305364    1.27275238   -0.23490807    0.06059619   -0.02812804   -0.00493862
C    1.68555057   -1.19176282    0.24104934    0.01359127   -0.00372009    0.00701596
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   15
   -420.51338343
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O   -1.84666636   -1.41442989   -0.36143299    0.02859656   -0.01216089    0.00224323
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C   -0.86335660   -0.74855907   -0.07905713   -0.05110571    0.03056938   -0.00053300
C    0.27751135    1.58044484   -0.12857881   -0.01576281    0.02131964    0.00106120
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C    1.72090370    1.26676663   -0.23992926    0.06091354   -0.03571998   -0.00277969
C    1.68366467   -1.19315065    0.24491739    0.00767117   -0.00707906    0.00696594
H    0.02716560    2.63494778   -0.28516320    0.00124042    0.00347101   -0.00582580
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H    2.34746849   -2.02811390    0.46051727   -0.00427331   -0.00323797    0.00126528
C    2.28550063    0.07783546   -0.03552739   -0.03197238    0.03328284   -0.00617166
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   15
   -420.51518790
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O   -1.84440499   -1.41733241   -0.36987921    0.02172854   -0.01622382    0.00041591
C   -0.77971197    0.70811895    0.09493518    0.02401108   -0.01328138    0.00830411
C   -0.85967012   -0.74613792   -0.08131088   -0.04364877    0.03231936    0.00106858
C    0.27456861    1.57412514   -0.12797130   -0.01954276    0.01422564    0.00216926
C    0.36884026   -1.52516950    0.16485806    0.00269318    0.00540596   -0.00474753
C    1.71510415    1.26291421   -0.24478189    0.05439146   -0.03799171   -0.00070861
C    1.68132734   -1.19411461    0.24836588   -0.00073731   -0.00959211    0.00657325
H    0.04068971    2.63616285   -0.27511555    0.00263421    0.00524230   -0.00581915
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H    2.29296088    2.16609193   -0.44782816   -0.00545809    0.00705317    0.00062219
H    2.36253974   -2.01412868    0.46740790   -0.00197660   -0.00139900    0.00098197
C    2.28582478    0.07611941   -0.03755207   -0.02568386    0.03018375   -0.00712121
H    3.36624108    0.03384393   -0.08265762   -0.00592151   -0.00213920    0.00047929
   15
   -420.51744372
H   -2.01978415    2.04830153    0.71860892    0.00160552   -0.00026190    0.00418042
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O   -1.84312343   -1.41949817   -0.37834275    0.01323970   -0.02044566   -0.00182896
C   -0.78368933    0.71126000    0.09605296    0.02187064   -0.00857397    0.00777446
C   -0.85336237   -0.74565998   -0.08363151   -0.03249479    0.03180348    0.00311851
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C    2.28769474    0.07260518   -0.03915255   -0.01787652    0.02165406   -0.00679766
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   15
   -420.51908400
H   -2.04219850    2.03984937    0.72538675   -0.00120886   -0.01093369   -0.00039268
O   -2.05032254    1.16529793    0.32676709    0.00195546    0.00068272    0.00043761
O   -1.84244176   -1.42073852   -0.38672327    0.00450696   -0.02406398   -0.00409304
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C   -0.84510106   -0.74709276   -0.08614139   -0.01899793    0.02876311    0.00529504
C    0.27228151    1.55933746   -0.12717284   -0.01965539    0.00059729    0.00252038
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C    1.69440021    1.26167525   -0.25443080    0.02828220   -0.02050024    0.00109321
C    1.67738132   -1.19423846    0.25411963   -0.01957389   -0.01115244    0.00487521
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C    2.29064984    0.06779876   -0.04034699   -0.01079123    0.00965282   -0.00547169
H    3.37194487    0.07261861   -0.05809671   -0.00544851    0.00218210    0.00164718
   15
   -420.51971887
H   -2.06377576    2.03887536    0.73227491   -0.00352187   -0.01522302   -0.00216585
O   -2.04567744    1.17039020    0.33244357    0.00789313    0.00682065    0.00245616
O   -1.84196801   -1.42089160   -0.39491931   -0.00331162   -0.02649016   -0.00602916
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C    0.27293906    1.55168841   -0.12700263   -0.01504263   -0.00483892    0.00161756
C    0.37274574   -1.51578041    0.18291152    0.01519655    0.01121961   -0.00356674
C    1.68105518    1.26324548   -0.25933478    0.01261332   -0.00356417    0.00056040
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H    3.38110021    0.09041850   -0.04741140   -0.00109340    0.00403920    0.00203960
   15
   -420.51924818
H   -2.08281356    2.04824073    0.74043615   -0.00587361   -0.00956946    0.00062279
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O   -1.84135070   -1.41984834   -0.40284401   -0.00936536   -0.02741739   -0.00737800
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C   -0.82601328   -0.75481933   -0.09224025    0.00958581    0.01627301    0.00892862
C    0.27449055    1.54432973   -0.12692757   -0.00722841   -0.00976538    0.00012313
C    0.37245922   -1.51378018    0.18936942    0.01419158    0.01469565   -0.00413107
C    1.66694577    1.26502477   -0.26426968   -0.00274404    0.01463982   -0.00058258
C    1.67797956   -1.19173736    0.25869892   -0.02926186   -0.00907214    0.00291339
H    0.06681001    2.60946948   -0.19827764    0.00619010   -0.00218849   -0.00174936
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C    2.29819880    0.05722306   -0.04185907   -0.00042179   -0.01500578   -0.00176419
H    3.39101995    0.10533449   -0.03819533    0.00364819    0.00549307    0.00243626
   15
   -420.51768904
H   -2.09761039    2.06420175    0.74801685   -0.00837583    0.00093995    0.00557460
O   -2.03774461    1.17991836    0.34362778    0.02013681   -0.00578848   -0.00509343
O   -1.84031698   -1.41756714   -0.41043676   -0.01315286   -0.02674005   -0.00797513
C   -0.80938199    0.72499665    0.09598868   -0.00697830    0.01771916    0.00755744
C   -0.81690304   -0.76036483   -0.09604667    0.02213951    0.00820544    0.00991401
C    0.27646585    1.53756285   -0.12685820    0.00324391   -0.01481979   -0.00180549
C    0.37133221   -1.51266343    0.19607889    0.00962994    0.01714572   -0.00499187
C    1.65299715    1.26592985   -0.26916939   -0.01707091    0.03056717   -0.00175282
C    1.68081284   -1.18962674    0.26069507   -0.02773065   -0.00701961    0.00207764
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H    2.42147641   -1.95311986    0.49588845    0.00676492    0.00692501   -0.00109324
C    2.30215700    0.05292510   -0.04239717    0.00446640   -0.02370861   -0.00013083
H    3.39841802    0.11633100   -0.03073517    0.00665829    0.00633655    0.00285650
   15
   -420.51574052
H   -2.10640607    2.07966923    0.75167868   -0.01036961    0.00858243    0.00903399
O   -2.03500564    1.18487527    0.34945363    0.02472047   -0.01165733   -0.00850949
O   -1.83869598   -1.41407846   -0.41767070   -0.01441021   -0.02452542   -0.00774709
C   -0.81606534    0.72673147    0.09485542   -0.01546712    0.02236924    0.00788532
C   -0.80911785   -0.76640591   -0.10044852    0.03191761   -0.00000367    0.01006312
C    0.27823795    1.53169307   -0.12667841    0.01508475   -0.02000008   -0.00401062
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C    1.64007500    1.26501381   -0.27396652   -0.03019344    0.04103730   -0.00226213
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   15
   -420.51467308
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   15
   -420.51494151
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   15
   -420.51621716
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   15
   -420.51804738
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C    1.61223692    1.23721855   -0.29250241   -0.04701015    0.01433364    0.00364970
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   15
   -420.52001896
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C    1.61253411    1.22627151   -0.29742762   -0.03473103   -0.00215547    0.00416850
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C    2.31051566    0.05999147   -0.04734803    0.00807332   -0.00590833    0.00200231
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   15
   -420.52103918
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O   -1.82125998   -1.37730398   -0.45664767    0.02217763    0.00916309    0.00777724
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C    2.30877127    0.06490491   -0.04866223   -0.00350926    0.00493902    0.00126007
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   15
   -420.52048326
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   15
   -420.51884511
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C    0.38881502   -1.53528858    0.26997320   -0.01522062   -0.00232067    0.00314364
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C    2.30653399    0.07317408   -0.05148346   -0.02070617    0.02534259    0.00040144
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   15
   -420.51713348
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C    0.39743501   -1.53860521    0.27861773   -0.00560685   -0.00378894    0.00543846
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C    2.30705522    0.07531535   -0.05294175   -0.02118505    0.03105934    0.00090691
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   15
   -420.51562147
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O   -1.82302312   -1.35600839   -0.48709342    0.02250540    0.01422846    0.00917190
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H    2.36396135   -2.00832916    0.59009650   -0.00962492   -0.00311519   -0.00009874
C    2.30882684    0.07560326   -0.05445935   -0.01558775    0.03181991    0.00228865
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   15
   -420.51431895
H   -1.83907615    2.15880584    0.56748503    0.00815612   -0.01069700   -0.00365776
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O   -1.82645402   -1.35240527   -0.49586625    0.01291158    0.01030225    0.00585871
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C   -0.81075619   -0.77981165   -0.14766458   -0.01915738    0.01152018   -0.01990059
C    0.21262365    1.52868412   -0.10045761   -0.03541982    0.00911144    0.00745213
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C    1.72323904   -1.18907638    0.29290709   -0.00277488   -0.00530551   -0.00343104
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H    2.37960608   -1.99844268    0.59714715   -0.00746601   -0.00249839   -0.00002889
C    2.31152014    0.07399237   -0.05612003   -0.00588669    0.02751668    0.00454214
H    3.38925206    0.08890169   -0.15492848   -0.00375609   -0.00161540    0.00039661
   15
   -420.51351541
H   -1.81876001    2.15601044    0.54303873    0.00956531   -0.01512815   -0.00493484
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O   -1.83046517   -1.34926724   -0.50490212    0.00182725    0.00577895    0.00178418
C   -0.82742149    0.67504992    0.06005034    0.02380139   -0.02046017   -0.01296351
C   -0.80810392   -0.77788055   -0.14642748   -0.01126001    0.01968125   -0.01636271
C    0.20868529    1.52741081   -0.09787268   -0.03879748    0.00649828    0.00945354
C    0.42259260   -1.54678959    0.30204839    0.02820186   -0.00725476    0.01106445
C    1.61850538    1.19335618   -0.33354456    0.02721808   -0.03693425   -0.01154620
C    1.72157288   -1.19205094    0.29733340   -0.01703182   -0.00888253   -0.00313074
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H    3.38621496    0.09230505   -0.17930986   -0.00619322   -0.00057096   -0.00061046
   15
   -420.51336662
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O   -1.83456024   -1.34639293   -0.51401836   -0.00901238    0.00165637   -0.00244919
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C   -0.80477622   -0.77712793   -0.14420383   -0.00223794    0.02549759   -0.01221219
C    0.20707815    1.52573748   -0.09585649   -0.03907927    0.00526826    0.01088846
C    0.42848389   -1.54870056    0.30864919    0.03716816   -0.00622582    0.01151471
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C    1.72092760   -1.19449450    0.30194918   -0.02944684   -0.01121414   -0.00284921
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C    2.31735074    0.06632913   -0.06045315    0.01260228    0.00875935    0.01088087
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   15
   -420.51342533
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O   -1.83825252   -1.34359806   -0.52302482   -0.01824472   -0.00134607   -0.00631882
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C   -0.80131177   -0.77790079   -0.14124187    0.00652542    0.02805282   -0.00804077
C    0.20781785    1.52373876   -0.09449510   -0.03601765    0.00528502    0.01158656
C    0.43214594   -1.55024042    0.31455821    0.04245213   -0.00416534    0.01106765
C    1.60652850    1.20532287   -0.34008426    0.00212560   -0.01552552   -0.01569113
C    1.72203828   -1.19626401    0.30673585   -0.03690695   -0.01268295   -0.00227838
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H    0.23330078   -2.57140915    0.62399997    0.00823934    0.00105327    0.00177932
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H    2.44727560   -1.95804165    0.61717628    0.00424660   -0.00130488    0.00093720
C    2.31939056    0.06139296   -0.06350562    0.01730279   -0.00206811    0.01427619
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   15
   -420.51353915
H   -1.80820276    2.18927624    0.48974279    0.01675724    0.01002084   -0.00378962
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O   -1.84112620   -1.34074787   -0.53174729   -0.02502971   -0.00285041   -0.00944110
C   -0.84141378    0.67245963    0.05920945    0.00796240   -0.01805306   -0.01578843
C   -0.79823581   -0.78035203   -0.13779145    0.01406187    0.02699804   -0.00431354
C    0.21071846    1.52141975   -0.09383046   -0.02955322    0.00535370    0.01146200
C    0.43326459   -1.55152822    0.31980110    0.04295866   -0.00211778    0.00998260
C    1.59994440    1.21305999   -0.34199023   -0.01092788   -0.00227790   -0.01682321
C    1.72534550   -1.19726960    0.31165800   -0.03731885   -0.01353050   -0.00123943
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H    0.21798189   -2.57228940    0.63173404    0.00593852   -0.00092718    0.00215891
H    2.20414468    2.10520353   -0.56233963    0.00345573    0.00641817    0.00226066
H    2.46749233   -1.94201433    0.62273728    0.00629327    0.00091755    0.00054108
C    2.32039655    0.05657547   -0.06741805    0.01954887   -0.01162726    0.01700354
H    3.39777468    0.10172010   -0.24601977    0.00368620    0.00249022   -0.00479527
   15
   -420.51402981
H   -1.82706846    2.19476186    0.47781392    0.01475557    0.01091826   -0.00372565
O   -2.04961581    1.23285823    0.44244329   -0.01842604   -0.00059320    0.01297111
O   -1.84287492   -1.33777432   -0.54004502   -0.02896725   -0.00278020   -0.01158463
C   -0.84760839    0.67390348    0.06079485   -0.00187813   -0.01472860   -0.01538305
C   -0.79600094   -0.78441884   -0.13407650    0.01974230    0.02252372   -0.00131755
C    0.21539134    1.51878486   -0.09385499   -0.02009949    0.00386996    0.01052658
C    0.43181031   -1.55268240    0.32444150    0.03847443   -0.00116285    0.00864179
C    1.59401172    1.22093397   -0.34288271   -0.02210597    0.01115323   -0.01716633
C    1.73087233   -1.19745979    0.31665264   -0.03033947   -0.01378911    0.00027165
H    0.02879604    2.58814347   -0.07797540    0.00506214   -0.00391174   -0.00053004
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H    2.22520710    2.09110013   -0.56401700    0.00614673    0.00298364    0.00246949
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C    2.32022439    0.05244886   -0.07235226    0.02092360   -0.01875011    0.01842153
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   15
   -420.51468150
H   -1.85641732    2.19281833    0.46856324    0.01043860    0.00471822   -0.00357547
O   -2.04567756    1.23205052    0.44495204   -0.01105006    0.00554442    0.01243120
O   -1.84332029   -1.33468011   -0.54782123   -0.02998430   -0.00124863   -0.01263956
C   -0.85368450    0.67623310    0.06330743   -0.01270229   -0.01042227   -0.01434620
C   -0.79494881   -0.78983375   -0.13027747    0.02317934    0.01524392    0.00080154
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C    0.42805019   -1.55375758    0.32855903    0.02981020   -0.00191697    0.00736009
C    1.58940174    1.22813976   -0.34274115   -0.03045934    0.02328923   -0.01666244
C    1.73820459   -1.19682010    0.32162967   -0.01753984   -0.01321723    0.00200550
H    0.01958057    2.58344071   -0.08438526    0.00393288   -0.00407365   -0.00047666
H    0.17648025   -2.57090768    0.64236088    0.00063415   -0.00319074    0.00237197
H    2.24194698    2.07492815   -0.56748526    0.00715372   -0.00176753    0.00291060
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C    2.31878620    0.04944072   -0.07839174    0.02238747   -0.02281046    0.01810179
H    3.39893102    0.10057199   -0.27542708    0.00749181    0.00274135   -0.00603873
   15
   -420.51503760
H   -1.89324017    2.18767550    0.46186821    0.00542736   -0.00463619   -0.00309707
O   -2.04124235    1.23097803    0.44689935   -0.00249862    0.01500371    0.01124282
O   -1.84241558   -1.33153380   -0.55502801   -0.02823504    0.00149365   -0.01260493
C   -0.85899270    0.67919124    0.06668516   -0.02346093   -0.00576558   -0.01280972
C   -0.79528605   -0.79616093   -0.12652241    0.02412374    0.00604401    0.00200423
C    0.22765747    1.51308715   -0.09571175    0.00379524   -0.00590102    0.00705719
C    0.42250052   -1.55470886    0.33223033    0.01850628   -0.00424600    0.00628940
C    1.58661815    1.23395210   -0.34159635   -0.03567296    0.03241025   -0.01525337
C    1.74658281   -1.19538749    0.32648646   -0.00178081   -0.01134558    0.00353167
H    0.00758876    2.58153060   -0.09045957    0.00188302   -0.00195451   -0.00030412
H    0.15407677   -2.56709394    0.64512307   -0.00166830   -0.00220462    0.00183282
H    2.25361211    2.06002797   -0.57305040    0.00693251   -0.00646376    0.00337559
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C    2.31599297    0.04779580   -0.08551683    0.02402449   -0.02363830    0.01598128
H    3.39185995    0.09703447   -0.28375853    0.00483953    0.00204367   -0.00542763
   15
   -420.51495584
H   -1.93402851    2.18562171    0.45738018    0.00132876   -0.00988899   -0.00225262
O   -2.03669105    1.22923999    0.44833915    0.00545032    0.02052929    0.00939450
O   -1.84023898   -1.32845852   -0.56166680   -0.02403198    0.00511412   -0.01153906
C   -0.86288797    0.68249965    0.07083599   -0.03304358   -0.00140902   -0.01094148
C   -0.79706897   -0.80284892   -0.12288402    0.02243110   -0.00409906    0.00229900
C    0.23382190    1.51060290   -0.09733710    0.01498205   -0.01179195    0.00508934
C    0.41583558   -1.55539930    0.33552041    0.00638228   -0.00737680    0.00538441
C    1.58597654    1.23782764   -0.33953387   -0.03778352    0.03687580   -0.01288013
C    1.75506930   -1.19327741    0.33113278    0.01392370   -0.00774379    0.00443877
H   -0.00572642    2.58097899   -0.09632047   -0.00070537    0.00102881   -0.00006944
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H    2.26030536    2.04968902   -0.58102769    0.00637106   -0.00961451    0.00353008
H    2.50667876   -1.90615268    0.64723957    0.00317613    0.00900683   -0.00168200
C    2.31175136    0.04756558   -0.09360105    0.02473313   -0.02148130    0.01239138
H    3.38142087    0.09205168   -0.28821991    0.00023874    0.00095513   -0.00415698
   15
   -420.51468841
H   -1.97584048    2.19011618    0.45450158   -0.00171915   -0.00599815   -0.00122503
O   -2.03238339    1.22660583    0.44935398    0.01237504    0.01705376    0.00718093
O   -1.83697924   -1.32561710   -0.56778549   -0.01788498    0.00922344   -0.00958804
C   -0.86479605    0.68589684    0.07564790   -0.04038867    0.00225408   -0.00893727
C   -0.80019560   -0.80928919   -0.11938043    0.01817211   -0.01421937    0.00174976
C    0.23909489    1.50882186   -0.09927127    0.02324112   -0.01577737    0.00331213
C    0.40878077   -1.55564532    0.33848488   -0.00497741   -0.01016959    0.00448125
C    1.58760512    1.23950216   -0.33669741   -0.03688135    0.03556019   -0.00951153
C    1.76272438   -1.19070712    0.33551444    0.02756345   -0.00255093    0.00460238
H   -0.01854378    2.57974498   -0.10213084   -0.00317528    0.00314630    0.00016287
H    0.11411093   -2.55636326    0.64738312   -0.00495306    0.00222106   -0.00002197
H    2.26238217    2.04611343   -0.59150933    0.00624890   -0.01013178    0.00306572
H    2.50900496   -1.91165841    0.65599119    0.00390012    0.00645350   -0.00056074
C    2.30602800    0.04862185   -0.10243035    0.02261925   -0.01677614    0.00794258
H    3.37079874    0.08638991   -0.28970085   -0.00417461   -0.00027501   -0.00268088
   15
   -420.51429234
H   -2.01641791    2.19854969    0.45251012   -0.00467277    0.00403777   -0.00027323
O   -2.02863467    1.22322188    0.45004283    0.01854271    0.00742476    0.00501300
O   -1.83291270   -1.32319426   -0.57347150   -0.01050694    0.01335273   -0.00703303
C   -0.86427750    0.68916165    0.08100081   -0.04452552    0.00512971   -0.00702263
C   -0.80441012   -0.81487378   -0.11597914    0.01171213   -0.02347365    0.00049496
C    0.24298353    1.50797941   -0.10140738    0.02727439   -0.01669997    0.00186558
C    0.40201715   -1.55528373    0.34117913   -0.01438506   -0.01152346    0.00338836
C    1.59144798    1.23905521   -0.33329001   -0.03272440    0.02846179   -0.00528440
C    1.76872582   -1.18798579    0.33962006    0.03856406    0.00325999    0.00431843
H   -0.02911566    2.57636686   -0.10805531   -0.00500430    0.00326086    0.00034765
H    0.09893172   -2.55251317    0.64817583   -0.00617997    0.00368428   -0.00069963
H    2.25992346    2.04967024   -0.60415642    0.00667130   -0.00793630    0.00189627
H    2.50847459   -1.92171504    0.66511069    0.00538149    0.00231942    0.00114518
C    2.29895996    0.05068206   -0.11173886    0.01590651   -0.00995100    0.00327427
H    3.36303138    0.08091251   -0.28923560   -0.00614466   -0.00133173   -0.00145096
   15
   -420.51379239
H   -2.05361947    2.20416912    0.45072781   -0.00776320    0.01265557    0.00047355
O   -2.02572331    1.21949496    0.45050250    0.02359004   -0.00075271    0.00328962
O   -1.82837045   -1.32137537   -0.57883919   -0.00286131    0.01697524   -0.00427204
C   -0.86108623    0.69211985    0.08678008   -0.04465932    0.00728377   -0.00542625
C   -0.80932563   -0.81904681   -0.11260542    0.00379997   -0.03111917   -0.00122387
C    0.24524608    1.50813080   -0.10365815    0.02663632   -0.01447840    0.00079098
C    0.39611016   -1.55423573    0.34366978   -0.02115278   -0.01084673    0.00201736
C    1.59725164    1.23690991   -0.32956542   -0.02492749    0.01681884   -0.00057861
C    1.77240669   -1.18545715    0.34346370    0.04721765    0.00817684    0.00418071
H   -0.03615234    2.57078221   -0.11422644   -0.00580971    0.00109755    0.00046370
H    0.08819456   -2.55122325    0.64944227   -0.00727788    0.00362384   -0.00089666
H    2.25266371    2.05883747   -0.61814004    0.00699863   -0.00398022    0.00025579
H    2.50409081   -1.93343586    0.67340862    0.00649679   -0.00192582    0.00279412
C    2.29095490    0.05333563   -0.12124614    0.00430899   -0.00143946   -0.00124236
H    3.35947728    0.07637468   -0.28769690   -0.00466702   -0.00207633   -0.00067314
   15
   -420.51343267
H   -2.08526499    2.20109319    0.44861870   -0.01028100    0.01444562    0.00098881
O   -2.02387337    1.21577580    0.45081047    0.02629743   -0.00205402    0.00221922
O   -1.82369511   -1.32032268   -0.58401191    0.00392020    0.01952503   -0.00182241
C   -0.85521612    0.69464058    0.09288993   -0.04038338    0.00882158   -0.00430384
C   -0.81446880   -0.82134900   -0.10915732   -0.00452289   -0.03651223   -0.00300875
C    0.24591889    1.50914703   -0.10595833    0.02177762   -0.01015340    0.00003944
C    0.39146786   -1.55254103    0.34603924   -0.02502131   -0.00837755    0.00049602
C    1.60454534    1.23375937   -0.32580558   -0.01364905    0.00282153    0.00407922
C    1.77324215   -1.18341153    0.34705092    0.05380384    0.01082649    0.00473479
H   -0.03906630    2.56450079   -0.12072532   -0.00564652   -0.00259553    0.00048409
H    0.08268488   -2.55245266    0.65132526   -0.00814110    0.00211237   -0.00062664
H    2.24042160    2.07084829   -0.63230485    0.00635745    0.00032674   -0.00140152
H    2.49510701   -1.94384582    0.67973152    0.00631509   -0.00491054    0.00381722
C    2.28270286    0.05607068   -0.13067923   -0.01001942    0.00816034   -0.00557285
H    3.35914950    0.07330403   -0.28565934   -0.00090014   -0.00239682   -0.00015681
   15
   -420.51348856
H   -2.10958723    2.18811526    0.44580836   -0.01146548    0.00801858    0.00132373
O   -2.02320398    1.21211814    0.45101526    0.02569131    0.00490078    0.00180040
O   -1.81919000   -1.32014985   -0.58909862    0.00867327    0.02046102   -0.00026722
C   -0.84692543    0.69663050    0.09926270   -0.03179563    0.00982054   -0.00370082
C   -0.81934243   -0.82145754   -0.10552949   -0.01205026   -0.03899608   -0.00434366
C    0.24528981    1.51077641   -0.10826216    0.01389793   -0.00567905   -0.00045730
C    0.38832446   -1.55034377    0.34837785   -0.02599583   -0.00507967   -0.00087358
C    1.61265215    1.23043657   -0.32228898    0.00006278   -0.01084431    0.00806774
C    1.77083479   -1.18200542    0.35034687    0.05812531    0.01046683    0.00625112
H   -0.03795958    2.56008678   -0.12756490   -0.00479783   -0.00623884    0.00038546
H    0.08300872   -2.55516602    0.65364658   -0.00849334   -0.00003324   -0.00014776
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H    2.48167463   -1.95084320    0.68336289    0.00449841   -0.00583522    0.00389125
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   15
   -420.51381714
H   -2.12575241    2.16970223    0.44205040   -0.01109518   -0.00390006    0.00155750
O   -2.02368839    1.20821650    0.45113649    0.02192172    0.01733662    0.00186701
O   -1.81506737   -1.32089783   -0.59416796    0.01049574    0.01938678   -0.00010366
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C   -0.82349667   -0.81922503   -0.10164387   -0.01771187   -0.03801119   -0.00470369
C    0.24382745    1.51275988   -0.11053941    0.00456922   -0.00328025   -0.00073621
C    0.38673880   -1.54783791    0.35076690   -0.02407342   -0.00204421   -0.00178128
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C    1.76492740   -1.18121765    0.35326042    0.05935841    0.00721001    0.00861278
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H    2.46508102   -1.95376466    0.68424516    0.00139894   -0.00468338    0.00308257
C    2.26880829    0.05948750   -0.14828360   -0.03301358    0.02574675   -0.01368808
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   15
   -420.51441496
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O   -1.81140856   -1.32251745   -0.59922636    0.00904269    0.01619206   -0.00158407
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C   -0.82659260   -0.81471244   -0.09748051   -0.02083476   -0.03329344   -0.00373368
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C    0.38659407   -1.54520317    0.35326043   -0.01914560   -0.00003319   -0.00204678
C    1.62800171    1.22634225   -0.31687554    0.02655073   -0.02690662    0.01247310
C    1.75545232   -1.18085627    0.35565121    0.05613979    0.00203474    0.01133315
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H    2.44750052   -1.95339028    0.68293591   -0.00203240   -0.00229514    0.00179693
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H    3.35299451    0.07360812   -0.28054199    0.00353283   -0.00062637    0.00187445
   15
   -420.51555083
H   -2.13493499    2.14781530    0.43110594   -0.00949183   -0.01443520    0.00154749
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O   -1.80814906   -1.32486469   -0.60420712    0.00469070    0.01112776   -0.00459057
C   -0.81366274    0.69896672    0.11970943    0.00925683    0.00962249   -0.00370208
C   -0.82844173   -0.80820395   -0.09309822   -0.02133802   -0.02507592   -0.00140045
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C    0.38759136   -1.54256037    0.35587464   -0.01103930    0.00080117   -0.00169191
C    1.63366504    1.22652840   -0.31524487    0.03484427   -0.02657926    0.01285086
C    1.74261213   -1.18061612    0.35735842    0.04692387   -0.00349483    0.01368888
H   -0.01686440    2.57558076   -0.14893747   -0.00200334   -0.00259966   -0.00070149
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C    2.26240413    0.05694730   -0.16262097   -0.03274062    0.03022629   -0.01957189
H    3.34577507    0.07546817   -0.28079201   -0.00017662    0.00076457    0.00267117
   15
   -420.51681821
H   -2.12902881    2.15139271    0.42395008   -0.00943665   -0.00458879    0.00094033
O   -2.03011807    1.19051355    0.45092080    0.00693848    0.01701172    0.00346839
O   -1.80509516   -1.32771201   -0.60897560   -0.00158140    0.00478384   -0.00865827
C   -0.80252042    0.69854835    0.12696556    0.02231225    0.00825000   -0.00350665
C   -0.82901124   -0.80019254   -0.08863651   -0.01967779   -0.01414881    0.00197648
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C    0.38924023   -1.53996252    0.35858917    0.00026957    0.00095509   -0.00093695
C    1.63724859    1.22829818   -0.31438841    0.03762399   -0.02154554    0.01265791
C    1.72696897   -1.18017036    0.35824261    0.03081022   -0.00791963    0.01507844
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H    2.15580459    2.10329773   -0.67941147   -0.01168328   -0.00003178   -0.00099991
H    2.41825361   -1.94915203    0.67720413   -0.00487917    0.00065896    0.00016625
C    2.26223433    0.05296836   -0.16809775   -0.02428739    0.02523240   -0.02094858
H    3.33873707    0.07676589   -0.28295074   -0.00478485    0.00232243    0.00322529
   15
   -420.51745990
H   -2.11635942    2.15813929    0.41613519   -0.00876473    0.00763677   -0.00004487
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O   -1.80196744   -1.33077462   -0.61334999   -0.00845793   -0.00204960   -0.01308762
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C   -0.82839758   -0.79133288   -0.08429673   -0.01661983   -0.00172716    0.00583416
C    0.24039978    1.52412580   -0.11915729   -0.02250166   -0.01538323   -0.00155207
C    0.39085916   -1.53742377    0.36136005    0.01426119    0.00135741   -0.00013147
C    1.63858707    1.23135894   -0.31429826    0.03435839   -0.01408672    0.01262701
C    1.70949324   -1.17925369    0.35822051    0.00863469   -0.01076858    0.01536295
H    0.00531840    2.59795477   -0.16116513    0.00024026    0.00529920   -0.00159997
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H    2.15298631    2.10508599   -0.68468166   -0.01268869   -0.00049879   -0.00091809
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C    2.26352423    0.04748317   -0.17231381   -0.01398161    0.01631603   -0.02107570
H    3.33504870    0.07639470   -0.28740348   -0.00783730    0.00383537    0.00330182
   15
   -420.51729805
H   -2.09746264    2.15972518    0.40835698   -0.00664756    0.01451490   -0.00112779
O   -2.03632928    1.17460316    0.45002943   -0.00259795   -0.00677387    0.00531812
O   -1.79845842   -1.33374547   -0.61713190   -0.01470217   -0.00856511   -0.01717441
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C   -0.82678173   -0.78236923   -0.08030898   -0.01295641    0.01080377    0.00954003
C    0.24219896    1.52876302   -0.12112975   -0.02255190   -0.01470201   -0.00273069
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C    1.63787463    1.23527019   -0.31497463    0.02571170   -0.00628005    0.01314976
C    1.69151103   -1.17769117    0.35727307   -0.01660289   -0.01251698    0.01489261
H    0.01657713    2.60479431   -0.16571241    0.00186367    0.00593062   -0.00179413
H    0.17940666   -2.55472159    0.66715911    0.00446272    0.00239072   -0.00110327
H    2.15915685    2.10711132   -0.68923404   -0.01122049    0.00103078   -0.00175892
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C    2.26566690    0.04102210   -0.17526148   -0.00502671    0.00520919   -0.01996629
H    3.33678540    0.07328348   -0.29420584   -0.00734610    0.00508653    0.00280637
   15
   -420.51664448
H   -2.07384929    2.15138449    0.40138085   -0.00329545    0.01280324   -0.00201211
O   -2.03937094    1.16685144    0.44924353   -0.00803889   -0.00868363    0.00583530
O   -1.79428859   -1.33633154   -0.62013829   -0.01930579   -0.01406519   -0.02029596
C   -0.77925988    0.69490567    0.14978390    0.03999857   -0.00042564    0.00059580
C   -0.82438217   -0.77405280   -0.07689464   -0.00931346    0.02211078    0.01254459
C    0.24534505    1.53427069   -0.12293363   -0.01921603   -0.01032127   -0.00459413
C    0.39058436   -1.53269315    0.36690402    0.04322058    0.00522201    0.00021431
C    1.63562556    1.23956432   -0.31644779    0.01342130    0.00092340    0.01399166
C    1.67452493   -1.17537401    0.35542628   -0.04025225   -0.01378287    0.01415654
H    0.02648983    2.60753035   -0.16898234    0.00357390    0.00376547   -0.00175889
H    0.19616378   -2.55550129    0.67068527    0.00686983    0.00205450   -0.00095323
H    2.17329583    2.10832468   -0.69248563   -0.00784876    0.00371841   -0.00316730
H    2.39376084   -1.94180426    0.66598510    0.00226174   -0.00304867    0.00143970
C    2.26812820    0.03424746   -0.17700677    0.00112718   -0.00621250   -0.01783145
H    3.34359347    0.06653554   -0.30299652   -0.00329285    0.00590221    0.00175372
   15
   -420.51562823
H   -2.04789357    2.13429362    0.39583195    0.00052557    0.00339230   -0.00253639
O   -2.04205025    1.15946668    0.44819499   -0.01285498   -0.00358154    0.00580649
O   -1.78925149   -1.33828519   -0.62222906   -0.02160914   -0.01803613   -0.02201959
C   -0.77608038    0.69347543    0.15746367    0.03763659   -0.00375939    0.00336196
C   -0.82141714   -0.76706162   -0.07423352   -0.00610413    0.03103633    0.01446047
C    0.24963909    1.54038961   -0.12445702   -0.01303361   -0.00338310   -0.00697568
C    0.38696994   -1.53073083    0.36965733    0.05211652    0.00784900   -0.00047739
C    1.63257114    1.24380575   -0.31876595   -0.00012977    0.00750340    0.01457371
C    1.65994036   -1.17222527    0.35272307   -0.05737865   -0.01463605    0.01345877
H    0.03384616    2.60765923   -0.17099707    0.00503570   -0.00016712   -0.00153801
H    0.20801013   -2.55769072    0.67487531    0.00865853    0.00058752   -0.00043773
H    2.19303523    2.10687982   -0.69346591   -0.00362995    0.00606769   -0.00443122
H    2.38492548   -1.93625923    0.66065052    0.00322240   -0.00261437    0.00130161
C    2.27053242    0.02784186   -0.17767687    0.00513217   -0.01632660   -0.01505384
H    3.35267545    0.05557602   -0.31303276    0.00234906    0.00606979    0.00042926
   15
   -420.51460260
H   -2.02229262    2.11492479    0.39209456    0.00397024   -0.00858512   -0.00282849
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O   -1.78324393   -1.33942747   -0.62332696   -0.02125556   -0.02014593   -0.02208296
C   -0.77516042    0.69226886    0.16493736    0.03194330   -0.00636453    0.00667580
C   -0.81807972   -0.76193094   -0.07244041   -0.00353512    0.03666089    0.01507358
C    0.25471176    1.54671156   -0.12555769   -0.00493158    0.00384501   -0.00952497
C    0.38024341   -1.52923692    0.37244126    0.05313806    0.00924127   -0.00151760
C    1.62951862    1.24759544   -0.32196094   -0.01250524    0.01367560    0.01425685
C    1.64877445   -1.16819615    0.34920581   -0.06432392   -0.01451274    0.01276754
H    0.03761688    2.60789993   -0.17191411    0.00584002   -0.00393817   -0.00119290
H    0.21366088   -2.56028116    0.67937218    0.00980381   -0.00124243    0.00022125
H    2.21541117    2.10116731   -0.69130175    0.00020614    0.00672632   -0.00492075
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C    2.27262933    0.02241145   -0.17743748    0.00849731   -0.02401104   -0.01208238
H    3.36012916    0.04029208   -0.32338343    0.00699829    0.00545861   -0.00079283
   15
   -420.51423510
H   -1.99951808    2.10138755    0.39040364    0.00685397   -0.01484964   -0.00328127
O   -2.04553007    1.14485983    0.44533273   -0.01755102    0.00525760    0.00478518
O   -1.77628236   -1.33966323   -0.62342957   -0.01813306   -0.02023839   -0.02037155
C   -0.77616041    0.69144170    0.17200559    0.02384826   -0.00788225    0.01034198
C   -0.81452494   -0.75899770   -0.07155207   -0.00166945    0.03834306    0.01432064
C    0.26007887    1.55281204   -0.12608361    0.00393350    0.00892211   -0.01181523
C    0.37034932   -1.52829049    0.37531725    0.04505575    0.00840352   -0.00261772
C    1.62720634    1.25056047   -0.32601196   -0.02170985    0.01934073    0.01271733
C    1.64144250   -1.16329850    0.34491805   -0.06016819   -0.01255963    0.01173252
H    0.03724379    2.61083528   -0.17196957    0.00562361   -0.00539953   -0.00088794
H    0.21229118   -2.56200805    0.68371696    0.01030183   -0.00255675    0.00076100
H    2.23771472    2.09074682   -0.68566084    0.00277033    0.00513244   -0.00430915
H    2.36136241   -1.92134241    0.64779976   -0.00035499    0.00276736   -0.00052859
C    2.27420981    0.01841817   -0.17646651    0.01230925   -0.02871526   -0.00928730
H    3.36271712    0.02112434   -0.33318905    0.00882562    0.00407463   -0.00158854
   15
   -420.51483124
H   -1.98166690    2.09789343    0.39109907    0.00944503   -0.01071235   -0.00409339
O   -2.04611677    1.13728452    0.44356301   -0.01760153   -0.00305981    0.00436937
O   -1.76850810   -1.33898830   -0.62261438   -0.01233266   -0.01831940   -0.01692350
C   -0.77859570    0.69108576    0.17844773    0.01432718   -0.00830081    0.01414633
C   -0.81086558   -0.75836194   -0.07152340   -0.00050814    0.03575913    0.01228220
C    0.26521029    1.55838951   -0.12589791    0.01235261    0.01075700   -0.01350596
C    0.35777024   -1.52784091    0.37835092    0.02906414    0.00534641   -0.00359863
C    1.62618434    1.25236104   -0.33082595   -0.02647148    0.02392288    0.00998724
C    1.63770507   -1.15765492    0.33992526   -0.04721225   -0.00789818    0.00978948
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H    0.20353919   -2.56195766    0.68753172    0.01016511   -0.00280033    0.00100850
H    2.25811916    2.07675274   -0.67697752    0.00371350    0.00154640   -0.00268415
H    2.34910990   -1.91572842    0.64155456   -0.00321538    0.00575506   -0.00144098
C    2.27504303    0.01614629   -0.17493181    0.01666247   -0.03038964   -0.00688972
H    3.35915174   -0.00094168   -0.34188493    0.00730028    0.00210012   -0.00179389
   15
   -420.51549399
H   -1.97059599    2.10172627    0.39474111    0.01163572   -0.00024259   -0.00487507
O   -2.04590938    1.12986913    0.44159560   -0.01640737   -0.01682891    0.00380679
O   -1.76018319   -1.33748906   -0.62103716   -0.00416772   -0.01456998   -0.01192487
C   -0.78189480    0.69122719    0.18403470    0.00427434   -0.00780137    0.01787241
C   -0.80717225   -0.75986793   -0.07223208    0.00000526    0.02900945    0.00915885
C    0.26960294    1.56332910   -0.12489912    0.01913553    0.01014982   -0.01441526
C    0.34345824   -1.52770848    0.38160159    0.00812805    0.00109023   -0.00446690
C    1.62673972    1.25272540   -0.33623983   -0.02656280    0.02636701    0.00647191
C    1.63680085   -1.15155046    0.33434766   -0.02981280    0.00007464    0.00641773
H    0.02549912    2.62660244   -0.17028514    0.00207882    0.00034464   -0.00059687
H    0.18750664   -2.55995640    0.69063933    0.00934649   -0.00197166    0.00093236
H    2.27592936    2.06170661   -0.66639241    0.00334368   -0.00300525   -0.00050512
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   15
   -420.51550169
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   15
   -420.51479329
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   15
   -420.51377283
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   15
   -420.51246574
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   15
   -420.51127109
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   15
   -420.51093879
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   15
   -420.51164648
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   15
   -420.51289211
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   15
   -420.51396882
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   15
   -420.51461611
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   15
   -420.51444897
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C   -0.77071608   -0.75917289   -0.07853129    0.01641730   -0.00094372    0.00393272
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   15
   -420.51351034
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O   -1.73256925   -1.32093746   -0.61703339   -0.01014408   -0.01101027   -0.00979724
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C    1.64714038    1.24801404   -0.38701712    0.02261723    0.00217807   -0.01856166
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H    2.35705623   -1.95592463    0.52402630    0.00421148   -0.00043714   -0.00173617
C    2.23614572    0.03904012   -0.15340657    0.00415526    0.00430649    0.00764706
H    3.29881530   -0.01020922   -0.36283078   -0.00276851    0.00421606   -0.00163658
   15
   -420.51289319
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   15
   -420.51321043
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   15
   -420.51408823
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   15
   -420.51496676
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   15
   -420.51546478
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   15
   -420.51515971
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   15
   -420.51385594
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   15
   -420.51227627
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   15
   -420.51138162
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   15
   -420.51147902
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   15
   -420.51236163
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   15
   -420.51379343
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O   -1.75014922   -1.29032709   -0.60672669    0.01686141    0.01809074    0.00331409
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   15
   -420.51540482
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   15
   -420.51623403
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O   -1.76119521   -1.29090653   -0.60606403   -0.00412513    0.01219912   -0.00783772
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   15
   -420.51568131
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   15
   -420.51401381
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   15
   -420.51209531
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O   -1.77526847   -1.29555016   -0.60189441   -0.03018533    0.00345589   -0.02001619
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   15
   -420.51061114
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   15
   -420.51041715
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   15
   -420.51198325
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O   -1.77798692   -1.30187439   -0.59010003   -0.02888265    0.00228616   -0.01675731
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   15
   -420.51458587
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O   -1.77611170   -1.30417527   -0.58451153   -0.02164496    0.00394043   -0.01226648
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   15
   -420.51676497
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C   -0.75822267   -0.77998655   -0.11391729    0.01486626   -0.00901972    0.00003457
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   15
   -420.51759599
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C    1.58318185    1.20242976   -0.29128859   -0.02110740   -0.00442083    0.00306382
C    1.71652156   -1.20480305    0.32245553    0.00702154   -0.00102996    0.00406543
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   15
   -420.51700728
H   -2.07649294    2.10643552    0.64573675   -0.00631124   -0.00923328   -0.00038399
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O   -1.76652577   -1.31265965   -0.56548631    0.01203026    0.01297606    0.00599022
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C   -0.76741924   -0.77178332   -0.12665636   -0.00144973   -0.00728716   -0.01517338
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C    0.38443873   -1.53428048    0.40293548   -0.01258342   -0.00089710   -0.00125885
C    1.58263314    1.20349522   -0.28620160   -0.02375803   -0.00184780    0.00488439
C    1.72403012   -1.20140108    0.32295545    0.02196709    0.00552659    0.00158182
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H    2.20735109    2.06637858   -0.48004410   -0.00492087   -0.00238016    0.00711517
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C    2.26735390   -0.00439147   -0.21831340    0.01538145   -0.01083507   -0.00557301
H    3.30450413   -0.03882473   -0.51978723   -0.00573462   -0.00549420   -0.00374694
   15
   -420.51527694
H   -2.06795221    2.12300965    0.63236504   -0.00522291    0.00183072    0.00221640
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O   -1.76369775   -1.31646656   -0.55930673    0.02256138    0.01558407    0.01131752
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   15
   -420.51326678
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O   -1.76188113   -1.32097491   -0.55363436    0.02984141    0.01669216    0.01496738
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   15
   -420.51212211
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O   -1.76140147   -1.32623255   -0.54863285    0.03262115    0.01566421    0.01643863
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C    1.59018799    1.20743274   -0.27326708   -0.02928608   -0.00651092    0.01198035
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   15
   -420.51249324
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O   -1.76238373   -1.33219226   -0.54436861    0.03058336    0.01234760    0.01563152
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C    0.26414947    1.53806761   -0.05424615    0.03309515   -0.00373929   -0.01091199
C    0.35978574   -1.53299258    0.37479405   -0.05571959   -0.02446503    0.00168511
C    1.59613741    1.20929829   -0.27020532   -0.02756448   -0.00948033    0.01394666
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   15
   -420.51405026
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   15
   -420.51610993
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O   -1.76819003   -1.34553549   -0.53782333    0.01555905    0.00073868    0.00880881
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C   -0.78485191   -0.74154534   -0.13501801   -0.00282856    0.01784833   -0.02259050
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C    1.72458249   -1.19395202    0.32517923    0.03932053   -0.00457750    0.01159527
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C    2.26381061    0.01571251   -0.23011801   -0.01508525    0.01026615   -0.01906730
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   15
   -420.51795499
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O   -2.07169619    1.18816264    0.37091992   -0.00540281    0.00673779    0.00245657
O   -1.77234438   -1.35239918   -0.53523795    0.00572920   -0.00574998    0.00416411
C   -0.82583501    0.71606253    0.14067392   -0.00248544    0.01494579    0.01262639
C   -0.78575598   -0.73820059   -0.13097496    0.00370743    0.02395623   -0.01770887
C    0.26302716    1.51515255   -0.04901860    0.00789284   -0.01683659   -0.00574843
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C    1.62255003    1.21828861   -0.26625463   -0.00525285   -0.00354815    0.01412131
C    1.71554043   -1.19382681    0.32441991    0.02454898   -0.00966591    0.01423567
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H    2.20097806    2.10450755   -0.53190697   -0.00279501    0.00406438    0.00115008
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   15
   -420.51867546
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O   -1.77676096   -1.35900477   -0.53284187   -0.00350196   -0.01148560   -0.00038837
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C    1.63271869    1.22202112   -0.26669490    0.00485245    0.00231736    0.01247177
C    1.70505155   -1.19313504    0.32281112    0.00236949   -0.01129363    0.01465918
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   15
   -420.51762658
H   -1.97737934    2.15950080    0.48271448    0.00693680    0.00628638   -0.00043234
O   -2.07415940    1.19036809    0.36457682   -0.00801825   -0.01225832   -0.00066048
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C    0.25893676    1.50439271   -0.04360440   -0.01272077   -0.03086226   -0.00031907
C    0.38884939   -1.50807783    0.33947830    0.02401885    0.01156536   -0.00391730
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C    2.27038487    0.01985916   -0.22236895   -0.00338125    0.00223453   -0.02227269
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   15
   -420.51567847
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O   -1.78480391   -1.37047490   -0.52782729   -0.01575550   -0.01827393   -0.00724577
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C   -0.79103136   -0.73777401   -0.11367961    0.01539398    0.03034260   -0.00289810
C    0.25773484    1.50160773   -0.04078503   -0.01998165   -0.03199596    0.00172496
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C    2.27330070    0.02070472   -0.21713454   -0.00279939   -0.00126167   -0.02143490
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   15
   -420.51415311
H   -1.98712878    2.17149779    0.45083970    0.00554959    0.01064060   -0.00021530
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O   -1.78787887   -1.37503350   -0.52489984   -0.01755466   -0.01876223   -0.00896017
C   -0.82606351    0.69941284    0.15493560    0.00599080   -0.00038177    0.01228884
C   -0.79442610   -0.74125876   -0.10718356    0.01560990    0.02687948    0.00070351
C    0.25772469    1.50073123   -0.03806583   -0.02392988   -0.02788490    0.00295933
C    0.39964274   -1.49894126    0.32648739    0.05909023    0.01394476   -0.00092799
C    1.65956293    1.23140950   -0.27216523    0.02288726    0.00853261    0.00900723
C    1.67891675   -1.18720122    0.31296099   -0.06333939   -0.00866419    0.01137307
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H    2.25524585    2.07716330   -0.59983284    0.00072045   -0.00309242   -0.00232298
H    2.43481663   -1.92527310    0.63267163    0.01041019   -0.00112483    0.00193205
C    2.27639918    0.02162399   -0.21060759   -0.00481443   -0.00425634   -0.01984056
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   15
   -420.51361694
H   -1.99836624    2.16604318    0.43507476    0.00352117    0.00191241   -0.00106071
O   -2.07519783    1.19751003    0.35523741   -0.00670261   -0.00293526   -0.00010385
O   -1.79016926   -1.37874807   -0.52157078   -0.01618679   -0.01731679   -0.00935377
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C   -0.79875635   -0.74635596   -0.10072470    0.01412676    0.02079641    0.00321728
C    0.25914452    1.50151991   -0.03552174   -0.02444205   -0.01958852    0.00342948
C    0.40016870   -1.49564223    0.32013140    0.06213847    0.00961443    0.00085709
C    1.66608128    1.23352190   -0.27513981    0.02375460    0.00558034    0.00878086
C    1.67634497   -1.18410413    0.30821679   -0.06623754   -0.00847537    0.01111626
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H    2.27110412    2.07571322   -0.61501495    0.00396500   -0.00080926   -0.00422525
H    2.43417169   -1.92271607    0.60991498    0.00966461    0.00095892    0.00041001
C    2.27979388    0.02279637   -0.20288296   -0.00790386   -0.00639791   -0.01779426
H    3.36311468    0.08429147   -0.32704280    0.00195177    0.01084423    0.00165645
   15
   -420.51417399
H   -2.01212929    2.15934091    0.42006589    0.00131705   -0.00878686   -0.00179587
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O   -1.79173648   -1.38168332   -0.51782221   -0.01180974   -0.01418225   -0.00844436
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C   -0.80393393   -0.75270145   -0.09445454    0.01123602    0.01282438    0.00455962
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   15
   -420.51579383
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O   -1.79277746   -1.38398005   -0.51369483   -0.00486495   -0.00975862   -0.00638120
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C   -0.80978593   -0.75981782   -0.08845464    0.00732647    0.00390289    0.00480427
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   15
   -420.51802961
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O   -1.79360444   -1.38583677   -0.50928106    0.00386214   -0.00460793   -0.00349019
C   -0.83003608    0.68336107    0.15726946   -0.00702548   -0.01876735    0.01149189
C   -0.81607847   -0.76716993   -0.08274120    0.00290345   -0.00506079    0.00422626
C    0.27139708    1.50875244   -0.02908891   -0.00909184    0.00151724    0.00254190
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   15
   -420.51952356
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O   -1.79460922   -1.38748458   -0.50471023    0.01325908    0.00057714   -0.00025895
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C   -0.82254677   -0.77422004   -0.07728126   -0.00148800   -0.01322316    0.00322476
C    0.27712032    1.51138355   -0.02728608   -0.00008142    0.00102599    0.00193115
C    0.37156691   -1.48705725    0.29461559    0.00115342    0.01807030   -0.00878485
C    1.67800023    1.24022347   -0.29167770    0.02216294    0.00051689    0.00068046
C    1.69706279   -1.16716121    0.28263122    0.00617398    0.00466658    0.00649860
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H    2.29439011    2.06868125   -0.63869747    0.00425629   -0.00295937   -0.00421040
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C    2.29912060    0.03173757   -0.16263837   -0.00834213   -0.00666906   -0.00785671
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   15
   -420.51922662
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O   -1.79621303   -1.38915584   -0.50012669    0.02196828    0.00502803    0.00271052
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C   -0.82892777   -0.78047826   -0.07201655   -0.00534835   -0.01982102    0.00224611
C    0.28284736    1.51395950   -0.02559950    0.00921112   -0.00081872    0.00121421
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C    1.67756156    1.24184640   -0.29635968    0.02053081    0.00228696   -0.00303535
C    1.70446030   -1.16275825    0.27492306    0.02110868    0.01545866    0.00228197
H   -0.00628000    2.57710750   -0.01308396   -0.00702119    0.00391821    0.00162584
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H    2.38660520   -1.97159311    0.51575279   -0.00084253    0.00250371   -0.00133334
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   15
   -420.51781435
H   -2.07307332    2.19519728    0.36066967   -0.00500918    0.01343988   -0.00028425
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O   -1.79880582   -1.39104966   -0.49566284    0.02860048    0.00799324    0.00480083
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C    0.28802321    1.51657861   -0.02398653    0.01738494   -0.00145236    0.00052966
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C    1.67589139    1.24333486   -0.30086044    0.01690148    0.00331931   -0.00629007
C    1.71060408   -1.15928744    0.26707667    0.03146414    0.02568305   -0.00189755
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H    2.37993508   -1.99647540    0.50288167    0.00240552   -0.00536308    0.00096564
C    2.31210226    0.03872151   -0.13904706   -0.00495132   -0.00515916   -0.00141953
H    3.38382930   -0.03722798   -0.26728003   -0.00448553   -0.00692294    0.00369566
   15
   -420.51647641
H   -2.07733694    2.18922936    0.35014098   -0.00518654    0.00680312   -0.00048364
O   -2.06874309    1.21067395    0.33333087   -0.00365853    0.00273285    0.00024353
O   -1.80268409   -1.39329836   -0.49141155    0.03199413    0.00889771    0.00550205
C   -0.82782532    0.68377184    0.14870723   -0.01374246   -0.01732996    0.00828555
C   -0.84055368   -0.78917725   -0.06186756   -0.01022653   -0.02538839    0.00178045
C    0.29215951    1.51927231   -0.02240695    0.02320025    0.00048819    0.00010718
C    0.34545182   -1.49081401    0.28012231   -0.05111355    0.02743797   -0.01624689
C    1.67321135    1.24463087   -0.30498513    0.01087777    0.00275318   -0.00869181
C    1.71486236   -1.15734845    0.25933921    0.03829206    0.03170028   -0.00495044
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C    2.31908746    0.04270341   -0.12702139   -0.00447715   -0.00424287    0.00225943
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   15
   -420.51574707
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O   -1.80799950   -1.39594186   -0.48740374    0.03153286    0.00745261    0.00457242
C   -0.82527069    0.68677918    0.14516871   -0.01196724   -0.01324083    0.00712519
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C    0.29490869    1.52192296   -0.02083638    0.02583768    0.00506052    0.00016362
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C    1.66988217    1.24576646   -0.30858731    0.00316362    0.00101474   -0.01044189
C    1.71682028   -1.15729448    0.25189301    0.04200633    0.03137386   -0.00637179
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H    2.36066738   -2.03096973    0.47411471    0.00275640   -0.01298076    0.00284660
C    2.32634176    0.04694104   -0.11513256   -0.00364924   -0.00317597    0.00600166
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   15
   -420.51554043
H   -2.07502476    2.17111893    0.33026209   -0.00408758   -0.01291004   -0.00074159
O   -2.06536631    1.21269230    0.32698906   -0.00526076    0.02027253    0.00079316
O   -1.81473130   -1.39891516   -0.48359737    0.02726874    0.00380645    0.00205269
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C   -0.84979084   -0.79200621   -0.05221399   -0.01098519   -0.01790241    0.00442113
C    0.29611227    1.52426040   -0.01927872    0.02511452    0.01099379    0.00081392
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C    1.71625366   -1.15910445    0.24482393    0.04248910    0.02444491   -0.00616449
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H    2.26743937    2.10947907   -0.60922664    0.00232376    0.00162139   -0.00177599
H    2.34787058   -2.03523923    0.45688706   -0.00101476   -0.01028008    0.00203847
C    2.33380765    0.05137110   -0.10360569   -0.00103331   -0.00220543    0.00956615
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   15
   -420.51581564
H   -2.06921107    2.17228149    0.32109308   -0.00331502   -0.01173075   -0.00073842
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O   -1.82268868   -1.40205493   -0.47987952    0.01990711   -0.00149644   -0.00169559
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C    0.29581102    1.52593999   -0.01777293    0.02163357    0.01551362    0.00200890
C    0.34493772   -1.50731590    0.27360539   -0.05639006   -0.00326781   -0.00697314
C    1.66312098    1.24793524   -0.31379299   -0.01117395   -0.00040874   -0.01424937
C    1.71313692   -1.16236793    0.23812208    0.03902294    0.01264414   -0.00486292
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H    2.25988744    2.12321342   -0.60009662    0.00309830    0.00468408   -0.00182576
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H    3.41520065   -0.06098703   -0.27031754    0.00349442   -0.01221846   -0.00032453
   15
   -420.51651184
H   -2.06101454    2.18136140    0.31246227   -0.00246823   -0.00201566   -0.00083289
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O   -1.83154185   -1.40512363   -0.47608205    0.01056628   -0.00766046   -0.00614161
C   -0.81413442    0.69940481    0.13227870    0.00091546    0.00175778    0.00316008
C   -0.85642249   -0.79069434   -0.04368027   -0.00918339   -0.00137633    0.00949319
C    0.29420953    1.52670546   -0.01639020    0.01650690    0.01530689    0.00354116
C    0.35179761   -1.51336534    0.27258894   -0.04422595   -0.00877045   -0.00359438
C    1.66054261    1.24904433   -0.31516298   -0.01516403    0.00190944   -0.01695624
C    1.70768718   -1.16639022    0.23171333    0.03012761   -0.00028025   -0.00336554
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H    2.25019043    2.13370137   -0.58969128    0.00246023    0.00567197   -0.00122519
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C    2.34857011    0.06060844   -0.08247372    0.01191259   -0.00186373    0.01542232
H    3.42037995   -0.04545395   -0.27270156    0.00325386   -0.01047579   -0.00139163
   15
   -420.51723235
H   -2.05105210    2.19184900    0.30443931   -0.00143143    0.00854254   -0.00105033
O   -2.05854417    1.21043668    0.31720967   -0.00493633   -0.00688551    0.00109035
O   -1.84087173   -1.40784478   -0.47200552    0.00049980   -0.01382774   -0.01068686
C   -0.81012829    0.70380953    0.12748988    0.00696624    0.00670524    0.00177975
C   -0.85887381   -0.78964852   -0.04019316   -0.00805348    0.00698844    0.01219013
C    0.29161405    1.52657694   -0.01522227    0.01047210    0.00893967    0.00521976
C    0.36130279   -1.51892749    0.27179586   -0.02618997   -0.00594348   -0.00135325
C    1.65886690    1.25002869   -0.31550570   -0.01630236    0.00602418   -0.02001994
C    1.70045092   -1.17041296    0.22551189    0.01418994   -0.00983076   -0.00258008
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H    0.28920405   -2.57750547    0.44554426    0.01714210    0.00801795   -0.00070674
H    2.23880602    2.14024103   -0.57843866    0.00042429    0.00443919   -0.00005054
H    2.32870670   -2.02180757    0.40094103   -0.01252645    0.00542911   -0.00179399
C    2.35509096    0.06539591   -0.07322198    0.02082706   -0.00264852    0.01755010
H    3.42329676   -0.02244048   -0.27409552    0.00167144   -0.00769937   -0.00221728
   15
   -420.51736769
H   -2.04006691    2.19654484    0.29717358   -0.00025349    0.01329091   -0.00127976
O   -2.05580243    1.20955310    0.31385909   -0.00436181   -0.01371225    0.00123054
O   -1.85022602   -1.40994136   -0.46744580   -0.00911639   -0.01924822   -0.01477819
C   -0.80654359    0.70780929    0.12259298    0.01302532    0.01152417    0.00047942
C   -0.86083676   -0.78901735   -0.03744123   -0.00717692    0.01378262    0.01447917
C    0.28838900    1.52592808   -0.01437050    0.00368902   -0.00140499    0.00697151
C    0.37237071   -1.52415920    0.27108796   -0.00399010    0.00257635    0.00021580
C    1.65816428    1.25064667   -0.31463838   -0.01489875    0.01051611   -0.02293134
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   15
   -420.51649257
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O   -2.05286407    1.20926021    0.31045309   -0.00344783   -0.01231378    0.00125707
O   -1.85917205   -1.41116951   -0.46221888   -0.01731569   -0.02335642   -0.01798218
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H    2.35347160   -2.02232323    0.36786131   -0.00359370   -0.00134597   -0.00069347
C    2.36387774    0.07550821   -0.05799331    0.03444713   -0.00398905    0.02034419
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   15
   -420.51486422
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C   -0.80202674    0.71345275    0.11277720    0.02119926    0.01974462   -0.00149232
C   -0.86347657   -0.79049244   -0.03464551   -0.00699876    0.02019819    0.01659697
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C    1.65925674    1.24984046   -0.30863232   -0.00812085    0.01243973   -0.02566981
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   15
   -420.51366188
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O   -1.87445761   -1.41035671   -0.44923874   -0.02686016   -0.02630630   -0.02074508
C   -0.80157908    0.71460497    0.10797666    0.02136994    0.02203566   -0.00198913
C   -0.86416321   -0.79298516   -0.03472823   -0.00790791    0.01949284    0.01610782
C    0.27912197    1.52659684   -0.01475548   -0.01614621   -0.01722396    0.01152845
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C    1.66065031    1.24831460   -0.30333253   -0.00436943    0.00702086   -0.02461520
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C    2.36465557    0.08648883   -0.04764703    0.03285767   -0.00062834    0.02107536
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   15
   -420.51382273
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O   -1.88036645   -1.40818268   -0.44136068   -0.02756436   -0.02493927   -0.02017711
C   -0.80240747    0.71443429    0.10329461    0.01829432    0.02240045   -0.00213373
C   -0.86436816   -0.79664477   -0.03578000   -0.00950240    0.01641138    0.01458521
C    0.27749243    1.52873455   -0.01616834   -0.01927511   -0.01070328    0.01222217
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C    1.66230756    1.24638289   -0.29655162   -0.00048071   -0.00207914   -0.02206140
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H    2.21159637    2.15539056   -0.53709214   -0.00455139    0.00292458    0.00137838
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C    2.36200228    0.09209891   -0.04437845    0.02696015    0.00379307    0.02017877
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   15
   -420.51505631
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O   -1.88503477   -1.40488320   -0.43257173   -0.02558239   -0.02186349   -0.01843396
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C   -0.86399585   -0.80128768   -0.03770949   -0.01162348    0.01142814    0.01217212
C    0.27701481    1.53149697   -0.01831717   -0.01959417    0.00017959    0.01228016
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C    1.66399133    1.24458481   -0.28844130    0.00390458   -0.01274687   -0.01854479
C    1.68556088   -1.18007711    0.19258170   -0.05694706   -0.01003192   -0.00467542
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C    2.35772465    0.09747096   -0.04232480    0.01974569    0.00992414    0.01820350
H    3.43458719    0.14865967   -0.23243660    0.00463481    0.00923810   -0.00516548
   15
   -420.51627188
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O   -2.03759666    1.21001203    0.29268775    0.00812936   -0.01056308    0.00107456
O   -1.88855111   -1.40059683   -0.42294981   -0.02129176   -0.01739859   -0.01578008
C   -0.80698499    0.71015710    0.09430565    0.00451337    0.01752319   -0.00171282
C   -0.86291927   -0.80661508   -0.04037218   -0.01397609    0.00508473    0.00914973
C    0.27770764    1.53424859   -0.02120535   -0.01698022    0.01098002    0.01167858
C    0.40461339   -1.56668709    0.26225674    0.03994737   -0.01957298    0.01455484
C    1.66543630    1.24355343   -0.27921093    0.00879381   -0.02260412   -0.01470388
C    1.69516582   -1.17943562    0.18802171   -0.03522733   -0.01001035   -0.00474769
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C    2.35225232    0.10223741   -0.04136710    0.01261740    0.01710897    0.01526757
H    3.43108688    0.16331420   -0.21355143    0.00414941    0.00984247   -0.00433943
   15
   -420.51744427
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O   -2.03517590    1.21040619    0.28900148    0.01026676   -0.01734224    0.00118102
O   -1.89110779   -1.39552428   -0.41261409   -0.01532022   -0.01203995   -0.01255260
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C   -0.86099863   -0.81224674   -0.04358682   -0.01608447   -0.00191290    0.00583942
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C    0.39995348   -1.57339740    0.25863493    0.02367385   -0.02620068    0.01584073
C    1.66634991    1.24387489   -0.26909022    0.01357878   -0.02964325   -0.01106273
C    1.70688897   -1.17820022    0.18374999   -0.01102989   -0.00767458   -0.00505644
H    0.13393658    2.60020005   -0.00971109    0.01257928   -0.01094520   -0.00063970
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H    2.23371456    2.14683738   -0.52506348   -0.00078392    0.00538156   -0.00193026
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C    2.34601143    0.10596967   -0.04132982    0.00652654    0.02418193    0.01176747
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   15
   -420.51883189
H   -1.99076586    2.19618904    0.27402648    0.00177644    0.01199251   -0.00141763
O   -2.03321815    1.21155529    0.28526166    0.01163475   -0.01584628    0.00128395
O   -1.89297244   -1.38990660   -0.40170957   -0.00852179   -0.00636215   -0.00914102
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C   -0.85810938   -0.81776307   -0.04715512   -0.01737061   -0.00886057    0.00262358
C    0.28180081    1.53752224   -0.02901896   -0.00345235    0.01435190    0.00876929
C    0.39385955   -1.57856552    0.25406179    0.00773464   -0.02462062    0.01585264
C    1.66644835    1.24596858   -0.25829774    0.01717545   -0.03258109   -0.00796096
C    1.71929830   -1.17652365    0.17978602    0.00950681   -0.00086123   -0.00573669
H    0.11436478    2.60516760   -0.01360160    0.00966742   -0.00624118   -0.00008260
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C    2.33936910    0.10824737   -0.04200408    0.00168318    0.02966596    0.00823356
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   15
   -420.51977205
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O   -2.03178442    1.21339149    0.28146311    0.01197141   -0.00602081    0.00151501
O   -1.89444984   -1.38399922   -0.39038955   -0.00188009   -0.00096285   -0.00593908
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C   -0.85417666   -0.82274710   -0.05088432   -0.01724445   -0.01509120   -0.00015197
C    0.28438858    1.53783880   -0.03377010    0.00624922    0.00717086    0.00677362
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C    1.66552038    1.25001121   -0.24702098    0.01832217   -0.03124541   -0.00542718
C    1.73116524   -1.17481742    0.17617020    0.02373883    0.01026838   -0.00664510
H    0.08792303    2.61439134   -0.01744110    0.00524473    0.00236820    0.00059324
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C    2.33262083    0.10874593   -0.04317871   -0.00236012    0.03217717    0.00514656
H    3.40970454    0.16670172   -0.14238203   -0.00320243    0.00646605    0.00028082
   15
   -420.51952610
H   -1.99441049    2.17969070    0.27849798   -0.00080278   -0.00645363   -0.00096984
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O   -1.89583760   -1.37804511   -0.37879800    0.00361014    0.00361867   -0.00327872
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C   -0.84921039   -0.82682509   -0.05460766   -0.01525486   -0.02000072   -0.00224900
C    0.28659756    1.53772358   -0.03893056    0.01605718   -0.00048251    0.00470774
C    0.38112260   -1.58490401    0.24211473   -0.01988489   -0.01037701    0.01321765
C    1.66350206    1.25592692   -0.23541450    0.01594639   -0.02659503   -0.00320811
C    1.74162192   -1.17373793    0.17295545    0.03292945    0.02250693   -0.00738317
H    0.05773115    2.62196802   -0.02170819    0.00034693    0.01007856    0.00125171
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H    2.46695340   -1.98805440    0.25905187    0.00333589   -0.00099686   -0.00276705
C    2.32601411    0.10731735   -0.04466798   -0.00615772    0.03095060    0.00271757
H    3.40470685    0.15698028   -0.11749279   -0.00380962    0.00429035    0.00173295
   15
   -420.51876063
H   -1.99586093    2.17429329    0.28185879   -0.00193908   -0.01344349   -0.00090365
O   -2.03049653    1.21722562    0.27363542    0.00926261    0.01841092    0.00266791
O   -1.89738178   -1.37225071   -0.36705481    0.00714381    0.00700236   -0.00136633
C   -0.81521233    0.68556142    0.07350360   -0.02323843   -0.00322495   -0.00192910
C   -0.84333158   -0.82970240   -0.05819879   -0.01127607   -0.02313561   -0.00357623
C    0.28784371    1.53762221   -0.04437657    0.02419867   -0.00520315    0.00279301
C    0.37615107   -1.58689481    0.23489599   -0.03169903   -0.00574692    0.01141212
C    1.66053878    1.26344203   -0.22361428    0.00971615   -0.02010208   -0.00096031
C    1.75009947   -1.17400506    0.17018437    0.03957529    0.03188319   -0.00756267
H    0.02724881    2.62254841   -0.02686795   -0.00388337    0.01355657    0.00177738
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H    2.27826618    2.10755760   -0.49194141   -0.00131868   -0.00838039   -0.00293710
H    2.48276836   -1.99779156    0.25647945    0.00851225   -0.00696248   -0.00224905
C    2.31977908    0.10403548   -0.04632470   -0.00977220    0.02605357    0.00089188
H    3.40233304    0.14417541   -0.09383953   -0.00245066    0.00201061    0.00298626
   15
   -420.51872914
H   -1.99594185    2.17794548    0.28586757   -0.00263129   -0.01032452   -0.00079069
O   -2.03052071    1.21817112    0.26955515    0.00654892    0.01880280    0.00329247
O   -1.89924094   -1.36676887   -0.35524654    0.00826065    0.00901231   -0.00026349
C   -0.81346921    0.68024727    0.06963587   -0.02255613   -0.00673102   -0.00232211
C   -0.83677942   -0.83119084   -0.06157708   -0.00560236   -0.02421574   -0.00421692
C    0.28764288    1.53781331   -0.04999313    0.02908772   -0.00553530    0.00119419
C    0.37308767   -1.58851626    0.22698617   -0.04169997   -0.00539316    0.00979056
C    1.65700273    1.27216882   -0.21175656    0.00055155   -0.01276022    0.00139719
C    1.75618799   -1.17617224    0.16786664    0.04526721    0.03569494   -0.00695605
H   -0.00052303    2.61369554   -0.03329608   -0.00659831    0.01157250    0.00210480
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   15
   -420.51949852
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O   -1.90146568   -1.36169081   -0.34342355    0.00692703    0.00966746    0.00010539
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   15
   -420.52008555
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O   -1.90399689   -1.35704712   -0.33160334    0.00351833    0.00918821   -0.00007176
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C    0.28199200    1.53889757   -0.06137566    0.02586419    0.00509486   -0.00084072
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   15
   -420.52048109
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O   -1.90668198   -1.35281722   -0.31977847   -0.00135714    0.00789932   -0.00059413
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C    0.38043451   -1.59034507    0.19995955   -0.04976952   -0.01758245    0.00697866
C    1.64848197    1.30095311   -0.17717482   -0.02239971    0.01409824    0.00604443
C    1.75693096   -1.19440773    0.16301818    0.05392052    0.01164861   -0.00061793
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   15
   -420.52135370
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O   -1.90930298   -1.34894413   -0.30792635   -0.00688998    0.00618731   -0.00122291
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C   -0.81123028   -0.82378681   -0.07250614    0.01864243   -0.01014362   -0.00431070
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C    0.38892458   -1.58915757    0.19004383   -0.04043570   -0.01372519    0.00554853
C    1.64786348    1.30961246   -0.16628859   -0.02274908    0.02425317    0.00610899
C    1.75077778   -1.20280489    0.16168110    0.04672840   -0.00043524    0.00195048
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   15
   -420.52254435
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O   -1.91161191   -1.34535185   -0.29601938   -0.01226545    0.00445921   -0.00174915
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C    0.39982372   -1.58717624    0.17979670   -0.02387707   -0.00283300    0.00331571
C    1.64860104    1.31680918   -0.15576947   -0.01920626    0.03356505    0.00572338
C    1.74184858   -1.21119470    0.16022989    0.02974681   -0.00893578    0.00376068
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C    2.29611777    0.06986325   -0.05470699    0.00179980   -0.02452579   -0.00555183
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   15
   -420.52269584
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C    1.65048773    1.32198857   -0.14559652   -0.01318785    0.04034102    0.00532952
C    1.73116477   -1.21906255    0.15855656    0.00407597   -0.01388473    0.00452201
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C    2.29329968    0.06663427   -0.05523657    0.00477667   -0.02861979   -0.00612857
H    3.37643453    0.08014993   -0.01943919   -0.00351681   -0.00328131    0.00465848
   15
   -420.52137570
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C   -0.80190733   -0.81099848   -0.07789299    0.01944131    0.00660013   -0.00552531
C    0.24954664    1.53683509   -0.08866325   -0.01559706   -0.02144982   -0.00138121
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C    1.65316839    1.32475014   -0.13574757   -0.00642568    0.04275525    0.00525756
C    1.72025339   -1.22609602    0.15661383   -0.02528286   -0.01773709    0.00447364
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H    2.46893159   -2.01440856    0.30398859    0.00609352   -0.00202438   -0.00051205
C    2.29020796    0.06512368   -0.05539593    0.00477665   -0.03021526   -0.00661217
H    3.37385818    0.08130825   -0.02397548   -0.00316081   -0.00223542    0.00380638
   15
   -420.51943860
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O   -1.91450804   -1.33557484   -0.25978918   -0.01995318    0.00237209   -0.00164842
C   -0.77706363    0.66115030    0.04469051    0.02702163   -0.01152935   -0.00150844
C   -0.80124745   -0.80710382   -0.07906161    0.01535985    0.01037687   -0.00616398
C    0.24379739    1.53784063   -0.09384240   -0.02414851   -0.02647538   -0.00143847
C    0.43532624   -1.58343499    0.14842696    0.05097525    0.02913560   -0.00218296
C    1.65624071    1.32495326   -0.12621823   -0.00017541    0.03977447    0.00552707
C    1.71085536   -1.23205192    0.15440214   -0.05149191   -0.02245736    0.00410178
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   15
   -420.51788998
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C   -0.80150906   -0.80382863   -0.07985747    0.00976851    0.01252540   -0.00679658
C    0.23950212    1.54041062   -0.09893198   -0.03140406   -0.02425129   -0.00199313
C    0.44310665   -1.58503572    0.13812542    0.07017957    0.02792251   -0.00190561
C    1.65932711    1.32277557   -0.11702364    0.00541428    0.03191957    0.00588752
C    1.70452173   -1.23664436    0.15194153   -0.06783485   -0.02816371    0.00389323
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   15
   -420.51736628
H   -1.91564700    2.16632438    0.34181340    0.00526522    0.01291930    0.00129599
O   -2.02760325    1.19482817    0.21857302   -0.00455001   -0.00407581    0.00076630
O   -1.91217411   -1.32967379   -0.23526530   -0.01373971    0.00528619    0.00001131
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C    0.23709433    1.54441211   -0.10389779   -0.03629784   -0.01510034   -0.00317553
C    0.44670035   -1.58828768    0.12793466    0.07800720    0.01937706   -0.00075479
C    1.66208682    1.31868254   -0.10818430    0.01084813    0.02106424    0.00607127
C    1.70221709   -1.23953424    0.14924263   -0.06965494   -0.03369932    0.00423534
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H    2.25568211    2.23981580   -0.16373811   -0.00156019    0.00974281    0.00139853
H    2.43199627   -2.03800756    0.34254210    0.00264175   -0.00570094    0.00223611
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H    3.37353865    0.09159060   -0.05108040    0.00288578    0.00015852    0.00051672
   15
   -420.51782171
H   -1.91069005    2.15719931    0.34817871    0.00623384    0.01118008    0.00136580
O   -2.02583503    1.18938376    0.21254676   -0.00115704   -0.00605169   -0.00013090
O   -1.90998600   -1.32704486   -0.22298328   -0.00750148    0.00782520    0.00107870
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C   -0.80340491   -0.79954510   -0.08018537   -0.00320364    0.01154069   -0.00768704
C    0.23686577    1.54930448   -0.10866894   -0.03798075   -0.00164339   -0.00488702
C    0.44564225   -1.59269012    0.11778927    0.07289737    0.00669973    0.00040904
C    1.66418918    1.31331904   -0.09971082    0.01650740    0.00950588    0.00599212
C    1.70404983   -1.24039571    0.14628425   -0.05669097   -0.03730254    0.00521365
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H    2.41231446   -2.03659282    0.35260158   -0.00493133   -0.00056031    0.00162974
C    2.27738278    0.07561730   -0.05183726   -0.01399640   -0.00879242   -0.00745516
H    3.37118522    0.09538855   -0.06198526    0.00290025    0.00022946   -0.00073641
   15
   -420.51881073
H   -1.91015290    2.14046883    0.35362595    0.00613214    0.00219810    0.00034287
O   -2.02401887    1.18418688    0.20652206    0.00344609   -0.00100303    0.00008382
O   -1.90746175   -1.32477209   -0.21075005   -0.00012898    0.01062521    0.00211325
C   -0.78093921    0.66923668    0.03469815    0.01004754   -0.01137055    0.00443726
C   -0.80426327   -0.79847958   -0.07966453   -0.00885847    0.00886553   -0.00774295
C    0.23891448    1.55430057   -0.11314352   -0.03573087    0.01085761   -0.00677393
C    0.44022692   -1.59750641    0.10762492    0.05760220   -0.00430939    0.00041172
C    1.66529328    1.30737420   -0.09159895    0.02212143   -0.00077945    0.00576183
C    1.70926251   -1.23902243    0.14300969   -0.03414931   -0.03665201    0.00632209
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   15
   -420.51996377
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O   -1.90493190   -1.32298062   -0.19861207    0.00733287    0.01322073    0.00297542
C   -0.78451441    0.67298755    0.03178871    0.00005500   -0.01042868    0.00617609
C   -0.80459485   -0.79794595   -0.07867732   -0.01273570    0.00534077   -0.00742250
C    0.24310270    1.55867446   -0.11721002   -0.02921899    0.01664668   -0.00831017
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C    1.66506431    1.30146336   -0.08383577    0.02674683   -0.00848127    0.00556738
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C    2.27467140    0.08579126   -0.04738726   -0.02020168    0.01200004   -0.00716793
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   15
   -420.52084387
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O   -1.90273104   -1.32178635   -0.18660800    0.01380624    0.01511991    0.00355215
C   -0.78809262    0.67736527    0.02850715   -0.00999348   -0.00872801    0.00764236
C   -0.80416878   -0.79773423   -0.07724323   -0.01411848    0.00158635   -0.00670140
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H    2.39081728   -2.04070466    0.37689354   -0.01236456    0.00156814    0.00294086
C    2.27506681    0.09011060   -0.04450694   -0.02133193    0.02067611   -0.00683237
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   15
   -420.52069154
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O   -1.90114944   -1.32127402   -0.17476387    0.01837276    0.01593688    0.00379667
C   -0.79107203    0.68226758    0.02476565   -0.01890873   -0.00637477    0.00865516
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C    0.25612234    1.56467965   -0.12379193   -0.00708425    0.00609529   -0.00949833
C    0.40816367   -1.60976085    0.07754430   -0.00433810   -0.00503761   -0.00774039
C    1.65966995    1.29142642   -0.06931953    0.02680996   -0.01569387    0.00560066
C    1.73180997   -1.22392666    0.13096359    0.02288719    0.00105818    0.00300338
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H    2.24269185    2.19853214    0.00077393   -0.00952279   -0.00096563    0.00712826
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C    2.27674832    0.09319421   -0.04121417   -0.02162227    0.02643494   -0.00634521
H    3.35727679    0.11178854   -0.09213114   -0.00588655   -0.00150748   -0.00472425
   15
   -420.51940747
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O   -1.90039199   -1.32147993   -0.16309077    0.02043061    0.01547054    0.00372154
C   -0.79291909    0.68755277    0.02050366   -0.02556994   -0.00348760    0.00907432
C   -0.80088438   -0.79739696   -0.07322984   -0.00855674   -0.00459982   -0.00427332
C    0.26363331    1.56690574   -0.12623313    0.00499177   -0.00195793   -0.00958304
C    0.39634009   -1.61304221    0.06819452   -0.02203937   -0.00400635   -0.00999062
C    1.65451646    1.28774540   -0.06256735    0.01914502   -0.01688870    0.00560535
C    1.73781891   -1.21774499    0.12642753    0.03167803    0.01599240    0.00090203
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H    2.25567935    2.17945448    0.02069071   -0.00823040   -0.00384052    0.00748533
H    2.41786953   -2.04850458    0.38297842   -0.00030558   -0.01107802    0.00800375
C    2.27973367    0.09469761   -0.03753827   -0.02110666    0.02851042   -0.00573710
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   15
   -420.51794848
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O   -1.90055141   -1.32238297   -0.15158556    0.01982294    0.01374794    0.00339525
C   -0.79323572    0.69304660    0.01569612   -0.02904494   -0.00014693    0.00882784
C   -0.79835824   -0.79690043   -0.07079602   -0.00242136   -0.00643348   -0.00283113
C    0.27084935    1.56923445   -0.12809479    0.01569504   -0.00693104   -0.00965052
C    0.38583472   -1.61606169    0.05944216   -0.03681388   -0.00677638   -0.01085305
C    1.64823364    1.28508158   -0.05615311    0.00587106   -0.01716836    0.00542072
C    1.74192733   -1.21250450    0.12183151    0.03735515    0.02581348   -0.00014826
H    0.01085331    2.65051529   -0.20898257   -0.00251836    0.01374101   -0.00385310
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H    2.43406216   -2.04279188    0.37831786    0.00386552   -0.01297566    0.00916867
C    2.28398892    0.09449603   -0.03351550   -0.01924465    0.02675312   -0.00510848
H    3.36780760    0.12486653   -0.08945361   -0.00275410   -0.00124734   -0.00576398
   15
   -420.51729360
H   -1.98832008    2.11424550    0.38985638    0.00271764    0.01216452    0.00531340
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O   -1.90160117   -1.32390598   -0.14023378    0.01681376    0.01101346    0.00290689
C   -0.79181465    0.69854783    0.01035821   -0.02874548    0.00347312    0.00787993
C   -0.79569068   -0.79601976   -0.06819059    0.00472580   -0.00727977   -0.00145441
C    0.27712882    1.57195954   -0.12937239    0.02387964   -0.00739740   -0.00980326
C    0.37753923   -1.61865094    0.05133947   -0.04826366   -0.01354087   -0.01038071
C    1.64161429    1.28344824   -0.05006643   -0.01102993   -0.01584049    0.00517431
C    1.74378694   -1.20879296    0.11723748    0.04093200    0.02925695    0.00017643
H    0.01747473    2.64911278   -0.20789095   -0.00222550    0.01122156   -0.00360154
H    0.08881748   -2.66811428    0.22005464   -0.00896192   -0.00740825    0.00315883
H    2.29615948    2.14922601    0.04414000    0.00134237   -0.00239118    0.00797945
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C    2.28939715    0.09269330   -0.02918309   -0.01520819    0.02165109   -0.00460544
H    3.37683381    0.13283651   -0.08206327    0.00024940   -0.00045575   -0.00591742
   15
   -420.51722190
H   -2.01175635    2.10321287    0.38952456    0.00109442    0.00630083    0.00431730
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O   -1.90340688   -1.32592613   -0.12901371    0.01196501    0.00761316    0.00236690
C   -0.78867454    0.70383934    0.00454709   -0.02456745    0.00702150    0.00625947
C   -0.79330827   -0.79470410   -0.06549623    0.01174629   -0.00707173   -0.00026851
C    0.28198182    1.57510890   -0.13005676    0.02855213   -0.00334140   -0.01003663
C    0.37214319   -1.62040857    0.04386005   -0.05579663   -0.02267848   -0.00901947
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C    1.74317965   -1.20682059    0.11262665    0.04272971    0.02671728    0.00170856
H    0.02561485    2.63994427   -0.20423312   -0.00053401    0.00351708   -0.00290790
H    0.08122424   -2.65740114    0.19424999   -0.00759144    0.00139813    0.00130449
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H    2.45778531   -2.00624258    0.34973036    0.00331720   -0.00303107    0.00708009
C    2.29571171    0.08959269   -0.02457069   -0.00851892    0.01424297   -0.00436744
H    3.38572267    0.14110951   -0.07043075    0.00256658    0.00071793   -0.00574768
   15
   -420.51690015
H   -2.03599578    2.08795185    0.38616740   -0.00028945   -0.00452922    0.00197459
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O   -1.90575135   -1.32829045   -0.11790117    0.00601897    0.00392397    0.00185870
C   -0.78406624    0.70870883   -0.00163963   -0.01691134    0.01004449    0.00405161
C   -0.79163008   -0.79296597   -0.06278431    0.01756962   -0.00579159    0.00064949
C    0.28512836    1.57844650   -0.13013441    0.02918476    0.00334125   -0.01022721
C    0.37009684   -1.62080194    0.03692520   -0.05833386   -0.03025520   -0.00747852
C    1.63139615    1.28279275   -0.03883337   -0.04181966   -0.00600252    0.00553969
C    1.74000096   -1.20644373    0.10790972    0.04188381    0.02019986    0.00377108
H    0.03408988    2.62840189   -0.19849364    0.00190168   -0.00671110   -0.00201407
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C    2.30252964    0.08563565   -0.01969253    0.00049298    0.00583716   -0.00445286
H    3.39285442    0.14885279   -0.05467972    0.00340524    0.00210849   -0.00524121
   15
   -420.51672401
H   -2.06004379    2.07583657    0.38136972   -0.00140792   -0.01337995   -0.00002443
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O   -1.90836777   -1.33083309   -0.10687337   -0.00023170    0.00031945    0.00145660
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C   -0.79100463   -0.79088274   -0.06011017    0.02142138   -0.00348122    0.00126693
C    0.28652731    1.58159048   -0.12959495    0.02624666    0.00834080   -0.01014821
C    0.37154621   -1.61939808    0.03044479   -0.05448677   -0.03144874   -0.00632761
C    1.62962747    1.28318104   -0.03371082   -0.04943444    0.00146578    0.00647797
C    1.73431404   -1.20728593    0.10296720    0.03606061    0.01314921    0.00534195
H    0.04119745    2.62154898   -0.19129808    0.00399217   -0.01448920   -0.00127339
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H    2.47340633   -1.96279058    0.30132361   -0.00217953    0.01343475    0.00284594
C    2.30931187    0.08132409   -0.01454351    0.01063867   -0.00228182   -0.00485129
H    3.39762815    0.15507937   -0.03517050    0.00270262    0.00350055   -0.00446650
   15
   -420.51774183
H   -2.08306630    2.07279510    0.37645475   -0.00270685   -0.01320645    0.00012882
O   -2.03705948    1.14224696    0.14905004    0.00316086    0.00532455    0.00444212
O   -1.91097532   -1.33339159   -0.09591219   -0.00605310   -0.00288820    0.00119500
C   -0.77243368    0.71650985   -0.01458390    0.00489490    0.01330748   -0.00140354
C   -0.79166221   -0.78859312   -0.05751114    0.02281758   -0.00034169    0.00158673
C    0.28635046    1.58426191   -0.12844387    0.02086847    0.00726346   -0.00965186
C    0.37625607   -1.61613491    0.02434894   -0.04376987   -0.02437802   -0.00552610
C    1.63081253    1.28348147   -0.02898217   -0.04996816    0.00875968    0.00782269
C    1.72648349   -1.20893708    0.09770792    0.02293084    0.00867216    0.00569572
H    0.04551433    2.62468170   -0.18316345    0.00451361   -0.01493840   -0.00094920
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H    2.34302970    2.10875820    0.02556617    0.00857805   -0.00729500    0.00454520
H    2.48251782   -1.95255873    0.27327559   -0.00055566    0.01604474    0.00204388
C    2.31545425    0.07714418   -0.00909984    0.02006597   -0.00912228   -0.00549453
H    3.40050990    0.15879621   -0.01245540    0.00110695    0.00470921   -0.00351628
   15
   -420.51942744
H   -2.10410332    2.07871847    0.37131686   -0.00454644   -0.00425886    0.00237466
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O   -1.91331224   -1.33582150   -0.08500578   -0.01081806   -0.00541505    0.00107756
C   -0.76671470    0.71924447   -0.02101402    0.01638174    0.01347750   -0.00416577
C   -0.79368675   -0.78628485   -0.05500674    0.02162382    0.00321449    0.00163895
C    0.28491904    1.58652631   -0.12671036    0.01394173    0.00001351   -0.00889067
C    0.38358385   -1.61142438    0.01858569   -0.02732972   -0.01204781   -0.00450286
C    1.63498859    1.28326296   -0.02472746   -0.04437378    0.01387401    0.00933418
C    1.71730117   -1.21112824    0.09210913    0.00294704    0.00714889    0.00505003
H    0.04668839    2.63809226   -0.17432489    0.00324861   -0.00758597   -0.00096238
H    0.09755266   -2.66114950    0.08957406   -0.00730410   -0.00074935   -0.00065390
H    2.33817642    2.10670185    0.01046022    0.00467279   -0.01077348    0.00300626
H    2.49178844   -1.95356463    0.24370288    0.00495239    0.01348159    0.00208185
C    2.32039672    0.07350592   -0.00332304    0.02678534   -0.01396839   -0.00629920
H    3.40258445    0.15913506    0.01278606   -0.00033560    0.00562566   -0.00246585
   15
   -420.52041929
H   -2.12186792    2.08761618    0.36445363   -0.00645050    0.00624208    0.00488219
O   -2.04581601    1.13735393    0.13762813   -0.00179110   -0.01130126    0.00180533
O   -1.91516414   -1.33800909   -0.07414877   -0.01402953   -0.00704881    0.00109278
C   -0.76197931    0.72116834   -0.02719369    0.02644534    0.01277117   -0.00663445
C   -0.79700682   -0.78417032   -0.05260033    0.01798161    0.00663692    0.00146902
C    0.28264956    1.58879763   -0.12443870    0.00604511   -0.00870326   -0.00819513
C    0.39254808   -1.60598496    0.01309175   -0.00760475    0.00033279   -0.00291963
C    1.64182986    1.28222738   -0.02103692   -0.03508161    0.01459082    0.01079401
C    1.70795591   -1.21375575    0.08620591   -0.02003729    0.00642197    0.00416698
H    0.04557557    2.65676680   -0.16479225    0.00122373    0.00297801   -0.00100061
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   15
   -420.52074589
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O   -1.91638672   -1.33988082   -0.06334172   -0.01532073   -0.00762718    0.00120801
C   -0.75883000    0.72232389   -0.03297445    0.03387599    0.01124517   -0.00864382
C   -0.80140403   -0.78245366   -0.05028192    0.01227027    0.00934875    0.00113607
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C    1.65078771    1.28033919   -0.01799849   -0.02463063    0.00944866    0.01213218
C    1.69981192   -1.21676409    0.08004879   -0.04094491    0.00424884    0.00362560
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   15
   -420.52123804
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C   -0.80653574   -0.78129662   -0.04803172    0.00504849    0.01092390    0.00070840
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C    0.41064589   -1.59560950    0.00250424    0.03007146    0.01134920    0.00124982
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   15
   -420.52175704
H   -2.14516099    2.08033679    0.32146231   -0.00633670   -0.00064854    0.00298567
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O   -1.91680738   -1.34262284   -0.04190002   -0.01161540   -0.00549361    0.00154394
C   -0.75885595    0.72274467   -0.04288685    0.03765209    0.00603396   -0.01105545
C   -0.81196865   -0.78079351   -0.04582426   -0.00297159    0.01118762    0.00026216
C    0.27554594    1.59936356   -0.11473059   -0.01502165   -0.00240860   -0.00747516
C    0.41753089   -1.59132832   -0.00283706    0.04208842    0.00771571    0.00297703
C    1.67253687    1.27554083   -0.01419622   -0.00334872   -0.01359834    0.01443404
C    1.69171249   -1.22324570    0.06707173   -0.06034804   -0.00665857    0.00389715
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   15
   -420.52145341
H   -2.14300376    2.07192728    0.30113354   -0.00460163   -0.01115269    0.00071025
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O   -1.91617197   -1.34358895   -0.03128026   -0.00704396   -0.00305482    0.00166821
C   -0.76225848    0.72232246   -0.04687228    0.03368592    0.00287624   -0.01152466
C   -0.81722207   -0.78096063   -0.04363288   -0.01092275    0.01020277   -0.00013880
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C    0.42190682   -1.58749336   -0.00835489    0.04696348    0.00013026    0.00400979
C    1.68403711    1.27399018   -0.01356982    0.00808914   -0.02481653    0.01503896
C    1.69291075   -1.22606799    0.06023764   -0.05499374   -0.01368007    0.00431259
H    0.04059149    2.67180529   -0.12119627    0.00024966    0.00336008    0.00036520
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H    2.29626911    2.18905041   -0.07658169   -0.00078582    0.01010455   -0.00444159
H    2.42522665   -2.03644611    0.07814248    0.00246342    0.00130170   -0.00188306
C    2.32193533    0.06830748    0.03237231    0.00412191   -0.00123016   -0.01008930
H    3.40893678    0.09878677    0.14815022    0.00401403    0.00237985    0.00369468
   15
   -420.52051758
H   -2.13750490    2.07112397    0.28019577   -0.00326052   -0.01471331    0.00000277
O   -2.06520905    1.13247576    0.10686313   -0.00688262    0.00735421    0.00744984
O   -1.91522072   -1.34441826   -0.02073588   -0.00149446   -0.00013429    0.00171357
C   -0.76768224    0.72172504   -0.05016255    0.02649358   -0.00000659   -0.01162515
C   -0.82182048   -0.78173988   -0.04143355   -0.01777923    0.00820198   -0.00044812
C    0.27455307    1.60730594   -0.10599369   -0.02027163    0.02805268   -0.00670320
C    0.42347744   -1.58367148   -0.01411196    0.04492459   -0.00640492    0.00439735
C    1.69504670    1.27391682   -0.01384896    0.01976250   -0.03137752    0.01485201
C    1.69739399   -1.22807142    0.05314344   -0.04156701   -0.01894101    0.00459322
H    0.04005656    2.66032103   -0.11017344    0.00169835   -0.00638929    0.00068995
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H    2.28909755    2.20168453   -0.08878277   -0.00284062    0.01242172   -0.00552257
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C    2.31960586    0.06876884    0.04120229   -0.00365099    0.00533358   -0.00978172
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   15
   -420.51984003
H   -2.12961712    2.08027878    0.25914298   -0.00251806   -0.00805822    0.00111672
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O   -1.91420176   -1.34524153   -0.01026889    0.00408600    0.00280944    0.00167114
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C   -0.82535424   -0.78301130   -0.03920773   -0.02252968    0.00542570   -0.00064338
C    0.27583098    1.60923358   -0.10100364   -0.01920288    0.03873092   -0.00583019
C    0.42235794   -1.57949403   -0.02013388    0.03752618   -0.00682495    0.00456619
C    1.70486501    1.27570787   -0.01502116    0.03062694   -0.03138458    0.01363608
C    1.70437311   -1.22895403    0.04577230   -0.02454810   -0.01933879    0.00471676
H    0.03834676    2.65321300   -0.09963994    0.00233185   -0.01240775    0.00089164
H    0.26269303   -2.63560268   -0.06689253    0.01101745    0.01240553   -0.00113125
H    2.28405426    2.20562472   -0.09704383   -0.00626026    0.01057503   -0.00600173
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C    2.31748748    0.06891649    0.05062001   -0.00953575    0.01015705   -0.00872420
H    3.39799698    0.05631284    0.19021413   -0.00000623   -0.00258150    0.00482358
   15
   -420.51957553
H   -2.11991716    2.09494705    0.23725805   -0.00176457    0.00336547    0.00271144
O   -2.07103192    1.13062614    0.09273820   -0.00289022   -0.01441065    0.00363778
O   -1.91336440   -1.34619062    0.00012250    0.00867592    0.00530873    0.00156635
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C   -0.82754002   -0.78460844   -0.03694339   -0.02436195    0.00217098   -0.00076391
C    0.27825586    1.60886989   -0.09566221   -0.01530229    0.03950652   -0.00471232
C    0.41898787   -1.57493829   -0.02643289    0.02638752   -0.00058806    0.00491189
C    1.71284204    1.27936374   -0.01701265    0.03927972   -0.02484343    0.01134769
C    1.71284089   -1.22870006    0.03811568   -0.00812132   -0.01332015    0.00488456
H    0.03505890    2.65456030   -0.08974634    0.00132149   -0.01066564    0.00105492
H    0.27414976   -2.64320134   -0.08539858    0.01171430    0.00471990   -0.00136315
H    2.28354944    2.20215161   -0.10101960   -0.01014881    0.00541374   -0.00587971
H    2.34266368   -2.10204787   -0.01280549   -0.01496636   -0.00093660   -0.00416027
C    2.31593575    0.06846492    0.06056156   -0.01338872    0.01200386   -0.00692011
H    3.39162875    0.03693873    0.20619527   -0.00312159   -0.00499992    0.00480122
   15
   -420.51920463
H   -2.10896788    2.10739958    0.21347569   -0.00057044    0.01155739    0.00345786
O   -2.07369521    1.13037635    0.08537619   -0.00131473   -0.02463845    0.00230214
O   -1.91291394   -1.34737738    0.01044287    0.01146946    0.00695676    0.00144939
C   -0.79118723    0.72030743   -0.05587055   -0.00382507   -0.00183605   -0.01072330
C   -0.82826908   -0.78633607   -0.03463286   -0.02286291   -0.00123460   -0.00088086
C    0.28159534    1.60616277   -0.09003644   -0.00926622    0.03132812   -0.00346233
C    0.41403237   -1.57035994   -0.03303024    0.01314345    0.00820121    0.00547695
C    1.71846282    1.28450052   -0.01968600    0.04403536   -0.01411454    0.00818956
C    1.72181131   -1.22766324    0.03016288    0.00610231   -0.00292069    0.00517829
H    0.03090528    2.66318582   -0.08061535   -0.00105919   -0.00240450    0.00126004
H    0.27723121   -2.65405366   -0.10290425    0.01137902   -0.00535414   -0.00191154
H    2.29028696    2.19483496   -0.10078241   -0.01291068   -0.00057388   -0.00538560
H    2.33328102   -2.12544547   -0.03777490   -0.01332674   -0.00852922   -0.00502515
C    2.31518587    0.06730388    0.07091846   -0.01566300    0.01057595   -0.00449444
H    3.38745564    0.02113970    0.21873071   -0.00541938   -0.00701295    0.00455354
   15
   -420.51878454
H   -2.09763990    2.11199201    0.18727819    0.00112042    0.01213322    0.00300467
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O   -1.91297540   -1.34887573    0.02069731    0.01201847    0.00754082    0.00137932
C   -0.79940579    0.72008079   -0.05644543   -0.01350069    0.00045536   -0.01027463
C   -0.82763140   -0.78798984   -0.03226867   -0.01819034   -0.00449116   -0.00107358
C    0.28549186    1.60157924   -0.08420167   -0.00252659    0.01947599   -0.00212368
C    0.40828402   -1.56626625   -0.03995875   -0.00054147    0.01484674    0.00601562
C    1.72144877    1.29049004   -0.02285234    0.04314091   -0.00318804    0.00454509
C    1.73042386   -1.22644941    0.02189747    0.01803915    0.00738748    0.00533148
H    0.02753011    2.67346183   -0.07239266   -0.00359052    0.00719983    0.00148608
H    0.27215380   -2.66122425   -0.11903736    0.01042105   -0.01264681   -0.00243340
H    2.30613517    2.18777319   -0.09667227   -0.01258040   -0.00397522   -0.00483885
H    2.33341083   -2.14274386   -0.05912513   -0.01030319   -0.01552925   -0.00588623
C    2.31537765    0.06551655    0.08154472   -0.01687283    0.00650086   -0.00159888
H    3.38708324    0.01036011    0.22799357   -0.00598649   -0.00847821    0.00421054
   15
   -420.51894228
H   -2.08712030    2.10832508    0.15896296    0.00286108    0.00486177    0.00176809
O   -2.07886046    1.13325834    0.07033033   -0.00094765   -0.02180809    0.00296435
O   -1.91357387   -1.35071201    0.03088883    0.01035006    0.00704284    0.00140257
C   -0.80681479    0.71982132   -0.05639887   -0.02174477    0.00376559   -0.00983018
C   -0.82590581   -0.78937382   -0.02983890   -0.01108182   -0.00738540   -0.00139700
C    0.28954397    1.59581050   -0.07823882    0.00367752    0.00897343   -0.00070250
C    0.40256244   -1.56304642   -0.04724989   -0.01304990    0.01675900    0.00629233
C    1.72185848    1.29668680   -0.02629246    0.03581117    0.00502433    0.00065517
C    1.73795678   -1.22566193    0.01331244    0.02766207    0.01369234    0.00492812
H    0.02668653    2.67875080   -0.06523645   -0.00515163    0.01354263    0.00165672
H    0.25960037   -2.65962468   -0.13344657    0.00900860   -0.01440030   -0.00257111
H    2.33078635    2.18329205   -0.08907241   -0.00805230   -0.00287740   -0.00437490
H    2.34098680   -2.14908734   -0.07625866   -0.00769468   -0.01885569   -0.00638089
C    2.31658571    0.06334354    0.09226577   -0.01720221    0.00090652    0.00167528
H    3.39089999    0.00564436    0.23422342   -0.00455823   -0.00922459    0.00387036
   15
   -420.51970386
H   -2.07864538    2.10140542    0.12937513    0.00428280   -0.00636913    0.00052518
O   -2.08138030    1.13627345    0.06262056   -0.00180126   -0.01195377    0.00383839
O   -1.91463509   -1.35286454    0.04101631    0.00685546    0.00566410    0.00153696
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C   -0.82351664   -0.79031380   -0.02732382   -0.00265104   -0.00973679   -0.00187988
C    0.29338021    1.58947784   -0.07223386    0.00858302    0.00263272    0.00079488
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C    1.72012790    1.30259276   -0.02977092    0.02346734    0.01073285   -0.00350108
C    1.74382971   -1.22567263    0.00443366    0.03467708    0.01410789    0.00367936
H    0.02945771    2.67462015   -0.05926679   -0.00515089    0.01438332    0.00171962
H    0.24056586   -2.64802746   -0.14603520    0.00740225   -0.01004483   -0.00219597
H    2.36103877    2.18068768   -0.07832773   -0.00029554    0.00137909   -0.00381247
H    2.35417917   -2.14215529   -0.08883605   -0.00634005   -0.01720995   -0.00624871
C    2.31882757    0.06111770    0.10288341   -0.01615277   -0.00513640    0.00534017
H    3.39791518    0.00752138    0.23766589   -0.00183307   -0.00913634    0.00348007
   15
   -420.52045622
H   -2.07321468    2.09885418    0.09936632    0.00504926   -0.01396569   -0.00003893
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O   -1.91600284   -1.35527188    0.05107370    0.00215963    0.00369094    0.00177647
C   -0.81734618    0.71840344   -0.05454670   -0.03160279    0.01026528   -0.00903422
C   -0.82096714   -0.79066855   -0.02469432    0.00580367   -0.01135560   -0.00250386
C    0.29670613    1.58295992   -0.06627714    0.01174934    0.00143407    0.00232218
C    0.39405621   -1.55936834   -0.06295622   -0.03001828    0.00603233    0.00547727
C    1.71698720    1.30785088   -0.03303601    0.00929856    0.01613897   -0.00796870
C    1.74762059   -1.22650780   -0.00466301    0.03865383    0.00886796    0.00152524
H    0.03583832    2.66048077   -0.05452807   -0.00349682    0.00943173    0.00166060
H    0.21620722   -2.62947584   -0.15707388    0.00570027   -0.00111733   -0.00132017
H    2.39146842    2.17709675   -0.06485937    0.00805776    0.00554673   -0.00290381
H    2.37201966   -2.12310055   -0.09695217   -0.00632257   -0.01108952   -0.00546591
C    2.32203589    0.05920062    0.11317638   -0.01301661   -0.01083273    0.00935180
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   15
   -420.52070314
H   -2.07138010    2.10574519    0.06934724    0.00515545   -0.01170656    0.00000788
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O   -1.91746679   -1.35784562    0.06105013   -0.00302320    0.00142042    0.00210071
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C   -0.81876262   -0.79034098   -0.02191313    0.01308715   -0.01205163   -0.00319790
C    0.29933099    1.57633264   -0.06046064    0.01305044    0.00463443    0.00379334
C    0.39229053   -1.55828670   -0.07132330   -0.03301266   -0.00154458    0.00462999
C    1.71327596    1.31212557   -0.03581850   -0.00330112    0.02292676   -0.01255585
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H    2.39444604   -2.09620193   -0.10116036   -0.00680286   -0.00270719   -0.00423214
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   15
   -420.52038683
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O   -1.91879418   -1.36048376    0.07093086   -0.00806077   -0.00087128    0.00246968
C   -0.82046174    0.71461992   -0.05050922   -0.03025141    0.01123435   -0.00819427
C   -0.81733933   -0.78929022   -0.01893862    0.01834188   -0.01159921   -0.00388549
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C    1.70974364    1.31500524   -0.03784303   -0.01186219    0.03131247   -0.01686246
C    1.74824372   -1.22923689   -0.02295307    0.03368427   -0.00782250   -0.00437981
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H    2.42168708   -2.06728003   -0.10232610   -0.00589722    0.00443013   -0.00291533
C    2.33044298    0.05760966    0.13180346    0.00017847   -0.01931048    0.01795794
H    3.41954228    0.04877123    0.23469574    0.00340986   -0.00374273    0.00134320
   15
   -420.51988683
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O   -1.91975886   -1.36308246    0.08069925   -0.01237026   -0.00303459    0.00283324
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C   -0.81701286   -0.78754439   -0.01572975    0.02109331   -0.00983390   -0.00446039
C    0.30223160    1.56196727   -0.04959324    0.01262829    0.00996070    0.00622135
C    0.39456758   -1.55576397   -0.08886559   -0.02421917    0.00020317    0.00389151
C    1.70690239    1.31598787   -0.03885132   -0.01521525    0.04030206   -0.02045198
C    1.74538975   -1.23015714   -0.03179357    0.02228560   -0.01234232   -0.00729384
H    0.06115657    2.60536665   -0.04700325    0.00496227   -0.01533749    0.00114826
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C    2.33485129    0.05844524    0.13962011    0.00875759   -0.02143659    0.02196855
H    3.42280845    0.07009758    0.23098446    0.00252363   -0.00092990    0.00039926
   15
   -420.51937922
H   -2.08597510    2.14640784   -0.02041381    0.00189817    0.01325567   -0.00091380
O   -2.09136245    1.15844270    0.02140020   -0.01128735   -0.02340486    0.00419723
O   -1.92016663   -1.36554462    0.09033934   -0.01553210   -0.00485608    0.00312012
C   -0.81647934    0.70826488   -0.04450159   -0.01820357    0.00519259   -0.00676459
C   -0.81794858   -0.78521053   -0.01225225    0.02115356   -0.00672720   -0.00481353
C    0.30252380    1.55395096   -0.04468881    0.01267585    0.00382032    0.00711472
C    0.39808115   -1.55442630   -0.09799646   -0.01305372    0.00912817    0.00402607
C    1.70495649    1.31453997   -0.03862815   -0.01369120    0.04783892   -0.02296585
C    1.74121304   -1.23035084   -0.04019440    0.00601371   -0.01305114   -0.00991161
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C    2.33873391    0.06056790    0.14611157    0.01654147   -0.02169257    0.02530100
H    3.42429892    0.09209651    0.22698289    0.00095453    0.00182199   -0.00049268
   15
   -420.51876522
H   -2.09495208    2.14726346   -0.04950690    0.00012291    0.00954336   -0.00110680
O   -2.09222894    1.16528482    0.01261025   -0.01361838   -0.01591496    0.00393083
O   -1.91987529   -1.36778841    0.09983841   -0.01719900   -0.00617305    0.00326967
C   -0.81263431    0.70451150   -0.04086100   -0.00951780    0.00054900   -0.00571530
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C    0.40237674   -1.55363565   -0.10736971   -0.00046801    0.01712637    0.00393518
C    1.70382456    1.31022254   -0.03702198   -0.00940986    0.05059674   -0.02430626
C    1.73667675   -1.22976325   -0.04799710   -0.01106930   -0.01215085   -0.01225647
H    0.06527114    2.60751742   -0.04631960    0.00367452   -0.00347703    0.00070694
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H    2.51389673   -2.00457321   -0.09628640    0.01292082    0.00452797    0.00012059
C    2.34162902    0.06399131    0.15107765    0.02171436   -0.01968973    0.02763554
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   15
   -420.51823785
H   -2.10402170    2.14163456   -0.07784544   -0.00156908   -0.00044422   -0.00060949
O   -2.09247866    1.17282452    0.00364532   -0.01569444   -0.00210667    0.00280595
O   -1.91881014   -1.36975465    0.10918981   -0.01712225   -0.00682622    0.00323382
C   -0.80821693    0.70072678   -0.03687585   -0.00019594   -0.00448762   -0.00444525
C   -0.82346813   -0.77959065   -0.00442725    0.01384354    0.00229813   -0.00449124
C    0.30080486    1.53794006   -0.03621294    0.01205753   -0.01775957    0.00841608
C    0.40670935   -1.55385556   -0.11697767    0.01040892    0.02019563    0.00320721
C    1.70326288    1.30288858   -0.03395075   -0.00526058    0.04477275   -0.02465336
C    1.73279021   -1.22843790   -0.05506034   -0.02429681   -0.01176056   -0.01423957
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H    0.05871642   -2.60343529   -0.21967504   -0.01635115   -0.00812088    0.00000557
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H    2.53326918   -1.99193038   -0.09353134    0.01804019    0.00318672    0.00112209
C    2.34323050    0.06859197    0.15437865    0.02291542   -0.01503394    0.02873223
H    3.42603280    0.13049116    0.22053773   -0.00058481    0.00611081   -0.00174394
   15
   -420.51836761
H   -2.11198761    2.13634289   -0.10577329   -0.00298191   -0.01061829    0.00032248
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O   -1.91697514   -1.37141413    0.11839528   -0.01517968   -0.00670255    0.00297958
C   -0.80378606    0.69721280   -0.03262280    0.00879646   -0.00938868   -0.00299021
C   -0.82761389   -0.77684517   -0.00009972    0.00725619    0.00716279   -0.00371850
C    0.29883912    1.53120111   -0.03271987    0.00985107   -0.02356592    0.00874889
C    0.41043303   -1.55526377   -0.12677569    0.01720649    0.01673206    0.00171260
C    1.70302651    1.29289859   -0.02939217   -0.00235738    0.02879726   -0.02423570
C    1.73033719   -1.22639399   -0.06126517   -0.03042996   -0.01278645   -0.01566366
H    0.05935050    2.61881248   -0.04762267    0.00004746    0.01267806    0.00011819
H    0.05669360   -2.60049047   -0.23058605   -0.01660571   -0.00666102    0.00047861
H    2.36919681    2.13700980    0.04175254    0.00263367   -0.01133282    0.00264807
H    2.53990943   -1.98171028   -0.09158117    0.01888441    0.00394257    0.00207204
C    2.34346808    0.07408690    0.15594908    0.01971892   -0.00743890    0.02846732
H    3.42734334    0.14381652    0.21899401    0.00024193    0.00734490   -0.00203835
   15
   -420.51933845
H   -2.11781003    2.13822228   -0.13390010   -0.00433421   -0.01311706    0.00072456
O   -2.09078531    1.18759132   -0.01458498   -0.01746840    0.01750236   -0.00021750
O   -1.91445800   -1.37277260    0.12746653   -0.01147673   -0.00575435    0.00248142
C   -0.79988086    0.69426308   -0.02818957    0.01652849   -0.01358151   -0.00140346
C   -0.83219261   -0.77453065    0.00445067   -0.00050424    0.01157284   -0.00254200
C    0.29628537    1.52585408   -0.02975427    0.00611329   -0.02281136    0.00875471
C    0.41314223   -1.55765266   -0.13667365    0.01884547    0.00709722   -0.00049515
C    1.70293087    1.28120513   -0.02337172    0.00097824    0.00530350   -0.02302671
C    1.72968297   -1.22357017   -0.06652649   -0.02837480   -0.01509404   -0.01632863
H    0.05569370    2.61348003   -0.04851084   -0.00064754    0.01316672   -0.00004056
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H    2.53322943   -1.97446211   -0.09111189    0.01513361    0.00686102    0.00283561
C    2.34253190    0.08001700    0.15580434    0.01279405    0.00305547    0.02691722
H    3.42844686    0.15189727    0.21890568    0.00160657    0.00783149   -0.00211862
   15
   -420.52022750
H   -2.12051264    2.14893103   -0.16246252   -0.00567570   -0.00572898   -0.00021452
O   -2.08876472    1.19397082   -0.02372058   -0.01641025    0.01277213   -0.00022755
O   -1.91142563   -1.37387258    0.13642602   -0.00633871   -0.00408872    0.00175950
C   -0.79696559    0.69212836   -0.02367178    0.02233754   -0.01650338    0.00024469
C   -0.83673881   -0.77291190    0.00915308   -0.00867312    0.01515890   -0.00102669
C    0.29336764    1.52185405   -0.02731614    0.00124184   -0.01565291    0.00836471
C    0.41473472   -1.56045181   -0.14653921    0.01598263   -0.00616875   -0.00315215
C    1.70276207    1.26920125   -0.01596328    0.00695475   -0.02024336   -0.02090526
C    1.73071049   -1.21983199   -0.07080474   -0.01956318   -0.01764072   -0.01610656
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H    0.08630364   -2.58551197   -0.25414623   -0.00983589    0.00844042    0.00243833
H    2.31942799    2.18243897    0.05992486    0.00585781    0.00788530    0.00324948
H    2.51585102   -1.97222398   -0.09266756    0.00809694    0.01089172    0.00331177
C    2.34083338    0.08575141    0.15403696    0.00364554    0.01566351    0.02431233
H    3.42841525    0.15438410    0.22033273    0.00261025    0.00754336   -0.00202476
   15
   -420.52028188
H   -2.11914192    2.16354075   -0.19081308   -0.00677220    0.00540089   -0.00206797
O   -2.08600329    1.19978779   -0.03284943   -0.01440139    0.00353973    0.00069422
O   -1.90810874   -1.37478906    0.14530628   -0.00037743   -0.00191637    0.00087250
C   -0.79539021    0.69098280   -0.01916878    0.02595915   -0.01765920    0.00188526
C   -0.84076282   -0.77220451    0.01391654   -0.01636287    0.01765654    0.00070130
C    0.29037637    1.51877868   -0.02538183   -0.00390469   -0.00423003    0.00756648
C    0.41537129   -1.56288565   -0.15621480    0.01097558   -0.01782818   -0.00566117
C    1.70215781    1.25840304   -0.00729491    0.01576203   -0.04210792   -0.01795761
C    1.73290657   -1.21503669   -0.07411351   -0.00788340   -0.01818951   -0.01496428
H    0.04935666    2.57934639   -0.05025069    0.00085475   -0.00224672    0.00019806
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H    2.28878722    2.20033042    0.06560274    0.00395419    0.01397945    0.00285997
H    2.49266409   -1.97775964   -0.09658727    0.00071843    0.01370845    0.00343802
C    2.33891553    0.09053729    0.15080253   -0.00572009    0.02847211    0.02104761
H    3.42656906    0.15148158    0.22320951    0.00254261    0.00654445   -0.00179348
   15
   -420.52001871
H   -2.11293482    2.17450573   -0.21769240   -0.00721422    0.01261108   -0.00363088
O   -2.08258933    1.20543164   -0.04200895   -0.01215178   -0.00256260    0.00141650
O   -1.90477491   -1.37561943    0.15414725    0.00562118    0.00045551   -0.00009830
C   -0.79537388    0.69089460   -0.01477931    0.02744245   -0.01671840    0.00344403
C   -0.84380420   -0.77255836    0.01863744   -0.02264909    0.01885765    0.00245523
C    0.28761618    1.51596103   -0.02390348   -0.00796060    0.00672183    0.00645596
C    0.41534150   -1.56427840   -0.16555272    0.00635452   -0.02228915   -0.00728400
C    1.70059511    1.25010895    0.00245739    0.02552966   -0.05554405   -0.01458558
C    1.73558925   -1.20916628   -0.07652183    0.00194982   -0.01383549   -0.01291394
H    0.04566395    2.56128514   -0.05126749    0.00202574   -0.01218326    0.00049937
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H    2.25547646    2.20848638    0.06925425   -0.00091257    0.01460416    0.00190717
H    2.46877023   -1.99291432   -0.10295987   -0.00359108    0.01236189    0.00317745
C    2.33733453    0.09361451    0.14629619   -0.01328390    0.03861839    0.01757366
H    3.42296972    0.14389868    0.22737157    0.00119982    0.00500481   -0.00145751
   15
   -420.52039435
H   -2.10158254    2.17686077   -0.24203444   -0.00682242    0.01207694   -0.00393527
O   -2.07862343    1.21116497   -0.05122853   -0.01002381   -0.00168701    0.00103225
O   -1.90169306   -1.37646999    0.16299219    0.01079509    0.00269221   -0.00097683
C   -0.79700745    0.69180656   -0.01059746    0.02696787   -0.01359440    0.00487422
C   -0.84548692   -0.77404579    0.02321074   -0.02671065    0.01870101    0.00402494
C    0.28532383    1.51277127   -0.02281508   -0.00934684    0.01094747    0.00524738
C    0.41492128   -1.56436654   -0.17445591    0.00284998   -0.01837153   -0.00777643
C    1.69749742    1.24511607    0.01309199    0.03349967   -0.05750158   -0.01124552
C    1.73817597   -1.20249022   -0.07815338    0.00757412   -0.00345624   -0.01002194
H    0.04058502    2.55164868   -0.05263783    0.00201587   -0.01641329    0.00070357
H    0.17695309   -2.61068125   -0.30277810   -0.00080283    0.00503660    0.00179661
H    2.22294938    2.20647132    0.07155632   -0.00788334    0.00951166    0.00054194
H    2.44719931   -2.01664225   -0.11159624   -0.00366022    0.00568617    0.00250972
C    2.33654020    0.09438439    0.14072636   -0.01756735    0.04317900    0.01421939
H    3.41855894    0.13272969    0.23257771   -0.00098685    0.00314982   -0.00101935
   15
   -420.52091374
H   -2.08535069    2.17097767   -0.26364135   -0.00583056    0.00407895   -0.00265664
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   15
   -420.52070944
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O   -1.89714262   -1.37861127    0.18084400    0.01593631    0.00553653   -0.00205218
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C    0.28226650    1.50487385   -0.02152487   -0.00279719   -0.00668621    0.00315899
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C    1.68509277    1.24485248    0.03622900    0.03366039   -0.03254087   -0.00587020
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H    2.41014049   -2.06906666   -0.13352618    0.00012377   -0.01278003    0.00038678
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   15
   -420.52051434
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O   -1.89590472   -1.38003005    0.18989888    0.01525753    0.00586073   -0.00206803
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C   -0.84079895   -0.78487628    0.03522648   -0.02177567    0.01219832    0.00603608
C    0.28111836    1.50118452   -0.02119641    0.00270756   -0.01930974    0.00222253
C    0.41337546   -1.55984312   -0.19841909   -0.00628986   -0.00155551   -0.00733609
C    1.67579566    1.24813719    0.04840708    0.02203015   -0.01813769   -0.00395868
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H    0.02272760    2.57531729   -0.05945776   -0.00466162    0.00688381    0.00013229
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   15
   -420.52104250
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O   -1.89535143   -1.38171222    0.19904616    0.01254927    0.00550928   -0.00170495
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C    0.27980873    1.49864192   -0.02100206    0.00778499   -0.02784408    0.00122860
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C    1.74261339   -1.18172115   -0.08084336    0.01677077    0.03487692    0.00406304
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H    2.19137619    2.18795047    0.08611527   -0.01464493   -0.00434273   -0.00303203
H    2.37487970   -2.08857881   -0.15674381   -0.00393473   -0.01639296   -0.00106029
C    2.34338622    0.07509186    0.11179403   -0.00690064    0.00275950    0.00064034
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   15
   -420.52125891
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O   -1.89536165   -1.38364262    0.20826955    0.00826833    0.00470104   -0.00100117
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C    0.27803565    1.49775173   -0.02088138    0.01140689   -0.03016382    0.00012202
C    0.41386872   -1.55551785   -0.21211332   -0.00862288   -0.01245846   -0.00978600
C    1.65443993    1.25752762    0.07338241   -0.01892235   -0.00361034   -0.00054978
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H    2.36049936   -2.08076358   -0.16743845   -0.00915026   -0.01015869   -0.00093917
C    2.34678742    0.06775567    0.10392223   -0.00126959   -0.01123022   -0.00326514
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   15
   -420.52007401
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C   -0.83148793    0.70170239    0.00618687   -0.01484845    0.02250865    0.00885072
C   -0.82519388   -0.80218894    0.04417270    0.00295009    0.00147230    0.00343110
C    0.27558473    1.49865227   -0.02076692    0.01269538   -0.02590746   -0.00118444
C    0.41487214   -1.55244079   -0.21811760   -0.00723307   -0.02065339   -0.01154746
C    1.64480881    1.26272403    0.08597124   -0.03862051    0.00221039    0.00139989
C    1.73935350   -1.18193705   -0.08277174    0.01910931    0.02054483    0.00717649
H    0.02890261    2.57290293   -0.06758246   -0.00221578    0.00466591    0.00017056
H    0.32530185   -2.60675721   -0.40715042    0.01521130    0.00702389    0.00073509
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C    2.35026047    0.06108572    0.09624725    0.00531792   -0.02266698   -0.00703637
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   15
   -420.51822689
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O   -1.89626178   -1.38809607    0.22680669   -0.00246490    0.00276187    0.00107435
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C   -0.81961637   -0.80844624    0.04664636    0.01227707   -0.00321621    0.00179275
C    0.27238032    1.50109398   -0.02057949    0.01117157   -0.01667938   -0.00273646
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C    1.63748017    1.26777532    0.09847415   -0.05176457    0.01022873    0.00360541
C    1.73602273   -1.18418477   -0.08434938    0.01485739    0.01079762    0.00766304
H    0.03594119    2.56111953   -0.07040334    0.00104479   -0.00523059    0.00051766
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C    2.35340731    0.05577006    0.08899572    0.01279460   -0.03080816   -0.01039734
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   15
   -420.51742276
H   -1.91523030    2.18440153   -0.38097572    0.00603643    0.00674308   -0.00499733
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O   -1.89666977   -1.39053299    0.23602708   -0.00754147    0.00210083    0.00221015
C   -0.84178518    0.69797494    0.00773182   -0.03044917    0.02459363    0.00895960
C   -0.81477691   -0.81450617    0.04901258    0.02068734   -0.00847135   -0.00003248
C    0.26851198    1.50454053   -0.02022611    0.00724519   -0.00672539   -0.00441618
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C    1.63323757    1.27219730    0.11075775   -0.05606463    0.02035858    0.00605933
C    1.73182628   -1.18710925   -0.08639116    0.00420148    0.00554441    0.00825206
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C    2.35577882    0.05230002    0.08237006    0.02053934   -0.03543800   -0.01317524
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   15
   -420.51752536
H   -1.89842846    2.17552072   -0.38619812    0.00563599   -0.00377422   -0.00205909
O   -2.03851042    1.25006370   -0.13254904    0.01803911    0.00328910    0.00096929
O   -1.89673954   -1.39306651    0.24514764   -0.01156779    0.00180247    0.00322136
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C    0.26421216    1.50841796   -0.01960644    0.00196792   -0.00138115   -0.00598691
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C    1.63233911    1.27538287    0.12267378   -0.05114293    0.03145476    0.00872070
C    1.72740272   -1.19039526   -0.08893425   -0.01162727    0.00530653    0.00927016
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C    2.35691265    0.05095594    0.07653805    0.02735075   -0.03660356   -0.01530769
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   15
   -420.51735389
H   -1.88564434    2.16928319   -0.38991998    0.00457271   -0.01297751    0.00056932
O   -2.03630728    1.25441655   -0.14186631    0.01899147    0.01463123   -0.00169390
O   -1.89629027   -1.39568331    0.25412301   -0.01404988    0.00190298    0.00397211
C   -0.84496867    0.68853243    0.00709989   -0.03394611    0.01521597    0.00952126
C   -0.80921663   -0.82476342    0.05385681    0.03112762   -0.01880809   -0.00329176
C    0.25979556    1.51241321   -0.01862630   -0.00373300   -0.00259180   -0.00724772
C    0.42052331   -1.52978790   -0.23540848    0.01590873    0.02108065   -0.00362235
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C    1.72368400   -1.19401044   -0.09203888   -0.02777622    0.00670394    0.01048430
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H    2.42395683   -2.02931950   -0.21922963    0.00332337   -0.00202516   -0.00038167
C    2.35640493    0.05180875    0.07162881    0.03163675   -0.03441371   -0.01681928
H    3.42858253    0.06182486    0.24048380   -0.00046470   -0.00259985    0.00358270
   15
   -420.51696388
H   -1.87619185    2.17185985   -0.39390728    0.00411266   -0.01365773    0.00089491
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O   -1.89521056   -1.39838790    0.26291954   -0.01466157    0.00238657    0.00435367
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C   -0.80911987   -0.82834115    0.05652940    0.03171540   -0.02278074   -0.00423176
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C    0.42059028   -1.52475638   -0.23865886    0.02112542    0.03386763   -0.00081435
C    1.63899376    1.27552567    0.14475967   -0.02396913    0.04378080    0.01387211
C    1.72161859   -1.19802197   -0.09577664   -0.03874854    0.00635242    0.01151027
H    0.04090608    2.58724878   -0.08613218    0.00333127    0.00065315   -0.00070990
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C    2.35400401    0.05472689    0.06773373    0.03193566   -0.02903051   -0.01772828
H    3.42676110    0.06790637    0.22804611   -0.00093636   -0.00188218    0.00316755
   15
   -420.51732831
H   -1.86977842    2.18369161   -0.39839219    0.00480275   -0.00507766   -0.00114504
O   -2.03439732    1.26103472   -0.16026188    0.01396044    0.01442682   -0.00097831
O   -1.89347304   -1.40120204    0.27152009   -0.01330542    0.00319474    0.00431485
C   -0.84019059    0.67562068    0.00414889   -0.02536210   -0.00430886    0.01079728
C   -0.81092378   -0.83054707    0.05945458    0.02884544   -0.02555033   -0.00450657
C    0.25198790    1.52116287   -0.01529495   -0.01511426   -0.00946167   -0.00906470
C    0.41939859   -1.52172983   -0.24184976    0.02256629    0.03813473   -0.00001046
C    1.64495372    1.27178785    0.15462300   -0.01141275    0.03530465    0.01536045
C    1.72185261   -1.20240171   -0.10020838   -0.04100408    0.00286557    0.01211170
H    0.03435212    2.60664864   -0.09007263    0.00118628    0.01052189   -0.00168772
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H    2.47024183   -2.01620190   -0.24002076    0.01480204   -0.00588459   -0.00088441
C    2.34969487    0.05938549    0.06490751    0.02764544   -0.02060035   -0.01796225
H    3.42553250    0.07534731    0.21332711   -0.00007313   -0.00123056    0.00274070
   15
   -420.51842732
H   -1.86683961    2.19902739   -0.40202657    0.00573772    0.00605215   -0.00364544
O   -2.03446744    1.26328969   -0.16936641    0.00930178    0.00771966    0.00082546
O   -1.89113845   -1.40416189    0.27992644   -0.01018776    0.00419699    0.00385961
C   -0.83534846    0.66924043    0.00171491   -0.01853301   -0.01550957    0.01140598
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   15
   -420.51888899
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O   -1.88834640   -1.40731198    0.28815895   -0.00580862    0.00515163    0.00306940
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   15
   -420.51800603
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O   -1.88529261   -1.41069435    0.29625312   -0.00094073    0.00571794    0.00205883
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   15
   -420.51674973
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O   -1.88219451   -1.41433300    0.30425380    0.00353409    0.00548215    0.00105187
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   15
   -420.51635780
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O   -1.87925224   -1.41821622    0.31220609    0.00681275    0.00413231    0.00023311
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C    0.25289671    1.54462443    0.00350214   -0.02960098    0.03877953   -0.01221010
C    0.39993772   -1.53094518   -0.25484338   -0.00966179   -0.00075905   -0.01064047
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   15
   -420.51701290
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C    0.25812096    1.54518007    0.00938325   -0.02618646    0.03916478   -0.01111120
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   15
   -420.51791547
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O   -1.87434219   -1.42641075    0.32809552    0.00786663   -0.00236657   -0.00024505
C   -0.79792733    0.66727873   -0.02729266    0.02080258   -0.03554566    0.00805260
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   15
   -420.51860414
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O   -1.87242252   -1.43042867    0.33605411    0.00571250   -0.00711445    0.00016938
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   15
   -420.51960234
H   -1.93533447    2.22681766   -0.36764413    0.00157101    0.01256210   -0.00193322
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O   -1.87075762   -1.43412220    0.34400374    0.00238183   -0.01228577    0.00092513
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C   -0.85102440   -0.79047076    0.08948610   -0.02105489    0.01432530    0.00765193
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   15
   -420.52073811
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   15
   -420.52063312
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O   -1.86757239   -1.43961068    0.35973219   -0.00531986   -0.02181712    0.00289098
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C   -0.85056635   -0.77983105    0.09317872   -0.01634690    0.02596375    0.00871649
C    0.29695350    1.52923557    0.04576666    0.02689066   -0.02441017    0.00174716
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C    2.29996569    0.06549798    0.07934987   -0.00931957   -0.00952574    0.00177470
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   15
   -420.51877869
H   -1.97454478    2.20398407   -0.34436051    0.00059272   -0.00394783    0.00070596
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C   -0.84877526   -0.77670171    0.09424870   -0.01316793    0.02890994    0.00895707
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C    1.64637556    1.29299413    0.22352215   -0.04741819    0.02383860   -0.00596282
C    1.73260103   -1.21742817   -0.20613289    0.02865463   -0.01538048   -0.00151842
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H    2.40054698   -2.03080073   -0.40416197   -0.01131632    0.00632517    0.00254733
C    2.30064465    0.06009899    0.08157814   -0.00406244   -0.01777552    0.00233953
H    3.39196101    0.12964282    0.06936001    0.00285732    0.00422764   -0.00553115
   15
   -420.51687992
H   -1.98897727    2.19257128   -0.33640255    0.00032555   -0.01247376    0.00147239
O   -2.03301173    1.23603110   -0.27171046   -0.00111212    0.01069607   -0.00234797
O   -1.86345227   -1.44119734    0.37493897   -0.01109428   -0.02762554    0.00466343
C   -0.79681513    0.72430937   -0.07197939    0.00989746    0.02916427   -0.00561120
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   15
   -420.51664093
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   15
   -420.51749674
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   15
   -420.51806283
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O   -1.85350608   -1.43426491    0.39613358   -0.01121767   -0.02624610    0.00539764
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C   -0.83559121   -0.78136109    0.09322149   -0.00176093    0.01930841    0.00736531
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C    0.38826781   -1.55972145   -0.24279571    0.01700126    0.00502275    0.00072762
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   15
   -420.51889448
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O   -1.84912433   -1.42949146    0.40271046   -0.00841937   -0.02317355    0.00486175
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C   -0.83165452   -0.78609312    0.09175873   -0.00046136    0.01227451    0.00660016
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C    0.38701581   -1.55847021   -0.23967056    0.01931739    0.01277067    0.00302328
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   15
   -420.52065489
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H    2.40779958   -2.00755423   -0.50764492    0.00967789   -0.01018898   -0.00280075
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   15
   -420.52205766
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C    2.29802789    0.05790442    0.09098052   -0.00449863    0.00648383    0.00757123
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   15
   -420.52122629
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C    1.69232978    1.25577136    0.26226229    0.02240972   -0.02296464   -0.00028167
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C    2.29652029    0.06016590    0.09089124   -0.01186702    0.01931116    0.00835655
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   15
   -420.51886798
H   -2.08133870    2.15624333   -0.30148716   -0.00361747   -0.01443237    0.00058685
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O   -1.82989124   -1.40188176    0.42731993    0.01166112   -0.00491641   -0.00016400
C   -0.80682667    0.72245878   -0.10935287   -0.01783101    0.00743438   -0.01374900
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C    0.27036321    1.56776670    0.11144787   -0.01885702    0.01128952    0.00091719
C    0.37305311   -1.55935866   -0.22933564   -0.00828559   -0.00936344    0.00469877
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   15
   -420.51686881
H   -2.08358096    2.15884299   -0.29983226   -0.00406315   -0.00739374    0.00079870
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O   -1.82579873   -1.39388823    0.43333404    0.01584446   -0.00120320   -0.00120097
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C   -0.81170614   -0.81031832    0.07951843    0.00046600   -0.02899227    0.00070296
C    0.26507253    1.57559864    0.11732065   -0.02542363    0.03038367    0.00196696
C    0.36942686   -1.55933964   -0.22741209   -0.01519324   -0.00764054    0.00674001
C    1.70537451    1.23568052    0.27107827    0.04376923   -0.05909160   -0.00255062
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C    2.29591336    0.06058071    0.08916851   -0.01795233    0.03569849    0.00887803
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   15
   -420.51572282
H   -2.08290446    2.16648463   -0.29877850   -0.00439175    0.00429989    0.00142172
O   -2.04321536    1.19260726   -0.34940480    0.00259313    0.00324160   -0.00383323
O   -1.82241898   -1.38583556    0.43940061    0.01839546    0.00132699   -0.00168717
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C   -0.80771581   -0.81173499    0.07657652    0.00220936   -0.03263087   -0.00161790
C    0.26130619    1.58162201    0.12307444   -0.02931532    0.04370133    0.00302251
C    0.36670019   -1.55889742   -0.22590099   -0.01834409    0.00159224    0.00970589
C    1.70825366    1.23052386    0.27569361    0.05266643   -0.05774874   -0.00111482
C    1.67237577   -1.16450420   -0.31241257    0.00449479    0.00681572   -0.01121224
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H    2.37317653   -1.93593035   -0.58262494   -0.00493495    0.00835375    0.00100153
C    2.29717440    0.05776896    0.08750701   -0.01518392    0.03420140    0.00794753
H    3.36435800   -0.03484591    0.26003318   -0.00370096   -0.00453305    0.00408306
   15
   -420.51466051
H   -2.07910417    2.17124689   -0.29875080   -0.00410191    0.01256825    0.00208797
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O   -1.81986671   -1.37783812    0.44554126    0.01904364    0.00254698   -0.00151257
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C   -0.80386234   -0.81119400    0.07373425    0.00459690   -0.03312706   -0.00429316
C    0.25929462    1.58506131    0.12864890   -0.02961033    0.04559153    0.00342555
C    0.36506818   -1.55855815   -0.22497629   -0.01854235    0.01220055    0.01254472
C    1.70796340    1.22879868    0.28036890    0.05832368   -0.04448110    0.00176299
C    1.67085944   -1.15690529   -0.31817372   -0.00057524    0.02339871   -0.00654004
H    0.03798452    2.62950132    0.22045881    0.00344822   -0.01186890    0.00173116
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H    2.37945987   -1.94193503   -0.60159309    0.00279919   -0.00028644   -0.00239665
C    2.29934060    0.05292451    0.08537036   -0.00980381    0.02564672    0.00593196
H    3.36003074   -0.04161268    0.27256839   -0.00633044   -0.00432991    0.00451990
   15
   -420.51381377
H   -2.07239309    2.16743498   -0.30020697   -0.00310470    0.01303457    0.00243555
O   -2.05189430    1.18350878   -0.36436305   -0.01155315   -0.00229941   -0.00782124
O   -1.81817162   -1.36995172    0.45174804    0.01786386    0.00256625   -0.00068154
C   -0.78775808    0.69804971   -0.10890534    0.00601364   -0.02081835   -0.00552155
C   -0.80028765   -0.80866507    0.07115266    0.00712678   -0.03049432   -0.00714427
C    0.25905530    1.58579714    0.13402003   -0.02625500    0.03700407    0.00310524
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C    1.70417708    1.22973979    0.28493714    0.05765242   -0.02658090    0.00468201
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   15
   -420.51395803
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O   -1.81728162   -1.36217833    0.45798366    0.01523828    0.00164999    0.00067026
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C    1.66822051   -1.14672509   -0.32875187   -0.00828228    0.04487468    0.00022442
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C    2.30508663    0.03945856    0.08021299    0.00145390   -0.00326212   -0.00049619
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   15
   -420.51501328
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O   -1.81707970   -1.35447773    0.46418769    0.01173025    0.00016876    0.00231834
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C   -0.79455098   -0.79844102    0.06745083    0.01055736   -0.01748074   -0.01237797
C    0.26294273    1.58135934    0.14423001   -0.01271212    0.01322855    0.00251629
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C    1.68694830    1.23572664    0.29320169    0.02628995   -0.00739266    0.00378106
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   15
   -420.51563173
H   -2.04326637    2.12565749   -0.31449517    0.00138010   -0.01335109    0.00183618
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O   -1.81740901   -1.34678412    0.47028639    0.00793803   -0.00149608    0.00400954
C   -0.77571608    0.69079150   -0.10460493    0.01980117   -0.02099286    0.00165844
C   -0.79259388   -0.79152576    0.06664501    0.01094281   -0.00851540   -0.01432445
C    0.26626101    1.57757837    0.14909969   -0.00469962    0.00703799    0.00316314
C    0.36860300   -1.56590600   -0.22951285   -0.00959031   -0.00377882    0.01198717
C    1.67537165    1.23960205    0.29695063    0.00155733   -0.00452783    0.00029825
C    1.66735626   -1.14681018   -0.33920123   -0.00551763    0.03821635   -0.00168696
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C    2.31054245    0.02671568    0.07515583    0.01034465   -0.02958964   -0.00594524
H    3.38112183   -0.03985461    0.28537002    0.00299818   -0.00295028    0.00716117
   15
   -420.51536024
H   -2.03412839    2.12208986   -0.32212457    0.00280152   -0.01105358    0.00238973
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O   -1.81809946   -1.33902325    0.47620389    0.00437884   -0.00299965    0.00550809
C   -0.77379284    0.69100016   -0.10318831    0.02119286   -0.01819211    0.00338209
C   -0.79129449   -0.78409762    0.06670222    0.01052049    0.00088908   -0.01561330
C    0.26986552    1.57334292    0.15377443    0.00290277    0.00658395    0.00453907
C    0.37132206   -1.56870942   -0.23266296   -0.00639016   -0.01747477    0.00956450
C    1.66368821    1.24374094    0.30068052   -0.02083321    0.00020656   -0.00303249
C    1.66749398   -1.15048681   -0.34432415   -0.00265329    0.02645411   -0.00529055
H   -0.03487213    2.63675202    0.25065134   -0.00866039    0.01050703    0.00228116
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C    2.31246305    0.02264558    0.07308907    0.01546579   -0.03751959   -0.00675555
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   15
   -420.51504423
H   -2.02700585    2.12600744   -0.33149873    0.00417604   -0.00108381    0.00332353
O   -2.05975643    1.15595267   -0.39478172   -0.03263122    0.00260589   -0.01298319
O   -1.81899093   -1.33112801    0.48187292    0.00143594   -0.00405551    0.00662854
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C   -0.79062836   -0.77672020    0.06769998    0.00950075    0.00970090   -0.01615578
C    0.27330018    1.56868430    0.15817215    0.00937638    0.01103207    0.00640840
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C    1.66780944   -1.15576472   -0.34912934   -0.00319414    0.01498245   -0.00842398
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H    2.33726181   -1.92489164   -0.65461007   -0.01312126    0.01527698    0.00301201
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H    3.39018881   -0.02523643    0.26324996    0.00499135   -0.00203858    0.00624584
   15
   -420.51559470
H   -2.02286782    2.13071884   -0.34324824    0.00516800    0.00879868    0.00397634
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O   -1.81995080   -1.32305131    0.48724310   -0.00064026   -0.00443649    0.00724644
C   -0.77374053    0.69449112   -0.10103404    0.01877946   -0.01052208    0.00523618
C   -0.79053470   -0.76992177    0.06967080    0.00804121    0.01697707   -0.01589989
C    0.27617409    1.56335091    0.16218234    0.01466227    0.01682713    0.00825879
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C    1.64496481    1.25143098    0.30878544   -0.04453014    0.01984847   -0.00496360
C    1.66834933   -1.16197522   -0.35343699   -0.00972724    0.00853148   -0.00928166
H   -0.02814658    2.59042859    0.24979916   -0.00278980   -0.01293697   -0.00056968
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C    2.31314824    0.02147495    0.07011977    0.02649174   -0.04093370   -0.00422879
H    3.38947125   -0.01556017    0.24520707    0.00301925   -0.00164894    0.00488891
   15
   -420.51668466
H   -2.02241100    2.12946772   -0.35782308    0.00548967    0.01261536    0.00400868
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O   -1.82088548   -1.31477644    0.49228670   -0.00168570   -0.00398717    0.00727660
C   -0.77546804    0.69731181   -0.10040827    0.01545819   -0.00606214    0.00532873
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C    0.38053283   -1.57002262   -0.24527695    0.01051981   -0.00896760    0.00840871
C    1.63934493    1.25380236    0.31327279   -0.04321120    0.03312692   -0.00267273
C    1.66949822   -1.16872808   -0.35719429   -0.02023313    0.00714054   -0.00802961
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H    2.34663549   -1.95225340   -0.66815532   -0.00598256    0.00500021   -0.00023825
C    2.31125977    0.02458401    0.06906836    0.02971837   -0.03702542   -0.00167363
H    3.38661795   -0.00469214    0.22365577    0.00035054   -0.00140483    0.00328767
   15
   -420.51757949
H   -2.02586000    2.11961313   -0.37525412    0.00507828    0.00854355    0.00352964
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O   -1.82174788   -1.30632409    0.49700248   -0.00161251   -0.00262611    0.00668064
C   -0.77812542    0.70049805   -0.10010209    0.01112101   -0.00137840    0.00488518
C   -0.79168315   -0.75967603    0.07641932    0.00363406    0.02457864   -0.01289340
C    0.27896992    1.54966896    0.16864860    0.02435546    0.00969733    0.00936239
C    0.38282908   -1.56864919   -0.25045769    0.01419021    0.00285893    0.00956745
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C    1.67186333   -1.17591883   -0.36046772   -0.02930878    0.00700281   -0.00640838
H   -0.01241015    2.57624370    0.25003367   -0.00045850   -0.01665599   -0.00130922
H    0.18788451   -2.63822547   -0.43800389    0.00478963   -0.01140686   -0.00089285
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H    2.35980946   -1.97405437   -0.67558672    0.00148624   -0.00482585   -0.00358294
C    2.30759408    0.02991651    0.06811701    0.02898340   -0.02995585    0.00113511
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   15
   -420.51815899
H   -2.03293742    2.10396340   -0.39521811    0.00420396   -0.00131877    0.00290060
O   -2.04208693    1.13146786   -0.40936458   -0.01616597   -0.00966253   -0.00880600
O   -1.82254135   -1.29775590    0.50141742   -0.00042260   -0.00037725    0.00547405
C   -0.78145165    0.70376764   -0.10008871    0.00603012    0.00331134    0.00392552
C   -0.79265759   -0.75668732    0.08101516    0.00046961    0.02466581   -0.01014084
C    0.27831088    1.54176118    0.17103976    0.02767054   -0.00496625    0.00827157
C    0.38428493   -1.56742335   -0.25621364    0.01434049    0.00978745    0.01005221
C    1.63536644    1.25187226    0.32250601   -0.02492362    0.04872027    0.00313504
C    1.67597050   -1.18352150   -0.36334747   -0.03243922    0.00466543   -0.00596878
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C    2.30220158    0.03704670    0.06709659    0.02313882   -0.02004230    0.00402351
H    3.38123842    0.01999084    0.17457222   -0.00136348   -0.00123205    0.00029987
   15
   -420.51897646
H   -2.04302986    2.08924928   -0.41728212    0.00310300   -0.01084598    0.00244614
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O   -1.82331931   -1.28917350    0.50558594    0.00172622    0.00264155    0.00375679
C   -0.78513973    0.70683820   -0.10031035    0.00037677    0.00774566    0.00250126
C   -0.79365730   -0.75517948    0.08622082   -0.00330537    0.02259082   -0.00669523
C    0.27599664    1.53415389    0.17293342    0.02739052   -0.01968072    0.00659272
C    0.38489130   -1.56675400   -0.26257128    0.01094223    0.00973537    0.00930691
C    1.63595184    1.24669296    0.32693098   -0.01748483    0.03867174    0.00087240
C    1.68200076   -1.19138787   -0.36585729   -0.02790106   -0.00130502   -0.00730500
H    0.00611630    2.60286330    0.25335379   -0.00341566    0.00620919    0.00056335
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H    2.37989619   -2.00287652   -0.68141281    0.00736772   -0.01380458   -0.00598390
C    2.29543369    0.04537609    0.06583210    0.01258009   -0.00754450    0.00704154
H    3.37989502    0.03368152    0.14918822    0.00045370   -0.00121791   -0.00100341
   15
   -420.51962726
H   -2.05533745    2.08186391   -0.44111017    0.00166249   -0.01260881    0.00201781
O   -2.02788344    1.12233922   -0.41395349    0.00216954   -0.00246291   -0.00376322
O   -1.82417785   -1.28071290    0.50958523    0.00445036    0.00619543    0.00172431
C   -0.78884875    0.70944283   -0.10068149   -0.00564065    0.01168114    0.00072508
C   -0.79445554   -0.75502939    0.09182919   -0.00736894    0.01881580   -0.00281627
C    0.27204909    1.52771082    0.17442958    0.02254887   -0.02934811    0.00467199
C    0.38484968   -1.56663947   -0.26948446    0.00482088    0.00300379    0.00712427
C    1.63760215    1.23923565    0.33132445   -0.01139133    0.01682050   -0.00546852
C    1.68968247   -1.19915668   -0.36791663   -0.01622847   -0.01094063   -0.01033963
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H    0.20882848   -2.62822711   -0.48990096    0.00950898   -0.00808296   -0.00228663
H    2.20975626    2.06554452    0.73092109   -0.00723389   -0.00243854    0.00327681
H    2.38268641   -2.00357274   -0.67812655    0.00388546   -0.01052503   -0.00419237
C    2.28791902    0.05415145    0.06414056   -0.00075740    0.00696361    0.01026224
H    3.37819412    0.04824311    0.12452533    0.00274646   -0.00110898   -0.00226768
   15
   -420.51877581
H   -2.06880072    2.08297667   -0.46636066   -0.00044986   -0.00505832    0.00109946
O   -2.02071316    1.11799138   -0.41593444    0.01303237   -0.01112312   -0.00044530
O   -1.82523830   -1.27253412    0.51350640    0.00715643    0.00994937   -0.00033277
C   -0.79221664    0.71134427   -0.10109562   -0.01164032    0.01496733   -0.00121814
C   -0.79480960   -0.75601144    0.09760760   -0.01113144    0.01387484    0.00111099
C    0.26675824    1.52300672    0.17564333    0.01369722   -0.03193327    0.00273619
C    0.38452253   -1.56668664   -0.27682271   -0.00247112   -0.00757041    0.00381847
C    1.63992826    1.23077707    0.33605145   -0.00283698   -0.00831051   -0.01240782
C    1.69832162   -1.20625165   -0.36934550    0.00014863   -0.02289171   -0.01436005
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   15
   -420.51633525
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   15
   -420.51411459
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   15
   -420.51350399
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C   -0.79695169    0.71108421   -0.10147971   -0.02179873    0.01970944   -0.00533191
C   -0.79131487   -0.76265209    0.11375658   -0.01395701   -0.00188124    0.00897128
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C    1.64490128    1.21253133    0.35545656    0.03461384   -0.03767972   -0.01281305
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   15
   -420.51352143
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O   -1.83323696   -1.24576433    0.52995995    0.00530284    0.01933107   -0.00285010
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C   -0.78844397   -0.76504464    0.11821835   -0.01103104   -0.00526411    0.00949735
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   15
   -420.51338188
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   15
   -420.51388178
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   15
   -420.51537289
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   15
   -420.51590035
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O   -1.84371852   -1.23216003    0.54782566   -0.01570715    0.01620303    0.00408242
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C    1.73229555   -1.20678141   -0.35219382    0.01116628    0.00251630    0.00537706
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   15
   -420.51425822
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   15
   -420.51199054
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C   -0.76736661   -0.77233918    0.13484387    0.01477038    0.00189884    0.00321536
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C    1.59451635    1.20703596    0.40514631   -0.04762152    0.00014103    0.01555446
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   15
   -420.51114977
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C   -0.76570448   -0.77311266    0.13655506    0.01626672    0.00429899    0.00295719
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C    2.28736060    0.04174035   -0.00008057    0.01380433   -0.03067272   -0.02745005
H    3.37316099    0.13037136    0.04040867    0.00196642    0.00405782   -0.00047273
   15
   -420.51126542
H   -1.96345475    2.04986901   -0.70366391    0.00096683   -0.00194124   -0.00048077
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O   -1.84379138   -1.23040310    0.56303968   -0.02251016    0.01368517    0.00668808
C   -0.77078902    0.66861455   -0.09205038    0.01045607   -0.02216628    0.00197205
C   -0.76502006   -0.77414257    0.13808476    0.01655743    0.00599866    0.00322665
C    0.25147508    1.55269544    0.19927038    0.01574634    0.01894752    0.00414528
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C    1.58693065    1.20439566    0.41200039   -0.05274659    0.01114559    0.02354525
C    1.72618691   -1.19603852   -0.34288534    0.01337648    0.00247361    0.01013225
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   15
   -420.51074783
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O   -2.02623639    1.11488381   -0.45957648   -0.02241989    0.01153152   -0.00803085
O   -1.84128909   -1.23155214    0.56609897   -0.02025715    0.01405218    0.00584120
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C   -0.76533044   -0.77552997    0.13941665    0.01552826    0.00664625    0.00402271
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   15
   -420.51000121
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O   -1.83787336   -1.23334045    0.56889538   -0.01648411    0.01486139    0.00441699
C   -0.76790205    0.66483522   -0.09033257    0.01118439   -0.02745743    0.00108699
C   -0.76657290   -0.77731290    0.14050272    0.01308961    0.00602040    0.00532399
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C    1.59137749    1.19894865    0.41315191   -0.02565775    0.02433136    0.03093854
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   15
   -420.51071911
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O   -1.83371450   -1.23580443    0.57149320   -0.01144042    0.01602887    0.00251202
C   -0.76746367    0.66536774   -0.08958757    0.01152204   -0.02770754    0.00051349
C   -0.76860036   -0.77945347    0.14126452    0.00933585    0.00411294    0.00708105
C    0.25028222    1.56741918    0.20648115    0.01952760    0.02471585    0.00587550
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C    1.59640383    1.19422630    0.41103029   -0.01665647    0.01581312    0.02910580
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   15
   -420.51256563
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C    0.24759119    1.56901771    0.20817149    0.01700411    0.01744323    0.00482557
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C    1.60247529    1.18861867    0.40717255   -0.01472730   -0.00631196    0.02259782
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   15
   -420.51353075
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O   -1.82411030   -1.24297610    0.57644920    0.00031947    0.01862926   -0.00191964
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C   -0.77405577   -0.78428725    0.14137511   -0.00025616   -0.00251392    0.01122986
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C    1.60943855    1.18341360    0.40195860   -0.01319353   -0.03264150    0.01399804
C    1.70575723   -1.19006122   -0.34691258    0.00616620    0.00222457    0.01189697
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H    2.26826787    2.03129456    0.64100250    0.00468370    0.00443510   -0.00307587
H    2.39057668   -1.97068547   -0.69937197    0.00116970   -0.00476024   -0.00226730
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   15
   -420.51314411
H   -1.85867793    2.04316211   -0.77193290    0.01129063    0.00804548   -0.00267556
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C   -0.77691145   -0.78658387    0.14047662   -0.00454073   -0.00640540    0.01289301
C    0.23955308    1.56925636    0.21076805    0.00133429    0.01318238    0.00188725
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C    1.61717621    1.18015320    0.39589430   -0.00725412   -0.05335184    0.00607401
C    1.70155990   -1.19066366   -0.35048982    0.01494842   -0.00983924    0.00585894
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H    2.36331138   -1.96605163   -0.70082108   -0.00824151    0.00293398    0.00138937
C    2.28788018    0.05816855    0.01958111   -0.00655175    0.02295910   -0.00946623
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   15
   -420.51294072
H   -1.86519897    2.03383269   -0.78066182    0.00925856   -0.00034797   -0.00032883
O   -2.01788168    1.12044214   -0.47743148   -0.01847556   -0.00487225   -0.00298110
O   -1.81452089   -1.25350510    0.58173338    0.00926695    0.01965172   -0.00501405
C   -0.77275810    0.68265734   -0.08661827    0.01049328   -0.01074514   -0.00100685
C   -0.77949979   -0.78849415    0.13880308   -0.00736067   -0.01007523    0.01362835
C    0.23514566    1.56814871    0.21184847   -0.01019352    0.01736804    0.00067789
C    0.36980614   -1.54710134   -0.36021797   -0.01415072   -0.01221322   -0.01117575
C    1.62533076    1.18006493    0.38945080    0.00297587   -0.06324093    0.00047281
C    1.69647844   -1.19068536   -0.35442610    0.01976125   -0.01902371    0.00076629
H   -0.02730136    2.63867325    0.28951737   -0.00570288    0.00940495    0.00083212
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H    2.25679325    2.08102855    0.66390311    0.01057702    0.02297941    0.00352391
H    2.34182877   -1.96340898   -0.70321595   -0.01509925    0.00857524    0.00411505
C    2.28615803    0.06003267    0.02683910   -0.00923878    0.03029060   -0.00475382
H    3.37591752    0.03402055    0.08899527    0.00253647   -0.00526602   -0.00109217
   15
   -420.51420091
H   -1.87834553    2.02483643   -0.78918251    0.00656347   -0.00993195    0.00244100
O   -2.01255273    1.12244221   -0.47991501   -0.01056317    0.00378241   -0.00513268
O   -1.81026173   -1.26009860    0.58468445    0.01096811    0.01887519   -0.00522020
C   -0.77576696    0.68948582   -0.08576325    0.00888457   -0.00343160   -0.00089325
C   -0.78165356   -0.78979872    0.13631207   -0.00809891   -0.01302365    0.01303093
C    0.23135656    1.56597870    0.21288552   -0.02203390    0.02375445   -0.00006776
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C    1.63329353    1.18373528    0.38296242    0.01560949   -0.05994769   -0.00187776
C    1.69024392   -1.18959677   -0.35842517    0.01641857   -0.02045813   -0.00113816
H   -0.00086759    2.62390680    0.30216308   -0.00025910   -0.00148249    0.00113063
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H    2.33082675   -1.96653758   -0.70838643   -0.01559474    0.00769382    0.00383908
C    2.28497503    0.06009003    0.03439049   -0.00808714    0.03263332   -0.00120415
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   15
   -420.51598123
H   -1.89624841    2.02261727   -0.79933032    0.00431866   -0.01342677    0.00308560
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O   -1.80649195   -1.26754460    0.58786816    0.01047017    0.01704214   -0.00430944
C   -0.77930942    0.69652200   -0.08485569    0.00654301    0.00384471   -0.00049570
C   -0.78332854   -0.79032164    0.13304046   -0.00665823   -0.01476616    0.01095060
C    0.22889133    1.56238473    0.21392551   -0.03209909    0.02752945   -0.00056107
C    0.36599240   -1.54627813   -0.35675403   -0.00831270    0.00284815   -0.00342311
C    1.64030870    1.19096211    0.37656901    0.02893705   -0.04305801   -0.00052295
C    1.68305612   -1.18731072   -0.36237221    0.00536082   -0.01420578    0.00019401
H    0.02578138    2.61015563    0.31400733    0.00477580   -0.01150416    0.00123209
H    0.22096269   -2.56507208   -0.69352885    0.01353131    0.00312538   -0.00220380
H    2.21983543    2.07268915    0.67892406   -0.00389958    0.00853493    0.00082096
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C    2.28426942    0.05820225    0.04202210   -0.00464670    0.02935768    0.00088612
H    3.36196616    0.03927857    0.10788649   -0.00585360   -0.00245641   -0.00114613
   15
   -420.51666410
H   -1.91729764    2.02948571   -0.81148436    0.00262663   -0.00762333    0.00028293
O   -2.00081976    1.12588033   -0.48421131    0.00518213    0.00035315   -0.00181565
O   -1.80318997   -1.27576010    0.59124360    0.00803951    0.01419750   -0.00238336
C   -0.78324342    0.70332833   -0.08391918    0.00337427    0.01058984    0.00009081
C   -0.78460983   -0.78995941    0.12911313   -0.00343533   -0.01493866    0.00756464
C    0.22834901    1.55716837    0.21500065   -0.03851652    0.02300596   -0.00128556
C    0.36496226   -1.54580275   -0.35456328   -0.00150318    0.01442313    0.00159262
C    1.64558221    1.20074334    0.37019306    0.04040741   -0.01667154    0.00361023
C    1.67555920   -1.18417987   -0.36633648   -0.00872483   -0.00503757    0.00264125
H    0.04909446    2.60425844    0.32493848    0.00813768   -0.01451917    0.00174963
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H    2.20242619    2.05576663    0.68478816   -0.01517888   -0.00767702   -0.00387906
H    2.33757728   -1.98338907   -0.72434264   -0.00212125   -0.00816283   -0.00324601
C    2.28384564    0.05456305    0.04960663   -0.00134365    0.02132764    0.00168044
H    3.35971899    0.04513675    0.11856633   -0.00708671   -0.00047286   -0.00087894
   15
   -420.51639048
H   -1.94022171    2.04156413   -0.82372947    0.00069118    0.00276076   -0.00435726
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O   -1.80024789   -1.28461673    0.59472438    0.00432150    0.01054161    0.00027792
C   -0.78737707    0.70949866   -0.08298824   -0.00066811    0.01643477    0.00068959
C   -0.78568837   -0.78870191    0.12473284    0.00078431   -0.01348494    0.00327624
C    0.23011292    1.55061009    0.21615579   -0.04033229    0.00897964   -0.00240296
C    0.36402138   -1.54617151   -0.35245899    0.00561909    0.02057089    0.00469617
C    1.64844821    1.21154104    0.36360320    0.04456183    0.00796982    0.00680590
C    1.66857950   -1.18073485   -0.37045517   -0.02082256    0.00237537    0.00409317
H    0.06666785    2.60826228    0.33456615    0.00953954   -0.00858777    0.00298018
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H    2.19570288    2.04410621    0.69338187   -0.02232376   -0.01935925   -0.00741417
H    2.34610957   -1.98627387   -0.73028686    0.00406070   -0.01377970   -0.00586323
C    2.28351254    0.04964799    0.05709339    0.00017960    0.01050617    0.00170167
H    3.36235830    0.05133522    0.12986457   -0.00477952    0.00151991   -0.00036805
   15
   -420.51682249
H   -1.96360807    2.05183627   -0.83290225   -0.00179202    0.01029964   -0.00798184
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O   -1.79750020   -1.29394992    0.59819136    0.00016033    0.00640365    0.00327799
C   -0.79146624    0.71468150   -0.08209809   -0.00550109    0.02098067    0.00112103
C   -0.78681461   -0.78663552    0.12015636    0.00507873   -0.01070446   -0.00140672
C    0.23429251    1.54353004    0.21745540   -0.03738050   -0.00922214   -0.00329399
C    0.36274801   -1.54774508   -0.35062604    0.01129576    0.01895756    0.00528732
C    1.64868465    1.22192689    0.35663061    0.03602202    0.01933746    0.00448741
C    1.66283306   -1.17741328   -0.37481105   -0.02775719    0.00582303    0.00352024
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H    0.15207380   -2.59308332   -0.67713543    0.00279015   -0.01636757   -0.00670885
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H    2.35194268   -1.97954649   -0.73214399    0.00653133   -0.01422722   -0.00623029
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   15
   -420.51768959
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   15
   -420.51707901
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O   -1.79186228   -1.31329564    0.60454858   -0.00636133   -0.00182316    0.00870552
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   15
   -420.51486069
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   15
   -420.51312711
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O   -1.78515375   -1.33234181    0.60936678   -0.00751209   -0.00804997    0.01150776
C   -0.80134156    0.72163870   -0.07929144   -0.02340906    0.02132331    0.00167367
C   -0.79608757   -0.77413458    0.10530244    0.01103022    0.00393485   -0.01601971
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C    1.65487311   -1.16605121   -0.39212411   -0.00530577   -0.00630855   -0.01244545
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C    2.28094810    0.02798828    0.09276599    0.01228354   -0.02785869    0.00599097
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   15
   -420.51321284
H   -2.03282935    2.05478633   -0.80845032   -0.00800889   -0.01379818   -0.00071453
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O   -1.78129240   -1.34138399    0.61101995   -0.00580721   -0.01005017    0.01160428
C   -0.80083046    0.71990901   -0.07881821   -0.02414973    0.01718603    0.00220757
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C    0.27669897    1.52816965    0.22521953    0.02184483   -0.01528616    0.01042465
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C    1.64110892    1.25811676    0.32728272   -0.03792152    0.02784929   -0.02146564
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   15
   -420.51352864
H   -2.03109084    2.07443974   -0.79850578   -0.00849838   -0.00329265   -0.00393919
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O   -1.77717261   -1.34997318    0.61214979   -0.00275897   -0.01125799    0.01084185
C   -0.79887114    0.71714522   -0.07847975   -0.02243032    0.01199116    0.00299681
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C    0.28435469    1.52957746    0.22583772    0.03096633   -0.00491676    0.01395182
C    0.34084771   -1.55719784   -0.34200245    0.00263921   -0.01584388    0.00380677
C    1.64428530    1.26155462    0.32479063   -0.03052438    0.03887878   -0.01677956
C    1.65514206   -1.15937077   -0.39751530   -0.00486789    0.00805815   -0.01093231
H    0.02254091    2.56550721    0.31587153    0.00341712   -0.01510444   -0.00018553
H   -0.01912290   -2.55420442   -0.59770744   -0.01142734    0.00150903    0.00326420
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C    2.27652960    0.02868435    0.10509870    0.01932526   -0.02362007    0.01121582
H    3.35264934    0.02074576    0.19726763   -0.00475086    0.00217244    0.00007487
   15
   -420.51251597
H   -2.02327269    2.09643670   -0.78575494   -0.00834170    0.00781233   -0.00673132
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O   -1.77293168   -1.35805438    0.61279062    0.00137108   -0.01170883    0.00930481
C   -0.79556803    0.71365894   -0.07832339   -0.01817275    0.00626493    0.00395182
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C    0.29015081    1.53131508    0.22561878    0.03745521   -0.00074448    0.01611727
C    0.33585265   -1.55493300   -0.34068073   -0.00036424   -0.00701395    0.00754246
C    1.64927146    1.26264759    0.32330486   -0.01621201    0.04829998   -0.01058038
C    1.65567196   -1.15648666   -0.39916907   -0.00618707    0.01717399   -0.00885415
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H    2.28319668    2.02270118    0.70156947   -0.00969132   -0.01947287   -0.00324821
H    2.39840353   -1.90489792   -0.72488619    0.00922649   -0.00189914   -0.00210377
C    2.27265967    0.03126333    0.11032931    0.01602323   -0.01693393    0.01369501
H    3.34828563    0.00509567    0.20465052   -0.00490747    0.00042004   -0.00029940
   15
   -420.51169817
H   -2.00951179    2.11316590   -0.76829627   -0.00715305    0.01313930   -0.00724752
O   -1.99017345    1.15963969   -0.51029424    0.00567596   -0.01376284   -0.00329463
O   -1.76875571   -1.36560684    0.61301153    0.00624160   -0.01147451    0.00716179
C   -0.79117696    0.70979339   -0.07840600   -0.01168009    0.00060317    0.00490935
C   -0.81428421   -0.76508224    0.10466450   -0.00405817    0.01392935   -0.01539020
C    0.29369363    1.53313214    0.22443195    0.04149553   -0.00320385    0.01692009
C    0.33089216   -1.55222311   -0.33980835   -0.00579992   -0.00221282    0.00993826
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C    1.65655725   -1.15462144   -0.40028071   -0.00385645    0.02241792   -0.00806349
H   -0.02200765    2.56647686    0.29575217   -0.00416919   -0.00932707   -0.00070304
H   -0.03731442   -2.57514302   -0.59179582   -0.01634360   -0.01325041    0.00012743
H    2.28207952    2.01645640    0.68208302   -0.01674642   -0.02753195   -0.00766740
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C    2.26784671    0.03485247    0.11473362    0.00762034   -0.00743492    0.01579578
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   15
   -420.51280771
H   -1.99064455    2.12091744   -0.74576356   -0.00518837    0.01051592   -0.00534349
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O   -1.76486405   -1.37264075    0.61290892    0.01141164   -0.01069841    0.00464133
C   -0.78608729    0.70588796   -0.07878457   -0.00362471   -0.00438911    0.00568691
C   -0.81894216   -0.76462711    0.10700665   -0.00994595    0.01451681   -0.01273281
C    0.29474352    1.53515526    0.22222659    0.04215503   -0.00813226    0.01675692
C    0.32629318   -1.54935228   -0.33952815   -0.01338716   -0.00276106    0.01059305
C    1.66147590    1.25636267    0.32214913    0.00102334    0.02792789   -0.01117900
C    1.65765343   -1.15408474   -0.40089539    0.00286084    0.02227144   -0.00911669
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H   -0.02943159   -2.57360455   -0.58945580   -0.01454165   -0.01201934    0.00058213
H    2.29228745    2.02910189    0.66769793   -0.01211947   -0.02063410   -0.00541984
H    2.40737387   -1.91309185   -0.72914977    0.01427006   -0.00783735   -0.00470473
C    2.26258694    0.03888015    0.11818461   -0.00355147    0.00424320    0.01749497
H    3.34755514   -0.02565366    0.22005696    0.00226440   -0.00355658   -0.00017975
   15
   -420.51414632
H   -1.96805360    2.12148304   -0.71946958   -0.00296993    0.00160887   -0.00202470
O   -1.99756220    1.16938573   -0.51467456   -0.00988464    0.00035827   -0.01136482
O   -1.76148925   -1.37919033    0.61259598    0.01633139   -0.00963068    0.00204760
C   -0.78078169    0.70224195   -0.07950543    0.00508437   -0.00818476    0.00613878
C   -0.82299872   -0.76504571    0.11011576   -0.01580186    0.01426533   -0.00945470
C    0.29326711    1.53765938    0.21901102    0.03820192   -0.01104517    0.01593374
C    0.32250892   -1.54628947   -0.33988009   -0.02195415   -0.00820025    0.00957272
C    1.66766817    1.25021686    0.32251328    0.00080270   -0.00166425   -0.01756269
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H   -0.05423990    2.59160603    0.27733314   -0.01274121    0.00744169    0.00015678
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C    2.25753977    0.04264779    0.12057958   -0.01428900    0.01657947    0.01878480
H    3.34629040   -0.03793749    0.22801715    0.00523622   -0.00516763    0.00008142
   15
   -420.51367613
H   -1.94331057    2.12093841   -0.69170281   -0.00087989   -0.00795765    0.00103717
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O   -1.75885205   -1.38530275    0.61218916    0.02035883   -0.00859229   -0.00027852
C   -0.77578217    0.69908356   -0.08059556    0.01351630   -0.01051255    0.00619117
C   -0.82610373   -0.76632396    0.11379552   -0.02083068    0.01339914   -0.00595105
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C    0.32004753   -1.54271892   -0.34080536   -0.02948365   -0.01584207    0.00747729
C    1.67379900    1.24415984    0.32392889    0.00288332   -0.02920227   -0.02193544
C    1.65867205   -1.15662988   -0.40027501    0.02416224    0.00663306   -0.01592672
H   -0.05807393    2.59913105    0.26811228   -0.01369259    0.00995117    0.00043566
H    0.01423924   -2.55051596   -0.58749492   -0.00457584    0.00512159    0.00471738
H    2.32952352    2.08584574    0.64618101    0.01041564    0.01182003    0.00473258
H    2.37986648   -1.90307151   -0.72177644    0.00118785    0.00330009    0.00019886
C    2.25334030    0.04542113    0.12184123   -0.02178179    0.02723610    0.01950418
H    3.34143142   -0.04654394    0.23592020    0.00531066   -0.00605986    0.00032984
   15
   -420.51248111
H   -1.91794285    2.12570613   -0.66458102    0.00139461   -0.01079531    0.00248096
O   -2.00323956    1.17906807   -0.51703810   -0.02064033    0.01320499   -0.01674690
O   -1.75713297   -1.39102404    0.61179263    0.02289674   -0.00790077   -0.00198488
C   -0.77159486    0.69655398   -0.08205809    0.02090387   -0.01144552    0.00584384
C   -0.82795703   -0.76841108    0.11783620   -0.02421361    0.01219580   -0.00267089
C    0.28398661    1.54452009    0.20977590    0.01660323   -0.00354623    0.01285876
C    0.31935050   -1.53820618   -0.34218394   -0.03330559   -0.02025686    0.00561082
C    1.67973178    1.23981563    0.32664996    0.00954003   -0.04631983   -0.02215853
C    1.65734087   -1.15879030   -0.39863934    0.03180676   -0.00395076   -0.01941285
H   -0.05221607    2.59981988    0.25858744   -0.01184623    0.00699865    0.00056533
H    0.04303944   -2.54082109   -0.59073468    0.00045019    0.01292093    0.00642002
H    2.34110259    2.10759406    0.63214079    0.01557371    0.02075167    0.00599778
H    2.36196052   -1.89911818   -0.71720282   -0.00689224    0.01047184    0.00337774
C    2.25043366    0.04656833    0.12192748   -0.02442981    0.03367130    0.01934784
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   15
   -420.51267106
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O   -1.75644546   -1.39638450    0.61148275    0.02347733   -0.00783497   -0.00280706
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   15
   -420.51401692
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O   -1.75681521   -1.40138650    0.61129651    0.02191236   -0.00852508   -0.00264205
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C   -0.82724506   -0.77471125    0.12625381   -0.02363676    0.00930881    0.00174408
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   15
   -420.51441501
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O   -1.75817169   -1.40599895    0.61122684    0.01835176   -0.00988487   -0.00156209
C   -0.76783650    0.69301762   -0.08836724    0.03184719   -0.00911491    0.00278782
C   -0.82471540   -0.77875024    0.13036460   -0.01952178    0.00772849    0.00270923
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C    0.32838741   -1.51911618   -0.34844582   -0.01261436    0.01304920    0.00882018
C    1.69141758    1.24305964    0.34156147    0.04518993   -0.01421058   -0.00062416
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   15
   -420.51346730
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O   -2.00236824    1.19506845   -0.51307014   -0.02639432   -0.00869820   -0.01449114
O   -1.76035523   -1.41016109    0.61122575    0.01330125   -0.01166865    0.00016876
C   -0.77025019    0.69303536   -0.09090552    0.03061821   -0.00738012    0.00111259
C   -0.82101500   -0.78325602    0.13431436   -0.01344421    0.00600896    0.00311003
C    0.26053713    1.55590649    0.18314402   -0.03067989    0.01787258    0.00290521
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C    1.63694226   -1.16355268   -0.38100396   -0.02040636    0.00118438   -0.00709314
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C    2.25154100    0.03268811    0.11197847   -0.01112779    0.00389009    0.00453299
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   15
   -420.51300192
H   -1.84773940    2.16475395   -0.55570356    0.00986374    0.00271667    0.00400490
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O   -1.76313948   -1.41379345    0.61121598    0.00751124   -0.01354437    0.00217054
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C   -0.81650750   -0.78812399    0.13807721   -0.00616474    0.00403766    0.00326745
C    0.25792353    1.55621424    0.17563848   -0.03276765    0.00847135    0.00053621
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C    1.68713189    1.25112920    0.35262083    0.05323994    0.02843061    0.01462816
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H    0.04372532    2.62381808    0.20257622    0.00428552   -0.00092975    0.00229401
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   15
   -420.51383578
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C    0.25727234    1.55601236    0.16809653   -0.03098670   -0.00151580   -0.00102256
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C    2.25708897    0.02159856    0.10419499   -0.01209514   -0.02031495   -0.00729103
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   15
   -420.51420994
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C   -0.80684341   -0.79844311    0.14499791    0.00899582   -0.00118150    0.00380263
C    0.25848010    1.55588105    0.16061150   -0.02618940   -0.00739391   -0.00161091
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C    1.67103616    1.25360435    0.36049311    0.01593074    0.01852967    0.01476514
C    1.62939670   -1.16593136   -0.36181067   -0.04554068   -0.00419273   -0.00163371
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C    2.26093366    0.01754064    0.10078659   -0.01057022   -0.02859802   -0.01159422
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   15
   -420.51361987
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O   -1.98472994    1.21217016   -0.49874636    0.00035179    0.01298356   -0.00808119
O   -1.77254024   -1.42074888    0.61027456   -0.00695710   -0.01648888    0.00649907
C   -0.79489438    0.69649146   -0.10035313   -0.00250806   -0.00160888   -0.00920554
C   -0.80259721   -0.80357827    0.14812231    0.01559527   -0.00451877    0.00439215
C    0.26126020    1.55616498    0.15321963   -0.01918263   -0.00706677   -0.00138142
C    0.34870355   -1.50566309   -0.36825981    0.02583385    0.00865200   -0.00295825
C    1.66088676    1.25289964    0.36306346   -0.00375645    0.01133277    0.01352424
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C    2.26540116    0.01519635    0.09807128   -0.00588186   -0.03365648   -0.01425135
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   15
   -420.51326628
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O   -1.77529743   -1.42160635    0.60943989   -0.00916110   -0.01602612    0.00675772
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C    2.27021072    0.01487053    0.09620972    0.00151425   -0.03535217   -0.01527909
H    3.35220393   -0.00991445    0.24689708    0.00290443    0.00168461    0.00396678
   15
   -420.51424644
H   -1.92130226    2.20105664   -0.50912236    0.00056238    0.01148679    0.00150528
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O   -1.77764510   -1.42173936    0.60830108   -0.00973016   -0.01483821    0.00636923
C   -0.80877263    0.69909340   -0.10243025   -0.02753288   -0.00020610   -0.01468519
C   -0.79723005   -0.81279552    0.15352238    0.02431783   -0.01228994    0.00621153
C    0.26978712    1.55754107    0.13863818   -0.00226818    0.01000342    0.00018091
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C    1.64200408    1.24947392    0.36577980   -0.02412478    0.01272391    0.01301867
C    1.64379134   -1.16568334   -0.34135905   -0.01824751   -0.01070334   -0.00096472
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C    2.27492423    0.01666673    0.09526581    0.00974616   -0.03384075   -0.01501791
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   15
   -420.51572024
H   -1.94229491    2.20851919   -0.50555577   -0.00193837    0.01468893    0.00080270
O   -1.97060326    1.22112098   -0.48392114    0.02513943   -0.00984061    0.00028415
O   -1.77955720   -1.42120129    0.60687546   -0.00872156   -0.01306784    0.00540185
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C    0.34574526   -1.50882259   -0.38050484    0.00914147    0.00754269   -0.00353670
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H    2.29943409   -1.95096650   -0.68120207   -0.01050452    0.00420587    0.00185592
C    2.27905968    0.02049483    0.09522598    0.01571401   -0.02936262   -0.01391019
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   15
   -420.54132938
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C   -0.74489620    0.00619432    0.00099768   -0.00119391    0.00120124    0.00040358
C    1.60316378   -1.10056856    0.00052362   -0.00038750    0.00136992    0.00018861
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C    1.25953880   -2.45395679   -0.00006245    0.00134593    0.00049852   -0.00019027
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H   -2.66229799   -0.85458311   -0.00073282   -0.00086562    0.00033860    0.00000781
H    2.10646405   -3.13893121    0.00069492    0.00001637   -0.00018268    0.00003741
H   -2.10558707   -3.13908806   -0.00002555   -0.00044815   -0.00057094   -0.00003824
C   -0.00079739   -3.06711471    0.00077906   -0.00251691   -0.00148358    0.00007964
H    0.00085474   -4.15351122    0.00067517    0.00019077    0.00072126   -0.00002147
   15
   -420.54133511
H    0.00064362    1.68152160    0.00043902   -0.00019642   -0.00025266    0.00016360
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   15
   -420.54135378
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   15
   -420.54132708
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   15
   -420.54132488
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   15
   -420.54135060
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   15
   -420.54134933
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   15
   -420.54132050
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   15
   -420.54133912
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   15
   -420.54133674
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   15
   -420.54134070
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   15
   -420.54133977
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   15
   -420.54134727
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   15
   -420.54135089
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   15
   -420.54133639
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   15
   -420.54135424
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   15
   -420.54132228
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   15
   -420.54133689
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   15
   -420.54133858
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   15
   -420.54135140
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   15
   -420.54135357
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   15
   -420.54133087
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O   -1.15491123    1.22943209   -0.00058305    0.00061777   -0.00123037    0.00002925
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   15
   -420.54133939
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   15
   -420.54134167
H    0.00020740    1.68239499   -0.00022996    0.00024280   -0.00018281   -0.00008207
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O    1.15480482    1.23092245    0.00044688   -0.00044118   -0.00012095    0.00013315
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C    0.74497095    0.00700603   -0.00036798   -0.00012282    0.00121512   -0.00014605
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C    1.25830414   -2.45393501    0.00058626   -0.00061595    0.00049188    0.00011615
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H    2.10657521   -3.13819148    0.00049006    0.00047126   -0.00021105   -0.00003524
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   15
   -420.54135196
H    0.00083412    1.68277060    0.00036472   -0.00031752    0.00016942    0.00010372
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O   -1.15410895    1.22958957   -0.00053661    0.00079801   -0.00108500   -0.00000293
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C   -1.25912601   -2.45472979    0.00079442   -0.00060348   -0.00067451    0.00016891
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H   -2.10544206   -3.13819180   -0.00031631    0.00072893    0.00045654   -0.00008917
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H    0.00019462   -4.15375904    0.00096657    0.00009279    0.00049327    0.00001755
   15
   -420.54134866
H    0.00073553    1.68297546    0.00014664    0.00017629    0.00005594   -0.00009709
O    1.15410684    1.23064613    0.00085619   -0.00029351   -0.00048928    0.00012418
O   -1.15571515    1.23113836    0.00085619   -0.00031830    0.00059624    0.00010870
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C   -1.60338691   -1.10122281   -0.00078405   -0.00058834    0.00010469   -0.00026274
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C   -1.25782086   -2.45362027    0.00088534    0.00070258    0.00018090    0.00039466
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H    2.10592522   -3.13759103   -0.00076105   -0.00004887    0.00012933   -0.00003956
H   -2.10556059   -3.13765082    0.00009169   -0.00011844   -0.00000169   -0.00009046
C    0.00018160   -3.06584423   -0.00073595    0.00004291    0.00042152   -0.00019445
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   15
   -420.54134133
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   15
   -420.54134685
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   15
   -420.54135214
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   15
   -420.54132684
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   15
   -420.54133989
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   15
   -420.54133751
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   15
   -420.54133506
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   15
   -420.54135215
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   15
   -420.54133489
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   15
   -420.54132389
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   15
   -420.54133694
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   15
   -420.54132057
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   15
   -420.54133847
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   15
   -420.54134064
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   15
   -420.54132437
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   15
   -420.54133768
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   15
   -420.54134591
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   15
   -420.54132542
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   15
   -420.54132443
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   15
   -420.54132368
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   15
   -420.54135119
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C    1.25876082   -2.45448271   -0.00045459    0.00000171    0.00012648    0.00005411
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   15
   -420.54134918
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   15
   -420.54133578
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C   -0.00002375   -3.06630905    0.00055358   -0.00026145   -0.00103108    0.00016821
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   15
   -420.54132664
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C    0.74410552    0.00631089    0.00041060   -0.00142300    0.00019505    0.00021199
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C    1.60348554   -1.10219667   -0.00008271    0.00107366   -0.00182482   -0.00022335
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H    2.10560238   -3.13853204   -0.00017723    0.00037467   -0.00034513   -0.00008039
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   15
   -420.54135146
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O   -1.15471785    1.23119789   -0.00092217    0.00008025    0.00056652   -0.00010165
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C   -0.74532898    0.00626924    0.00046011   -0.00037267   -0.00013653    0.00010926
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   15
   -420.54135188
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   15
   -420.54133845
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   15
   -420.54132962
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   15
   -420.54134948
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   15
   -420.54133567
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   15
   -420.54133670
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   15
   -420.54134867
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   15
   -420.54134235
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   15
   -420.54133646
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   15
   -420.54132476
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   15
   -420.54135116
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   15
   -420.54135019
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   15
   -420.54133597
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   15
   -420.54132184
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   15
   -420.54134246
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   15
   -420.54133421
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   15
   -420.54133710
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   15
   -420.54134135
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   15
   -420.54133705
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C    1.25817898   -2.45414259    0.00061780   -0.00038344   -0.00109249    0.00018397
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   15
   -420.54132044
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   15
   -420.54132405
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   15
   -420.54135382
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   15
   -420.54134906
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   15
   -420.54133206
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   15
   -420.54135296
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C    1.60213507   -1.10147325   -0.00010930   -0.00062091    0.00065254   -0.00011833
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   15
   -420.54133901
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   15
   -420.54133846
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   15
   -420.54133456
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   15
   -420.54132651
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   15
   -420.54134341
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   15
   -420.54132702
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   15
   -420.54134741
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   15
   -420.54133765
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   15
   -420.54135467
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   15
   -420.54135404
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   15
   -420.54133893
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   15
   -420.54133493
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   15
   -420.54135379
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   15
   -420.54134893
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   15
   -420.54132910
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   15
   -420.54135257
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   15
   -420.54132704
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   15
   -420.54132238
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   15
   -420.54133270
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   15
   -420.54134594
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   15
   -420.54133503
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   15
   -420.54134348
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   15
   -420.54133475
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   15
   -420.54135175
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   15
   -420.54104690
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   15
   -420.54118219
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O   -1.15012519    1.23021496    0.00072641    0.00300278   -0.00044611    0.00017243
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C   -0.74059723    0.00815414   -0.00140057    0.00238138    0.00442333   -0.00031495
C    1.60378775   -1.10099452    0.00483510    0.00273659    0.00242186    0.00121386
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H   -2.65770884   -0.85067344   -0.00253053   -0.00004167    0.00035608    0.00000181
H    2.10908744   -3.13472680    0.00120905    0.00160953   -0.00001859    0.00032584
H   -2.10872967   -3.14275791    0.00049927   -0.00288031   -0.00312617   -0.00012100
C   -0.00024946   -3.06370317   -0.00138471    0.00140924    0.00254670   -0.00014061
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   15
   -420.54099101
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O   -1.15282251    1.23503144    0.00360023    0.00111049    0.00397599    0.00098675
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C    1.60123398   -1.10514665    0.00319033   -0.00305939   -0.01151694    0.00054387
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C    1.25956584   -2.45015640   -0.00134061    0.00163368    0.00471658   -0.00128375
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C    0.00265754   -3.06227504    0.00421613    0.00503228    0.00435203    0.00128212
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   15
   -420.54112462
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O    1.15552626    1.22795471    0.00277297   -0.00143706   -0.00412167   -0.00006262
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C    0.74542458    0.00958842    0.00112172    0.00145001    0.00663787    0.00010207
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C    1.60661270   -1.09745317   -0.00125020    0.00558373    0.00373367   -0.00044863
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C    1.25846071   -2.45154895   -0.00063554   -0.00050801   -0.00143278   -0.00007166
H   -2.66457534   -0.85598024   -0.00124752    0.00072292    0.00046641    0.00005987
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H   -2.10788432   -3.13341888    0.00390257   -0.00107062    0.00053539    0.00023918
H    2.10564877   -3.13602081    0.00135999    0.00000111    0.00002250    0.00003448
C   -0.00077713   -3.06535617    0.00048773   -0.00287621    0.00357316    0.00001687
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   15
   -420.54110210
H   -0.00167824    1.67957320   -0.00090934    0.00096995   -0.00046082    0.00045269
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O    1.15126137    1.22764313   -0.00389707   -0.00083439    0.00085175   -0.00006835
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C    0.74102548    0.00281178   -0.00056811   -0.00126842   -0.00234645   -0.00074162
C   -1.60684419   -1.10362969    0.00330541   -0.00770110   -0.00037048    0.00053412
C    1.60474342   -1.10037034    0.00404899   -0.00143450   -0.00074152    0.00058154
C   -1.25465180   -2.45709334    0.00094597    0.00339991   -0.00496917    0.00016904
C    1.26193538   -2.44953292    0.00364708   -0.00015770    0.00592685    0.00125051
H   -2.65729193   -0.84994871   -0.00387428    0.00473827    0.00021078   -0.00037126
H    2.66520887   -0.85161625   -0.00256063    0.00132886   -0.00003302   -0.00034672
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C    0.00019019   -3.06387632   -0.00375341   -0.00455891    0.00464162   -0.00131826
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   15
   -420.54112118
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O    1.15864042    1.22935356    0.00318152   -0.00025762   -0.00368462   -0.00028571
C   -0.74683607    0.01072129    0.00075576   -0.00579243    0.00463612    0.00019174
C    0.74607053    0.01078485    0.00276902    0.00247880    0.00636852    0.00102210
C   -1.59980218   -1.09864821   -0.00463178    0.00245784   -0.00014952   -0.00074786
C    1.59803536   -1.10394121   -0.00398764   -0.00339271   -0.00387741   -0.00086186
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C    1.26006172   -2.45600505   -0.00070595    0.00333488    0.00089253    0.00022595
H   -2.65818513   -0.85745082    0.00193991    0.00140939   -0.00103153    0.00038468
H    2.65867782   -0.85299260   -0.00175576    0.00120731    0.00076525    0.00019195
H   -2.10722844   -3.13653995    0.00152719    0.00068241   -0.00040188    0.00027317
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C    0.00242638   -3.06936338   -0.00111509    0.00630273   -0.00441641    0.00003723
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   15
   -420.54115048
H   -0.00261086    1.67859281   -0.00378966    0.00021192   -0.00033046   -0.00033067
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O   -1.15893062    1.22751956   -0.00080370   -0.00050944   -0.00197903    0.00024078
C    0.74626863    0.00358060    0.00356142    0.00692610   -0.00354487    0.00165526
C   -0.74931620    0.00485387   -0.00084267   -0.00382596   -0.00055828   -0.00032560
C    1.59879873   -1.10223723   -0.00359726   -0.00684977   -0.00118938   -0.00084525
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C    1.26076861   -2.45131543   -0.00142612    0.00312571    0.00607032    0.00029623
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H    2.65996072   -0.85318348   -0.00390097    0.00131464    0.00043536    0.00008804
H   -2.66323384   -0.85018367    0.00102197    0.00168536    0.00035594    0.00029205
H    2.10456514   -3.14299315   -0.00059901    0.00027645   -0.00177991    0.00005125
H   -2.10703991   -3.13914954   -0.00119272   -0.00157954   -0.00069541    0.00021068
C    0.00011386   -3.06802092   -0.00322976   -0.00342557   -0.00327589   -0.00017054
H    0.00469564   -4.15226346   -0.00069339    0.00031561    0.00214241    0.00007693
   15
   -420.54113062
H    0.00325821    1.67749736    0.00484601   -0.00057471   -0.00079916    0.00083730
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O   -1.15591148    1.22756160   -0.00235780    0.00127276    0.00180600   -0.00074699
C    0.74504152    0.00628239    0.00479678    0.00070465    0.00251187    0.00109094
C   -0.74898815    0.00138937    0.00335001   -0.00406753   -0.00596419    0.00020249
C    1.60765614   -1.09864366    0.00111625    0.00818929    0.00237946   -0.00067212
C   -1.60645012   -1.10148575    0.00219311   -0.00213293    0.00158480    0.00052509
C    1.25663469   -2.45333751    0.00271395   -0.00162538   -0.00352959   -0.00029691
C   -1.25797444   -2.44933035   -0.00272221    0.00001422    0.00529736   -0.00102022
H    2.65940360   -0.85512521    0.00191921   -0.00520086   -0.00110849    0.00018232
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H    2.10159721   -3.13419658    0.00480096   -0.00217733    0.00189473    0.00012243
H   -2.10522629   -3.13690139   -0.00398160   -0.00088425   -0.00077140    0.00021042
C    0.00189593   -3.06629838    0.00336933    0.00352044   -0.00449990    0.00088491
H   -0.00236465   -4.14963813   -0.00207729   -0.00027593    0.00269942   -0.00026292
   15
   -420.54119213
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O   -1.15732602    1.23476023   -0.00348988   -0.00161039    0.00270449   -0.00072116
C    0.74004741    0.00378937   -0.00179680   -0.00078297   -0.00058786   -0.00019827
C   -0.74930448    0.00623141    0.00116418   -0.00130599   -0.00466031    0.00140175
C    1.59833466   -1.10478884   -0.00107966   -0.00295856   -0.00418444   -0.00015339
C   -1.60380608   -1.09921170   -0.00332726    0.00274372    0.00453786   -0.00116641
C    1.25695663   -2.45207648   -0.00133340   -0.00308581    0.00430170   -0.00013357
C   -1.25562789   -2.45618861   -0.00153401    0.00426981   -0.00462253   -0.00016667
H    2.66001169   -0.85925955    0.00122584    0.00152615   -0.00021537    0.00014861
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H    2.10761766   -3.13944374    0.00008806    0.00237092   -0.00184348    0.00006119
H   -2.10120368   -3.14303480    0.00238668    0.00005848   -0.00044798    0.00019833
C   -0.00047875   -3.06213992   -0.00116742   -0.00152455    0.00372836    0.00032060
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   15
   -420.54109431
H   -0.00304671    1.67757380    0.00205233    0.00000367   -0.00137205    0.00070138
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O    1.15459846    1.23500630   -0.00384365    0.00171619    0.00697384   -0.00027818
C   -0.74085609    0.00205850   -0.00175384    0.00231706   -0.00753499   -0.00040707
C    0.74637626    0.00213475   -0.00222615    0.00085386   -0.01043950   -0.00034726
C   -1.60035164   -1.09951375    0.00415391    0.00402759    0.00562274    0.00167372
C    1.60231466   -1.10007592    0.00167859   -0.00140446    0.00381299    0.00018209
C   -1.26206386   -2.45777851   -0.00480787   -0.00509244   -0.00508276   -0.00104169
C    1.25778765   -2.45367197    0.00309073   -0.00051934   -0.00060980    0.00119206
H   -2.66355064   -0.85253052   -0.00207868   -0.00275045    0.00013728   -0.00045406
H    2.66135282   -0.85844258    0.00059838   -0.00070073   -0.00062911   -0.00008763
H   -2.10574304   -3.13778854   -0.00458458    0.00277043    0.00216819    0.00016870
H    2.10797393   -3.13433318   -0.00362262    0.00030261    0.00035329   -0.00057897
C    0.00061716   -3.06743680   -0.00311552    0.00204282   -0.00140150   -0.00085463
H    0.00377494   -4.15310230    0.00468893    0.00014925    0.00131787    0.00054376
   15
   -420.54100015
H    0.00339544    1.68246184   -0.00261018    0.00058633   -0.00033601   -0.00073840
O    1.15218098    1.22566305    0.00385761   -0.00291410   -0.00918597    0.00028658
O   -1.15686090    1.23119430    0.00385761   -0.00009524   -0.00252873    0.00103524
C    0.74312445    0.01061983    0.00212784    0.00155996    0.00972400    0.00053324
C   -0.74633285    0.00924356   -0.00243723   -0.00005479    0.00208575   -0.00130186
C    1.60128644   -1.09945488    0.00063568    0.00175252   -0.00045660   -0.00001214
C   -1.60221481   -1.09796788   -0.00142713    0.00127847    0.00621917   -0.00061877
C    1.25372401   -2.45019673    0.00131505   -0.00702003    0.00390952    0.00069554
C   -1.26236647   -2.45812775    0.00485119   -0.00600929   -0.01013569    0.00190618
H    2.65955128   -0.85559609   -0.00211380   -0.00091229   -0.00031656   -0.00017875
H   -2.66359269   -0.85941792    0.00170572   -0.00040738   -0.00096854    0.00018023
H    2.10803099   -3.14117583   -0.00297197    0.00475752   -0.00399528   -0.00019261
H   -2.10181943   -3.13549376   -0.00404967    0.00551406    0.00419565   -0.00063563
C   -0.00163537   -3.06356100   -0.00130129    0.00253675    0.00651132   -0.00124999
H   -0.00247410   -4.15827823    0.00254468   -0.00058245   -0.00461422    0.00029193
   15
   -420.54107061
H    0.00023051    1.68085442   -0.00198537   -0.00090928   -0.00035126   -0.00030394
O    1.15497133    1.23114882    0.00048280    0.00111842    0.00048070    0.00013790
O   -1.15963544    1.23124480    0.00048280   -0.00127186    0.00100093    0.00053836
C    0.74777096    0.00456258   -0.00163569    0.00580223   -0.00493392    0.00015403
C   -0.74837646    0.00820934   -0.00382290   -0.00416283    0.00231089   -0.00070212
C    1.60484895   -1.09838625   -0.00028749    0.00212790    0.00301106    0.00060721
C   -1.59882153   -1.10559981   -0.00267904    0.00804123   -0.00630650   -0.00075428
C    1.26216904   -2.44995219   -0.00394441    0.00284219    0.00738669   -0.00119170
C   -1.25926143   -2.45450042    0.00292085   -0.00192754    0.00419188    0.00161598
H    2.65759534   -0.85294062   -0.00076978   -0.00442542   -0.00106663   -0.00016854
H   -2.66531072   -0.85458229    0.00335709   -0.00486618    0.00160385    0.00032983
H    2.11037435   -3.14262380    0.00352295    0.00259666   -0.00308381    0.00051377
H   -2.10642672   -3.13933174   -0.00439785    0.00005944   -0.00032436   -0.00066212
C   -0.00134665   -3.06908115   -0.00118230   -0.00482672   -0.00438877   -0.00021548
H   -0.00002497   -4.15549343    0.00133765   -0.00019430    0.00056347    0.00010120
   15
   -420.54101085
H   -0.00104981    1.68151747    0.00325570   -0.00074957   -0.00006762    0.00083669
O   -1.15279168    1.23279558   -0.00418795    0.00053774    0.00664256   -0.00073952
O    1.15471517    1.23302416   -0.00418795    0.00220297    0.00541055   -0.00069680
C   -0.74471351    0.00145853   -0.00029183   -0.00064327   -0.00715084    0.00042604
C    0.74160982    0.00241996   -0.00051401   -0.00385223   -0.00707281    0.00047254
C   -1.59980374   -1.10620631   -0.00111034    0.00234547   -0.00182020   -0.00070820
C    1.60480515   -1.09772412   -0.00157165    0.00551911    0.00865368   -0.00011105
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C    1.25500226   -2.45916764   -0.00014901   -0.01145580   -0.00725643   -0.00046664
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   15
   -420.54113864
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   15
   -420.54115015
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   15
   -420.54110715
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   15
   -420.54110116
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   15
   -420.54112671
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   15
   -420.54104227
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   15
   -420.54110386
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   15
   -420.54101528
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   15
   -420.54110985
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   15
   -420.54106885
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   15
   -420.54111707
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C    1.60129544   -1.10118331    0.00340948   -0.00147119    0.00505998   -0.00000349
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   15
   -420.54116289
H   -0.00465455    1.67983814    0.00319907    0.00064873   -0.00037473   -0.00020779
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O    1.15408987    1.22539834    0.00363481   -0.00056189   -0.00501199    0.00032835
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C    0.74320191    0.00638011   -0.00278847   -0.00034260    0.00388442   -0.00008975
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C    1.25511179   -2.44934331    0.00393000   -0.00592982    0.00355885    0.00138024
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H   -0.00310427   -4.15194054   -0.00018731   -0.00120700    0.00153194   -0.00011286
   15
   -420.54111768
H   -0.00166136    1.68045479    0.00463235    0.00116608   -0.00045139    0.00037235
O   -1.15373833    1.23361774    0.00097646   -0.00250353    0.00398066   -0.00090912
O    1.15952069    1.23141272    0.00097646    0.00145944    0.00432567    0.00067083
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C    0.74805429    0.00430781   -0.00491607    0.00271820   -0.00509074   -0.00258665
C   -1.60149935   -1.09852413    0.00053607   -0.00129286    0.00201811   -0.00086567
C    1.60287057   -1.10222473    0.00267542   -0.00561868    0.00045076    0.00159661
C   -1.25620593   -2.44941765    0.00241388    0.00101136    0.00432806    0.00096180
C    1.26364191   -2.45462369   -0.00256949    0.00854747   -0.00005085   -0.00052192
H   -2.65750643   -0.85921217    0.00301660    0.00295548   -0.00136321    0.00009233
H    2.66617414   -0.85262366   -0.00280089    0.00289601    0.00078446   -0.00037677
H   -2.10448432   -3.13556775   -0.00205111   -0.00062885   -0.00101363   -0.00029335
H    2.10649627   -3.13396382   -0.00251795   -0.00329349    0.00285591    0.00006978
C   -0.00209147   -3.06855248   -0.00211550   -0.00524727   -0.00439281   -0.00037932
H   -0.00363436   -4.15430084   -0.00157991    0.00006543    0.00106022    0.00013119
   15
   -420.54113099
H   -0.00230469    1.68555203   -0.00316295   -0.00070728    0.00151376   -0.00007001
O    1.15170933    1.22933252   -0.00189001   -0.00171525   -0.00202274   -0.00009669
O   -1.15547766    1.22596219   -0.00189001    0.00009928   -0.00044592   -0.00013602
C    0.74627835    0.00391943    0.00121508    0.00295843   -0.00297886    0.00023476
C   -0.74045480    0.00427189    0.00131206    0.00434639    0.00320631    0.00009549
C    1.60043477   -1.09984012    0.00161805   -0.00080050    0.00557472    0.00022090
C   -1.60308045   -1.10657260    0.00355642   -0.00061946   -0.00846833    0.00104596
C    1.25675424   -2.45617478   -0.00159805    0.00255520   -0.00442081   -0.00110177
C   -1.25749594   -2.45148509   -0.00496070    0.00553913    0.00508816   -0.00233003
H    2.65813138   -0.85796062    0.00163237   -0.00166118   -0.00069341    0.00001157
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H    2.10481233   -3.13383815    0.00269295   -0.00126242    0.00199459    0.00027144
H   -2.10615991   -3.13904609    0.00463397   -0.00137642   -0.00124745    0.00075045
C   -0.00488132   -3.06378859    0.00232902   -0.00703760    0.00219740    0.00169250
H   -0.00099711   -4.15098706   -0.00437815    0.00068522    0.00030283   -0.00037816
   15
   -420.54110252
H    0.00430964    1.68612592   -0.00230926   -0.00090647    0.00058605   -0.00009157
O    1.15633379    1.23501205   -0.00113333    0.00228892    0.00376069   -0.00046977
O   -1.15165737    1.22795352   -0.00113333    0.00412289   -0.00466848    0.00069100
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C   -0.74612508    0.00740530   -0.00436606   -0.00290479    0.00280177   -0.00189582
C    1.60213913   -1.10557280   -0.00357651    0.00305252   -0.00964912   -0.00154907
C   -1.60108605   -1.10364501    0.00307294    0.00345750   -0.00332062    0.00105016
C    1.26133548   -2.45244634    0.00079890    0.00147757    0.00724442    0.00035998
C   -1.25820049   -2.45353888    0.00386729   -0.00369484    0.00392020    0.00026661
H    2.65879436   -0.85769086    0.00490916   -0.00138827   -0.00048714    0.00050251
H   -2.66353482   -0.85172710   -0.00379498   -0.00264094    0.00118831   -0.00038974
H    2.10772179   -3.13954348   -0.00062890    0.00003922   -0.00080405   -0.00003727
H   -2.10826471   -3.13530965    0.00155447   -0.00062627    0.00015703   -0.00017685
C    0.00505031   -3.07058724    0.00261071    0.00509645   -0.00543805    0.00025712
H   -0.00146908   -4.15507980   -0.00250098   -0.00076937    0.00184486   -0.00026500
   15
   -420.54114442
H    0.00215242    1.68539190   -0.00243848   -0.00091857    0.00103716   -0.00056431
O    1.15120225    1.23415630    0.00321552    0.00007558    0.00628946    0.00023913
O   -1.15141774    1.23250747    0.00321552    0.00366065    0.00212352    0.00033702
C    0.74109609    0.00275170    0.00499499   -0.00086945   -0.00573652    0.00023672
C   -0.74824995    0.00485357    0.00445790   -0.00513032   -0.00423201   -0.00020913
C    1.59961008   -1.10384486    0.00335438   -0.00271672   -0.00207190   -0.00024931
C   -1.59985819   -1.10299990    0.00419037    0.00463126   -0.00144506    0.00065721
C    1.26335720   -2.45680047    0.00369911    0.00520927    0.00057878    0.00042294
C   -1.26291089   -2.45296008    0.00130821   -0.00762018    0.00263083    0.00032388
H    2.65951369   -0.85547818    0.00309539    0.00066719   -0.00018729    0.00000051
H   -2.65766205   -0.85597729   -0.00391456    0.00112999   -0.00022986   -0.00035179
H    2.11103465   -3.13831854    0.00248994   -0.00040390    0.00070105   -0.00010220
H   -2.10589129   -3.13697408   -0.00453489    0.00187569    0.00117538   -0.00018117
C    0.00022453   -3.06614238   -0.00028033    0.00035008   -0.00373567   -0.00092676
H   -0.00132635   -4.14906191    0.00478370    0.00005904    0.00322601    0.00036782
   15
   -420.54112641
H    0.00123327    1.67891971   -0.00184306    0.00089963   -0.00082925   -0.00028760
O    1.15154491    1.23132638    0.00107131   -0.00321757   -0.00273844   -0.00023712
O   -1.15489260    1.23025704    0.00107131   -0.00123044    0.00521244    0.00044752
C    0.74868803    0.00891057    0.00357121    0.00288742    0.00512323    0.00101748
C   -0.74145944    0.00153102   -0.00018278    0.00216142   -0.00481153   -0.00104805
C    1.60427664   -1.10264956    0.00099180    0.00009055   -0.00560895   -0.00001103
C   -1.60096860   -1.10616780    0.00449416   -0.00053366   -0.00308489    0.00073696
C    1.25390251   -2.44947986   -0.00460081   -0.00616095    0.00720058   -0.00168796
C   -1.25586840   -2.45653673    0.00065014    0.00029657    0.00060687   -0.00074801
H    2.66243276   -0.85055385    0.00467582   -0.00012831    0.00121791    0.00022212
H   -2.66024082   -0.85522877    0.00433826   -0.00069689    0.00051184   -0.00001826
H    2.10123793   -3.14217240   -0.00138313    0.00179901   -0.00277762    0.00038089
H   -2.10555160   -3.13519846   -0.00067054    0.00050242    0.00135118   -0.00010547
C    0.00279521   -3.06941556    0.00437060    0.00463436   -0.00272428    0.00149167
H   -0.00435166   -4.15451357    0.00115916   -0.00131135    0.00143725   -0.00015365
   15
   -420.54124360
H   -0.00511429    1.67888245    0.00449712    0.00101991   -0.00095440    0.00050113
O   -1.15769526    1.23397890    0.00001639   -0.00200840    0.00374311   -0.00047617
O    1.15054579    1.22671433    0.00001639   -0.00156250   -0.00020959    0.00021984
C   -0.74509928    0.00569334    0.00121739    0.00473408   -0.00038466    0.00043480
C    0.74032586    0.00320276   -0.00312695   -0.00176044   -0.00120445   -0.00129587
C   -1.60346129   -1.10295798    0.00427505   -0.00077407    0.00061133    0.00033932
C    1.60268985   -1.10263500    0.00280834   -0.00022181   -0.00058722    0.00050537
C   -1.25489232   -2.45921437    0.00211868    0.00678339   -0.00283001    0.00011211
C    1.25886064   -2.45327082    0.00252113    0.00106784    0.00078645    0.00012694
H   -2.66565368   -0.85917505    0.00422982   -0.00167970    0.00030822   -0.00013112
H    2.66327248   -0.85382808    0.00379353    0.00137600    0.00014804   -0.00006105
H   -2.10971001   -3.13998167    0.00059579   -0.00232212   -0.00088353   -0.00007823
H    2.10626004   -3.13537339    0.00318686   -0.00053050    0.00076429   -0.00006336
C   -0.00134993   -3.06853490    0.00045524   -0.00450335    0.00075417   -0.00015418
H    0.00503377   -4.15596897   -0.00055656    0.00040215    0.00005889    0.00002010
   15
   -420.54117841
H   -0.00437557    1.68606535    0.00278638    0.00007786    0.00206695    0.00037258
O   -1.15954203    1.22663479   -0.00076652   -0.00176941    0.00160838   -0.00037469
O    1.15192230    1.22718706   -0.00076652   -0.00039165   -0.00183604   -0.00012641
C   -0.74453521    0.00151303    0.00040908   -0.00037951   -0.00320736    0.00048013
C    0.74416408    0.00279583   -0.00164793    0.00201393   -0.00242420   -0.00024550
C   -1.59975396   -1.10517506   -0.00028122    0.00664056   -0.00337172   -0.00013939
C    1.60384510   -1.09998370   -0.00206448    0.00136128    0.00340522   -0.00048973
C   -1.26176265   -2.45355404    0.00225732   -0.00410560    0.00613589    0.00088074
C    1.26270764   -2.45358248   -0.00192333    0.00407031    0.00192216    0.00010351
H   -2.66378923   -0.85700285   -0.00343660   -0.00322564    0.00046257   -0.00017015
H    2.65879522   -0.85485657    0.00451291   -0.00288288   -0.00103838    0.00030428
H   -2.11069107   -3.13831264   -0.00032473   -0.00095234   -0.00058955   -0.00019666
H    2.10783146   -3.14062982   -0.00112049   -0.00020614   -0.00041869    0.00004435
C    0.00050478   -3.06798236   -0.00250603   -0.00011808   -0.00436398   -0.00044301
H   -0.00027608   -4.15284690   -0.00312078   -0.00013051    0.00173524   -0.00000005
   15
   -420.54107873
H    0.00434552    1.68728842    0.00479301   -0.00137183    0.00219211    0.00033914
O    1.15086314    1.22625903    0.00149142   -0.00268021   -0.00758871   -0.00053561
O   -1.15622170    1.22538478    0.00149142    0.00099385   -0.00423024    0.00059150
C    0.74847433    0.00487342    0.00327763    0.00607667    0.00140374    0.00137041
C   -0.74487317    0.00713563   -0.00369179    0.00007978    0.00532358   -0.00219791
C    1.60579037   -1.09665695   -0.00052560    0.00126643    0.00604153   -0.00062512
C   -1.60758986   -1.10011948    0.00329805   -0.00706048    0.00578543    0.00114471
C    1.25728504   -2.45230209    0.00475244   -0.00469095    0.00060344    0.00135142
C   -1.26005815   -2.45748048    0.00286276   -0.00210242   -0.00425762    0.00079569
H    2.66350442   -0.85499448   -0.00414891   -0.00152524   -0.00055145   -0.00023067
H   -2.66103678   -0.85617508   -0.00410341    0.00395474   -0.00103814   -0.00047099
H    2.10787097   -3.13948753    0.00431754    0.00190399   -0.00202791   -0.00006255
H   -2.10625051   -3.14073454    0.00132959    0.00065870    0.00073238   -0.00010659
C    0.00409375   -3.06949045   -0.00337627    0.00493725   -0.00190770   -0.00146188
H    0.00256531   -4.15743922   -0.00282763   -0.00044230   -0.00038667    0.00009952
   15
   -420.54101959
H   -0.00288754    1.68453457   -0.00255923    0.00030374    0.00013843   -0.00044195
O   -1.15218755    1.23510935    0.00137872   -0.00106794    0.00514001    0.00017949
O    1.15858422    1.23527676    0.00137872    0.00312176    0.00692395    0.00082113
C   -0.74381116    0.00358168   -0.00047912   -0.00050118   -0.00805393    0.00019532
C    0.74419332    0.00458033   -0.00412691   -0.00337190   -0.00763812   -0.00108807
C   -1.60307584   -1.09810218    0.00177253    0.00282094    0.00569008    0.00038786
C    1.60728388   -1.09675799   -0.00167089    0.00848651    0.00944878   -0.00052816
C   -1.25906229   -2.45502559   -0.00194195   -0.00045487   -0.00201875   -0.00114855
C    1.25690052   -2.45839133    0.00411166   -0.00304911   -0.01150032    0.00084964
H   -2.66618502   -0.85575301    0.00377737   -0.00211580   -0.00016334   -0.00000152
H    2.65861426   -0.85063183    0.00287461   -0.00501480   -0.00084412    0.00022415
H   -2.10401543   -3.14264366    0.00069058    0.00013555   -0.00066884    0.00030146
H    2.10354558   -3.13447055   -0.00011421   -0.00262080    0.00286315   -0.00038780
C    0.00134053   -3.06665420    0.00407383    0.00277510    0.00328475    0.00111900
H    0.00428880   -4.15805222   -0.00439790    0.00056389   -0.00250335   -0.00048281
   15
   -420.54114031
H   -0.00141742    1.68566033   -0.00174432    0.00065536    0.00072916    0.00008580
O   -1.15403609    1.23256640   -0.00208863    0.00025243    0.00396081   -0.00051946
O    1.15075479    1.23131533   -0.00208863   -0.00267642   -0.00304346    0.00004852
C   -0.74431974    0.00394630    0.00247071    0.00298160   -0.00159607    0.00131997
C    0.74492060    0.00928157   -0.00065579    0.00059426    0.00398509   -0.00027475
C   -1.60718432   -1.10652893   -0.00244224   -0.00354226   -0.00855849   -0.00138356
C    1.60565374   -1.09829874   -0.00123261    0.00252728    0.00107664   -0.00066744
C   -1.25842986   -2.45275814    0.00249192    0.00336487    0.00504685    0.00020681
C    1.26086767   -2.45200941    0.00489013    0.00434561   -0.00201685    0.00094388
H   -2.66316812   -0.85043254    0.00375630    0.00072337    0.00085394    0.00044384
H    2.66300638   -0.85454773   -0.00141701   -0.00149697   -0.00069475    0.00015388
H   -2.10658651   -3.14080792    0.00308642   -0.00150137   -0.00105616    0.00007089
H    2.10490222   -3.13356684    0.00033718   -0.00205632    0.00188864   -0.00028595
C   -0.00161211   -3.06368577    0.00399387   -0.00447265    0.00400688    0.00025200
H    0.00123597   -4.15798652   -0.00189189    0.00028846   -0.00451785   -0.00039405
   15
   -420.54110905
H   -0.00355322    1.67888189   -0.00419886    0.00039013   -0.00199723   -0.00019541
O   -1.15986671    1.23424325   -0.00191883   -0.00329539    0.00274211   -0.00058043
O    1.15389355    1.23184959   -0.00191883   -0.00148428   -0.00220075    0.00002258
C   -0.74227316    0.01037132    0.00421328    0.00415750    0.00458301    0.00181271
C    0.74745448    0.00955256    0.00075007    0.00079070    0.00482657   -0.00000649
C   -1.60073100   -1.10450738   -0.00376751    0.00007110   -0.00436827   -0.00152917
C    1.60521209   -1.10506071   -0.00164063    0.00428042   -0.00513407   -0.00054257
C   -1.26211296   -2.45779621   -0.00178040   -0.00885834   -0.00251754    0.00036162
C    1.25924579   -2.45467013   -0.00113707    0.00027224    0.00197440    0.00048027
H   -2.66225319   -0.85771081    0.00335301   -0.00151399    0.00001787    0.00050336
H    2.66063823   -0.85803654    0.00081868   -0.00243575   -0.00030840    0.00023705
H   -2.10536201   -3.13458700   -0.00214212    0.00384770    0.00353983   -0.00001650
H    2.10731958   -3.13737968   -0.00396902   -0.00016052    0.00038189   -0.00018684
C    0.00232517   -3.06992606   -0.00335330    0.00436901   -0.00436186   -0.00060651
H    0.00034250   -4.15318863    0.00127334   -0.00042683    0.00288494    0.00024629
   15
   -420.54117827
H    0.00180364    1.68486424   -0.00213526    0.00134358    0.00052789   -0.00043480
O    1.15520718    1.23083551    0.00188519   -0.00123853   -0.00240634    0.00050984
O   -1.15341767    1.23084868    0.00188519    0.00024457    0.00074662    0.00056653
C    0.74523591    0.01100227   -0.00146779   -0.00106261    0.00902389   -0.00068238
C   -0.74535972    0.00382813   -0.00150914   -0.00044545   -0.00315924   -0.00064184
C    1.60472864   -1.10470699    0.00244888    0.00409648   -0.00635642    0.00068045
C   -1.60491667   -1.10300382    0.00263365   -0.00405896   -0.00098255    0.00064192
C    1.25830935   -2.45322841   -0.00116656   -0.00041045    0.00410268   -0.00018125
C   -1.25625396   -2.45408087    0.00236658    0.00396292    0.00350268    0.00021154
H    2.66011089   -0.85465402    0.00247578   -0.00209647    0.00014778   -0.00013638
H   -2.66078059   -0.85692942   -0.00047184    0.00210575   -0.00036687   -0.00029822
H    2.10564535   -3.14131802   -0.00209446    0.00093159   -0.00116994   -0.00002702
H   -2.10932301   -3.13836313    0.00295071   -0.00240744   -0.00141132   -0.00006932
C   -0.00055538   -3.06990202   -0.00087988   -0.00140007   -0.00570699   -0.00029433
H    0.00347788   -4.15186795    0.00105007    0.00043840    0.00361641    0.00015565
   15
   -420.54110341
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O    1.15047152    1.23173966    0.00108395   -0.00081242   -0.00194171   -0.00003384
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   15
   -420.54098893
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O    1.15271855    1.22920255   -0.00052880   -0.00145257   -0.00016586   -0.00014387
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C    0.74893325    0.00328972    0.00443497    0.00912098   -0.00387770    0.00039068
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C    1.60107251   -1.10224018    0.00360340   -0.00290431    0.00109923    0.00020878
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C    1.26007075   -2.45513997   -0.00274130   -0.00072154    0.00175079   -0.00098068
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   15
   -420.54106363
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O   -1.15274220    1.22718976    0.00001068    0.00423888   -0.00325628   -0.00012314
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C   -0.74251754    0.00969571   -0.00086575    0.00399538    0.01017772    0.00000386
C    1.60231792   -1.09890176    0.00432312    0.00407034    0.00358346    0.00118307
C   -1.60436507   -1.10545031    0.00386010   -0.00161941   -0.00381848    0.00111057
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C    0.00090903   -3.06352578    0.00125321    0.00436191    0.00583240    0.00035003
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   15
   -420.54109749
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O   -1.15284532    1.22899202   -0.00430541    0.00203897   -0.00206709   -0.00092904
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C   -0.74177442    0.00702918    0.00212718    0.00431006    0.00218705    0.00091729
C    1.60728791   -1.10046002    0.00069179    0.00620921   -0.00251958   -0.00076609
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C    1.25380213   -2.45155565    0.00499510   -0.00770174    0.00290487    0.00102579
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   15
   -420.54117675
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O    1.15642932    1.22599593    0.00076403   -0.00058479   -0.00218954    0.00062065
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C    0.74280087    0.00533033   -0.00281922    0.00147087   -0.00146996   -0.00139335
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   15
   -420.54114070
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O   -1.15257437    1.22887127   -0.00317439    0.00162737   -0.00092360   -0.00084366
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C    1.25850211   -2.45682862    0.00029745   -0.00023814   -0.00107728   -0.00035196
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C    0.00106985   -3.07028579    0.00152718    0.00359917   -0.00722074    0.00017926
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   15
   -420.54121767
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O   -1.15433204    1.23159103    0.00177240   -0.00079490    0.00108343    0.00110761
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C   -0.73964603    0.00886900   -0.00292943    0.00289721    0.00157810   -0.00212378
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C    1.26020333   -2.45666169    0.00323978   -0.00186232   -0.00131457    0.00079489
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   15
   -420.54115242
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C   -1.25795260   -2.45129984    0.00348617    0.00341852    0.00228268    0.00063893
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   15
   -420.54115056
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O    1.15097989    1.22907386   -0.00493859   -0.00138419    0.00220694   -0.00100833
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H   -2.65796565   -0.85818128   -0.00344005    0.00384595   -0.00021440   -0.00000022
H    2.65964649   -0.85562551    0.00281265   -0.00078418    0.00021386    0.00004854
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C   -0.00177128   -3.06799335    0.00440040   -0.00246319    0.00055827    0.00156862
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   15
   -420.54117683
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C   -0.74348460    0.00545949   -0.00042157    0.00179136    0.00272323    0.00078153
C    1.60327177   -1.10355143    0.00435523    0.00102417   -0.00150765    0.00082129
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C    0.00248042   -3.06813687   -0.00220288    0.00139018   -0.00049623   -0.00072910
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   15
   -420.54116369
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O   -1.15636572    1.22635728    0.00321797    0.00151115   -0.00473171    0.00111674
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C   -1.60316880   -1.10096798    0.00158458    0.00228172    0.00394938    0.00079560
C    1.25434223   -2.45026123   -0.00205834   -0.00664978    0.00283355   -0.00067106
C   -1.25860244   -2.45695774    0.00367892    0.00321329   -0.00242061    0.00053754
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H   -2.10868335   -3.14298714    0.00438493   -0.00173589   -0.00142009   -0.00014418
C    0.00016893   -3.06537465    0.00000674    0.00149722    0.00092228   -0.00008630
H   -0.00125739   -4.15232721    0.00037291   -0.00057842    0.00039783   -0.00003271
   15
   -420.54114512
H   -0.00037482    1.68342327    0.00241457   -0.00024522    0.00069265    0.00078122
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O   -1.15779610    1.23373556   -0.00400531   -0.00147323    0.00675746   -0.00106155
C    0.74069303    0.00281530    0.00261365    0.00187538   -0.00492162    0.00053327
C   -0.74741792    0.00276178    0.00427597    0.00137815   -0.00632630    0.00098317
C    1.59890963   -1.09669477    0.00164377   -0.00476092    0.00412420    0.00027256
C   -1.60452543   -1.10547573    0.00417110   -0.00092450   -0.00427804    0.00052391
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H   -2.10574248   -3.14168412    0.00266683   -0.00200265   -0.00182594    0.00038694
C    0.00235923   -3.06615217    0.00359961    0.00157417   -0.00465927    0.00162875
H    0.00259026   -4.14897440    0.00287263   -0.00004042    0.00306537   -0.00010849
   15
   -420.54124522
H   -0.00099943    1.68108798   -0.00279979    0.00070418    0.00031714   -0.00049446
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O    1.15727324    1.22788366    0.00213289    0.00247661    0.00108428    0.00055244
C   -0.74831419    0.00134198    0.00453415   -0.00329967   -0.00510706    0.00043436
C    0.74162302    0.00484409    0.00167238   -0.00223733    0.00159296   -0.00071709
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C    1.60240282   -1.10434649    0.00269879    0.00077994   -0.00292035    0.00060060
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H   -0.00362445   -4.15696976   -0.00190560   -0.00099228    0.00090709    0.00003960
   15
   -420.54113637
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O    1.15388987    1.22723876    0.00166193   -0.00296232   -0.00647475    0.00019465
O   -1.15092846    1.22846171    0.00166193    0.00175214    0.00011148    0.00038793
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C   -0.74520133    0.00241895    0.00069960   -0.00356761   -0.00310307   -0.00002868
C    1.60734922   -1.10022264   -0.00400716    0.00432014    0.00227791   -0.00122599
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C    1.25452284   -2.45610669    0.00280989   -0.00693099   -0.00409037    0.00130819
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C    0.00059082   -3.06658115   -0.00073649    0.00514654    0.00189375   -0.00025904
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   15
   -420.54119509
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O   -1.15489926    1.22710332    0.00301208   -0.00003114   -0.00269420   -0.00012856
O    1.15281725    1.22959311    0.00301208   -0.00143880   -0.00391410    0.00071002
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C    0.74344426    0.00889507   -0.00040570   -0.00168610    0.00333853   -0.00065027
C   -1.60574734   -1.10041308   -0.00456319   -0.00757973    0.00408173   -0.00116787
C    1.60352835   -1.09732612   -0.00289837    0.00148069    0.00127419   -0.00026483
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C    1.25673067   -2.44922712   -0.00129326    0.00021778    0.00036911   -0.00048630
H   -2.65956981   -0.85977092   -0.00018658    0.00398246   -0.00186132    0.00034050
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C   -0.00253128   -3.06371619    0.00141144   -0.00188678    0.00216418    0.00079666
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   15
   -420.54115553
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O    1.15441708    1.23331599    0.00074503   -0.00170247    0.00064703   -0.00033496
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C    0.74721369    0.00980834    0.00279684    0.00295543    0.00107782    0.00061867
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C    1.60334043   -1.09889475    0.00063920   -0.00009288    0.00203199    0.00034547
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C    1.26342663   -2.45258360   -0.00293169    0.01028887   -0.00193381   -0.00008308
H   -2.65876041   -0.85304821    0.00326726    0.00117635    0.00011826    0.00016072
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H    2.10288994   -3.13483263   -0.00306907   -0.00390832    0.00282516    0.00019941
C   -0.00379433   -3.06599625   -0.00437911   -0.00602611   -0.00042305   -0.00103407
H   -0.00404081   -4.15349182   -0.00282691   -0.00048144    0.00012659    0.00016102
   15
   -420.54118131
H    0.00391045    1.68132364   -0.00218733    0.00094719    0.00045948    0.00034263
O    1.15891094    1.22584043   -0.00474930    0.00189509   -0.00140156   -0.00088734
O   -1.15817309    1.23024960   -0.00474930   -0.00397202    0.00338272   -0.00002007
C    0.74581093    0.00400977    0.00178997    0.00076336    0.00123797    0.00184166
C   -0.74621875    0.00097934   -0.00361058   -0.00301447   -0.00976352   -0.00077667
C    1.60723547   -1.10158868   -0.00316678    0.00248345    0.00103438   -0.00140742
C   -1.60292066   -1.09754529   -0.00018711    0.00451894    0.00544874    0.00031038
C    1.26129250   -2.45322132    0.00063128    0.00189673    0.00095692    0.00027946
C   -1.25986355   -2.45229057   -0.00100111   -0.00221236   -0.00047392   -0.00107846
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H   -2.10688077   -3.13391318    0.00445230    0.00081530    0.00090519    0.00025786
C   -0.00001325   -3.06560032    0.00392545    0.00062923    0.00178195    0.00074901
H   -0.00189098   -4.15864879    0.00435925   -0.00018993   -0.00372057   -0.00009780
   15
   -420.54104171
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O   -1.15240538    1.22617534    0.00168345    0.00179665   -0.00225794   -0.00011151
C    0.74453297    0.00148294   -0.00174905   -0.00051219   -0.01059232   -0.00043559
C   -0.74179634    0.00547414    0.00110264    0.00143285    0.00410105    0.00035872
C    1.59779596   -1.10215314   -0.00480252   -0.01041624   -0.00163641   -0.00150015
C   -1.60188557   -1.10530108    0.00038680   -0.00121988   -0.00436303    0.00001464
C    1.26133572   -2.45198062    0.00373702    0.00778210    0.00467602    0.00149107
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H   -2.11055654   -3.13381370    0.00123482   -0.00127623    0.00020249   -0.00007307
C   -0.00179374   -3.06752698    0.00316487   -0.00578097   -0.00445226   -0.00011883
H   -0.00074231   -4.14946538   -0.00113077   -0.00007818    0.00378361   -0.00024576
   15
   -420.54114505
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O   -1.15744223    1.23447773    0.00219895    0.00101928    0.00155785    0.00026900
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C   -0.74926483    0.00997428   -0.00006353   -0.00280187    0.00018866   -0.00008552
C    1.60721140   -1.10544651   -0.00007242    0.00760623   -0.00447913    0.00034214
C   -1.60120871   -1.09999309   -0.00137592    0.00604275    0.00082912   -0.00108817
C    1.25839364   -2.45598529   -0.00075210   -0.00186457   -0.00248602    0.00037111
C   -1.25830832   -2.45277727    0.00467549   -0.00089738    0.00064706    0.00155912
H    2.65924798   -0.85152874   -0.00497055   -0.00350184   -0.00005260   -0.00024463
H   -2.66648773   -0.85914660    0.00466026   -0.00297746    0.00016827    0.00030983
H    2.10513702   -3.13331143   -0.00374105   -0.00209408    0.00283758   -0.00003720
H   -2.10687220   -3.13949908    0.00080505   -0.00136257   -0.00122697   -0.00041354
C    0.00282111   -3.06429373   -0.00214805    0.00477135    0.00046939   -0.00090718
H   -0.00483362   -4.15017275   -0.00123803   -0.00078163    0.00118762    0.00010487
   15
   -420.54116928
H    0.00404386    1.67850545   -0.00021913   -0.00163704   -0.00053001   -0.00043604
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O   -1.15295701    1.22640305    0.00344340    0.00142825   -0.00360461   -0.00018776
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C   -0.74417968    0.00687366    0.00412223   -0.00192766    0.00531857    0.00126054
C    1.60622344   -1.10087029   -0.00008544    0.00407097    0.00156310    0.00021576
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C    1.25778272   -2.45283963    0.00198102    0.00190746   -0.00083247    0.00087673
C   -1.26049390   -2.45060442   -0.00158040   -0.00347778    0.00542606   -0.00051637
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H   -2.65992907   -0.85186574   -0.00357816   -0.00072197    0.00059591   -0.00047414
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H   -2.10354253   -3.13779049    0.00227365    0.00118596    0.00017315    0.00037691
C   -0.00055437   -3.06546375   -0.00287798    0.00011938    0.00011183   -0.00049338
H   -0.00017440   -4.15538354   -0.00305308    0.00011496   -0.00168435    0.00004747
   15
   -420.54106638
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O    1.15546149    1.22764261   -0.00351965    0.00038131   -0.00014369    0.00024393
O   -1.15526258    1.23446888   -0.00351965   -0.00179677    0.00277563   -0.00096359
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C   -0.74192071    0.00813063    0.00366462    0.00402654   -0.00226490    0.00203632
C    1.60089519   -1.10192402   -0.00208961   -0.00205807   -0.00348630   -0.00074636
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C    1.25649837   -2.44943143    0.00285534   -0.00605061    0.00877377    0.00074288
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H    2.66167170   -0.85078481    0.00452871    0.00177177    0.00064028    0.00040434
H   -2.65812899   -0.85305244    0.00181592    0.00220566   -0.00085611    0.00019121
H    2.10805437   -3.14093909    0.00280111    0.00328939   -0.00358727   -0.00014508
H   -2.10131845   -3.13890345   -0.00199532    0.00165905    0.00025554   -0.00034417
C    0.00490531   -3.06916434   -0.00028435    0.00792585   -0.00859237   -0.00076443
H    0.00037617   -4.14970977   -0.00036166   -0.00056863    0.00453607    0.00000496
   15
   -420.54114021
H   -0.00173238    1.67882584   -0.00086432    0.00039762   -0.00021881   -0.00001724
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O    1.15154186    1.22702635   -0.00033190   -0.00408508   -0.00382167    0.00013456
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C    0.74942941    0.00399756    0.00095882    0.00464374    0.00007974   -0.00021881
C   -1.60481875   -1.10543356    0.00212490   -0.00145680   -0.00503176    0.00020072
C    1.60606532   -1.09891173   -0.00133953   -0.00013075    0.00802555   -0.00068887
C   -1.26135250   -2.45513507   -0.00206066   -0.00193172   -0.00119470   -0.00044883
C    1.26115307   -2.45798559    0.00266906    0.00260669   -0.00730809    0.00057154
H   -2.66237872   -0.85152444   -0.00223807   -0.00003348    0.00037533   -0.00019045
H    2.66373479   -0.85528319   -0.00006311   -0.00140598   -0.00048357    0.00014922
H   -2.10154185   -3.14114992   -0.00178563    0.00249193    0.00161245    0.00023232
H    2.10516947   -3.14024954    0.00432535   -0.00165564    0.00163452   -0.00001527
C   -0.00178727   -3.06159011   -0.00140779   -0.00271903    0.00547838   -0.00027223
H   -0.00311647   -4.15340688   -0.00217234   -0.00004213   -0.00260057   -0.00001436
   15
   -420.54100004
H   -0.00100539    1.67823628    0.00119559   -0.00105681   -0.00028355    0.00021621
O   -1.15041328    1.22638942   -0.00076853    0.00527751   -0.00808166    0.00041588
O    1.14989730    1.22861334   -0.00076853   -0.00333447   -0.00090676   -0.00048398
C   -0.74861404    0.00944494   -0.00388709   -0.00892147    0.00671284   -0.00147925
C    0.74852966    0.00250795    0.00166357    0.00765654   -0.00431069    0.00095177
C   -1.59902683   -1.09682123    0.00096294    0.00851822    0.00519219    0.00086510
C    1.60235498   -1.10000602    0.00156208   -0.00498315    0.00180765    0.00038118
C   -1.26018601   -2.45277008   -0.00002807   -0.00698778   -0.00168237   -0.00049501
C    1.26365661   -2.45151222   -0.00134681    0.00758394    0.00271531   -0.00097866
H   -2.66583547   -0.85760135   -0.00295823   -0.00368016    0.00002649   -0.00024212
H    2.66209975   -0.85377530   -0.00098965    0.00015409   -0.00012808   -0.00019846
H   -2.10570672   -3.13374725    0.00228832    0.00173712    0.00125973    0.00011543
H    2.10187356   -3.13807942    0.00330834   -0.00366697    0.00150169    0.00036590
C    0.00307413   -3.06805595    0.00193998    0.00274387   -0.00590017    0.00086484
H   -0.00485871   -4.15219212   -0.00346051   -0.00104276    0.00220563   -0.00029928
   15
   -420.54116839
H   -0.00462988    1.68426045    0.00093081    0.00010630    0.00054640    0.00050917
O   -1.15513608    1.23147838   -0.00338346   -0.00022993    0.00382349   -0.00067741
O    1.15123632    1.23164717   -0.00338346   -0.00020057    0.00264304   -0.00028381
C   -0.74337155    0.00311897    0.00120700    0.00528368   -0.00249725    0.00072159
C    0.74064683    0.00420957   -0.00154658   -0.00287638   -0.00312306   -0.00001184
C   -1.60778266   -1.10383196    0.00140817   -0.00527867    0.00000546   -0.00036887
C    1.60048704   -1.10160367   -0.00272962   -0.00032071   -0.00148397   -0.00023379
C   -1.26048222   -2.45739498    0.00240146   -0.00143600   -0.00239362    0.00046729
C    1.25400333   -2.45317303   -0.00139460   -0.00924730    0.00236513   -0.00031358
H   -2.66370945   -0.85626921    0.00374308    0.00177963   -0.00039061    0.00014708
H    2.66058387   -0.85130720   -0.00158747    0.00119286    0.00064568    0.00015768
H   -2.11003243   -3.13556507   -0.00086772    0.00033416    0.00173341   -0.00025515
H    2.11072388   -3.13844163    0.00093156    0.00418675   -0.00286179    0.00015114
C    0.00309677   -3.06683503    0.00097563    0.00684031    0.00324361   -0.00009560
H    0.00332963   -4.15760221    0.00325415   -0.00011113   -0.00216227    0.00008567
   15
   -420.54110638
H    0.00147601    1.68126262    0.00443380    0.00008376   -0.00054323   -0.00012045
O    1.15012807    1.22619394    0.00476424   -0.00290188   -0.00898039    0.00014953
O   -1.15987908    1.23055572    0.00476424   -0.00036082   -0.00174677   -0.00018001
C    0.74336553    0.00996840    0.00284361    0.00088935    0.01087951   -0.00033123
C   -0.74786413    0.00943523    0.00458525   -0.00126695    0.00353122    0.00080505
C    1.60554877   -1.10088677    0.00130256    0.00380596    0.00233967   -0.00000194
C   -1.60037976   -1.10176470   -0.00203777    0.00531601   -0.00019218   -0.00041327
C    1.26114133   -2.45828765    0.00129895    0.00243898   -0.00249096   -0.00018322
C   -1.26341857   -2.45558273   -0.00246474   -0.00555783    0.00095435   -0.00082446
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H   -2.66472945   -0.85922970   -0.00242676   -0.00263076   -0.00007540    0.00010526
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   15
   -420.54114223
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O   -1.15956637    1.22947491   -0.00085537   -0.00117735    0.00007097   -0.00046850
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   15
   -420.54110768
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O   -1.15849180    1.22782845   -0.00084525    0.00051158    0.00218139    0.00032049
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C   -0.74936802    0.00274385   -0.00395288   -0.00390124   -0.00439978   -0.00107112
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C    0.00448391   -3.06946270    0.00131394    0.00645645   -0.00873009    0.00116917
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   15
   -420.54108728
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O   -1.15514387    1.22736762    0.00181455    0.00053578   -0.00216619   -0.00006289
C    0.73972586    0.00406850    0.00014783   -0.00836730   -0.00277976    0.00012195
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C    1.60331859   -1.10323340   -0.00280128    0.00142047   -0.00262642   -0.00081267
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C    1.25924016   -2.45663632    0.00322422    0.00111464   -0.00331373    0.00088598
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   15
   -420.54112011
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O   -1.15260850    1.22669345    0.00244315    0.00366280   -0.00207280   -0.00022397
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C    1.60432807   -1.10435116    0.00353137    0.00197986   -0.00868736    0.00097422
C   -1.59905896   -1.10532210   -0.00123403    0.00538957   -0.00315733   -0.00130545
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   15
   -420.54114978
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O    1.15384998    1.23034304    0.00148765   -0.00225347   -0.00273161    0.00050455
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C    1.60623353   -1.09932276    0.00147450    0.00400524    0.00401788    0.00073538
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C    1.26334726   -2.45580397   -0.00134913    0.00446170   -0.00348447    0.00006230
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C    0.00039507   -3.06767881   -0.00468830   -0.00322373    0.00091605   -0.00118830
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   15
   -420.54121903
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O    1.15953578    1.23490241   -0.00024868    0.00291610    0.00234118   -0.00003932
C   -0.74496986    0.00247773    0.00131617   -0.00445432   -0.00494661    0.00063293
C    0.74796306    0.00934675   -0.00152543    0.00204343   -0.00166700   -0.00034146
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C    1.60083155   -1.09726450   -0.00200397   -0.00186867    0.00328790   -0.00024424
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H   -2.65891141   -0.85680539   -0.00149007    0.00112240   -0.00056467   -0.00000582
H    2.66127377   -0.85802180   -0.00009329   -0.00020765   -0.00049787    0.00012234
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C    0.00070505   -3.06610208    0.00145079    0.00052528    0.00340214    0.00078849
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   15
   -420.54115550
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O    1.15524805    1.22733073   -0.00351700    0.00041175    0.00129285   -0.00046822
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C    0.74375334    0.00184238    0.00099236    0.00173807   -0.00324720    0.00125423
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C    1.26068636   -2.45537355    0.00083861    0.00326843   -0.00069517    0.00013661
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H    2.65795177   -0.85075937    0.00287002   -0.00079726    0.00027878   -0.00001493
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   15
   -420.54115964
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O   -1.15149171    1.22651520    0.00229739    0.00074753   -0.00309230   -0.00012831
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C    1.60100081   -1.10016499   -0.00462044   -0.00241823    0.00078383   -0.00129150
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C    1.26259909   -2.45283077    0.00125550    0.00501402   -0.00216277    0.00050431
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H    2.65863950   -0.85265609   -0.00220725   -0.00102648   -0.00025969    0.00034520
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C    0.00287241   -3.06192399    0.00204194   -0.00093177    0.00504681   -0.00010508
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   15
   -420.54118318
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C   -0.74937119    0.00927047   -0.00389846   -0.00288034    0.00241304   -0.00114730
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C    1.26220396   -2.45403045   -0.00385686    0.00599492    0.00202532   -0.00130206
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H   -2.66516876   -0.85518939    0.00433327   -0.00160645    0.00043113    0.00047837
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C   -0.00444979   -3.06917378    0.00377231   -0.00917265   -0.00239593    0.00113457
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   15
   -420.54115985
H   -0.00391899    1.68002844    0.00169510    0.00071292   -0.00073258    0.00037638
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O    1.14996436    1.23025910   -0.00174585   -0.00281235   -0.00048101   -0.00001137
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C    0.74258913    0.00675615   -0.00350150   -0.00280075    0.00223418   -0.00041201
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C    1.25537622   -2.44959951    0.00405604   -0.00968603    0.00389871    0.00143687
H   -2.66617572   -0.85037544    0.00194561   -0.00158933    0.00088680    0.00004335
H    2.66666548   -0.85371484    0.00214009    0.00153190    0.00035630    0.00009580
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C    0.00503868   -3.06394310   -0.00026501    0.00757739    0.00221514   -0.00091221
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   15
   -420.54107503
H   -0.00260391    1.68220330    0.00125635   -0.00042104    0.00059962   -0.00032834
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O   -1.15920779    1.22636427    0.00384622   -0.00194062   -0.00015287    0.00006017
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C   -1.60721107   -1.09978440    0.00400939   -0.00826167    0.00590340    0.00111617
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H   -2.65790051   -0.85877167    0.00156161    0.00616831   -0.00184147   -0.00021777
H    2.10744755   -3.13569656    0.00027143   -0.00180191    0.00173203    0.00013917
H   -2.10396634   -3.13938278   -0.00323594    0.00028111    0.00046337    0.00020711
C   -0.00055512   -3.06208240   -0.00049958   -0.00350979    0.00709546    0.00048274
H   -0.00429690   -4.15660679    0.00483712   -0.00042544   -0.00440383    0.00033049
   15
   -420.54103643
H    0.00458218    1.67794001   -0.00147534   -0.00205421   -0.00116926   -0.00003431
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O   -1.15990002    1.22553844   -0.00073718   -0.00042538   -0.00456911   -0.00021754
C    0.74897935    0.00706106    0.00037438    0.00709439    0.00273546   -0.00023162
C   -0.74392672    0.01037955    0.00215195    0.00024573    0.00695786    0.00082925
C    1.60063358   -1.09683571    0.00164886   -0.00444220    0.00614751    0.00050297
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C    1.25450344   -2.45630180   -0.00430121   -0.00307479   -0.00633055   -0.00071491
C   -1.26173632   -2.45476428    0.00488827   -0.00712843   -0.00364042    0.00163922
H    2.66517119   -0.85050868    0.00197215    0.00325287    0.00114444   -0.00005558
H   -2.66408663   -0.85819188    0.00357388   -0.00052089   -0.00079997    0.00020938
H    2.10268472   -3.13329557   -0.00090109   -0.00208075    0.00172500    0.00032988
H   -2.10422093   -3.13667602    0.00217662    0.00283862    0.00192917   -0.00036833
C    0.00419684   -3.07064662   -0.00442394    0.00840630   -0.00379014   -0.00093072
H   -0.00064309   -4.15503217   -0.00139177   -0.00046117    0.00209387    0.00022791
   15
   -420.54100660
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   15
   -420.54109470
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   15
   -420.54115939
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   15
   -420.54117041
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   15
   -420.54112841
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   15
   -420.54103843
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   15
   -420.54108350
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   15
   -420.54117262
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   15
   -420.54101759
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O   -1.15529327    1.23125374   -0.00174614   -0.00089852   -0.00043337   -0.00004823
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   15
   -420.54115197
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   15
   -420.54117017
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O    1.15618066    1.22859891    0.00290121   -0.00090145   -0.00285118    0.00076725
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C    1.60214813   -1.10008381    0.00284438   -0.00513584   -0.00017311    0.00138540
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H    2.66600132   -0.85464974   -0.00395294    0.00281659    0.00018316   -0.00049057
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C    0.00106383   -3.06807900    0.00429724   -0.00120611   -0.00390791    0.00134078
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   15
   -420.54116133
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O   -1.15522918    1.23352339    0.00003837    0.00056098    0.00048043    0.00004607
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C   -0.74636832    0.00984548   -0.00115750   -0.00101733    0.00222534    0.00002630
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H   -2.10898586   -3.13970779   -0.00001462   -0.00066816   -0.00066125   -0.00007416
C   -0.00015143   -3.06241281   -0.00171775   -0.00039231    0.00637439    0.00025885
H   -0.00001872   -4.15654063   -0.00114691    0.00033270   -0.00412067   -0.00002291
   15
   -420.54117897
H    0.00051650    1.68306219    0.00466253   -0.00184304    0.00000921    0.00051427
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O    1.15767457    1.23364738   -0.00025537    0.00270266    0.00323915    0.00035395
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C    0.74651957    0.00417792   -0.00376055    0.00154727   -0.00744806   -0.00181192
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   15
   -420.54107310
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   15
   -420.54094055
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C    0.74606520    0.00151008   -0.00230776   -0.00024090   -0.01268888    0.00029388
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   15
   -420.54106025
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O    1.15441434    1.23007246   -0.00062032    0.00155664    0.00352486    0.00026382
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C    1.60499553   -1.10160822   -0.00127045    0.00578332    0.00073383    0.00007588
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   15
   -420.54111979
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O    1.15578458    1.23002067   -0.00122488    0.00057520    0.00237123   -0.00056866
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C    0.74036147    0.00557341    0.00098254   -0.00755650   -0.00122364    0.00095452
C   -1.60000297   -1.09773598   -0.00141304    0.00261972    0.00578949   -0.00028148
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   15
   -420.54105031
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C    0.00251732   -3.06951083   -0.00318700    0.00424246   -0.00524071   -0.00064130
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   15
   -420.54113570
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O   -1.15750952    1.23056731    0.00129972   -0.00193671    0.00264135    0.00018616
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H   -2.66017533   -0.85118159    0.00356952    0.00232527   -0.00029997    0.00038601
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C    0.00434294   -3.06479607    0.00228929    0.00517090    0.00259165    0.00032422
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   15
   -420.54115999
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   15
   -420.54122515
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C    0.74696714    0.00547693    0.00229358    0.00232804   -0.00016923    0.00043496
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C    1.60248764   -1.10337589    0.00170834   -0.00276895   -0.00295531    0.00020573
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   15
   -420.54119600
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O    1.15585800    1.22614564   -0.00016662    0.00046868   -0.00319613   -0.00060754
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C    0.73978461    0.00616779    0.00410450   -0.00230862    0.00090713    0.00177471
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C    1.26334270   -2.45353232    0.00002939    0.00318342   -0.00230493    0.00027154
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   15
   -420.54119423
H   -0.00056225    1.68058737   -0.00059934   -0.00045092   -0.00051834   -0.00006407
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C    0.74561630    0.00709837    0.00215553    0.00278203    0.00300218    0.00115894
C   -1.60161657   -1.10457681    0.00289662    0.00194677   -0.00585232    0.00039310
C    1.60377835   -1.09817459   -0.00232517    0.00154827    0.00511876   -0.00069574
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C    1.26149943   -2.45546131    0.00138176    0.00188632   -0.00372823   -0.00003424
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C    0.00082688   -3.06433615    0.00270332    0.00124183   -0.00148697    0.00051885
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   15
   -420.54109955
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O   -1.15743555    1.22690117    0.00380370   -0.00036556   -0.00260243    0.00028373
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C   -0.74212189    0.00757688   -0.00213558    0.00021812    0.00418064    0.00004681
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C   -1.59793276   -1.10300847   -0.00215161    0.00240076   -0.00117673   -0.00026149
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H   -2.10387686   -3.13437306    0.00120445    0.00339789    0.00298856    0.00002529
C    0.00334236   -3.06227219    0.00364650    0.00786068    0.00829828    0.00103495
H   -0.00366312   -4.15834196   -0.00236355   -0.00097411   -0.00547766   -0.00038011
   15
   -420.54118155
H   -0.00044972    1.68021402    0.00207566   -0.00164698   -0.00087120    0.00025560
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O   -1.15757751    1.23188952   -0.00007812    0.00015321    0.00193067    0.00050731
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C   -0.74429880    0.00889657   -0.00311002    0.00244225    0.00327230   -0.00188238
C    1.60557698   -1.09750352    0.00425022    0.00147960    0.00555369    0.00038935
C   -1.59915170   -1.10438547    0.00228281    0.00695665   -0.00632092    0.00138105
C    1.25998119   -2.45522950    0.00123010    0.00024789   -0.00210292    0.00003544
C   -1.25982050   -2.45240074   -0.00237906   -0.00413967    0.00383815   -0.00084225
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H   -2.66619211   -0.85675498   -0.00342872   -0.00496815    0.00094741   -0.00035429
H    2.10769372   -3.13879420   -0.00148219   -0.00004618    0.00003885   -0.00009767
H   -2.10468735   -3.13688606    0.00004313    0.00107971    0.00049188    0.00020029
C    0.00056265   -3.06794058   -0.00050588    0.00007255   -0.00111446   -0.00004490
H   -0.00376792   -4.15659273    0.00079776   -0.00043281   -0.00081868    0.00015427
   15
   -420.54098902
H   -0.00223406    1.68194561   -0.00222295    0.00118429    0.00033078   -0.00076041
O   -1.15807681    1.22601931    0.00476933   -0.00252023   -0.00023188    0.00041458
O    1.15429082    1.22568222    0.00476933   -0.00214425   -0.00782055    0.00069766
C   -0.74080871    0.00264524    0.00344424    0.00511146   -0.00006980    0.00011236
C    0.74580583    0.00890793    0.00169189    0.00427358    0.00641957   -0.00045885
C   -1.60334205   -1.10487310    0.00384057    0.00010264   -0.00405494    0.00014207
C    1.59805354   -1.09870294    0.00099377   -0.00520965    0.00563369   -0.00061748
C   -1.25428757   -2.45461335    0.00139495    0.00906459    0.00004455    0.00000744
C    1.26356316   -2.45757081    0.00455558    0.00780126   -0.00660535    0.00176960
H   -2.66684418   -0.85488790    0.00383500   -0.00344327    0.00090684   -0.00014962
H    2.65818416   -0.84964258    0.00272886    0.00065265    0.00026560    0.00007611
H   -2.10783283   -3.13767965    0.00390175   -0.00248434   -0.00098942    0.00019612
H    2.10748709   -3.13650546   -0.00303892   -0.00271472    0.00238446   -0.00049489
C   -0.00345550   -3.06275432   -0.00318062   -0.01001906    0.00784082   -0.00110704
H   -0.00193768   -4.15662897   -0.00252773    0.00032161   -0.00395885    0.00017206
   15
   -420.54061649
H    0.00546514    1.67751811   -0.00679121   -0.00016649   -0.00187382    0.00044318
O    1.15958238    1.22676093   -0.00887238    0.00233886   -0.00308170   -0.00096415
O   -1.15408546    1.22736170   -0.00887238    0.00240180   -0.00906349   -0.00121643
C    0.73877796    0.00934452    0.00427169   -0.00606481    0.00705948    0.00189973
C   -0.74646010    0.01092104    0.00629988   -0.00482019    0.00630098    0.00151641
C    1.59856441   -1.10267499   -0.00724293   -0.00463642   -0.00376659   -0.00198496
C   -1.59426980   -1.09751452    0.00338352    0.00254127    0.01183459   -0.00038037
C    1.25443889   -2.45352656   -0.00039532   -0.00956917    0.00717808    0.00089221
C   -1.25592302   -2.46425437   -0.00432235   -0.00608454   -0.01404529   -0.00077884
H    2.66838244   -0.85288388   -0.00578912    0.00723411    0.00166278    0.00051635
H   -2.65314591   -0.85008050    0.00776855    0.00042874    0.00053412    0.00041023
H    2.10961638   -3.14815400   -0.00378610    0.00541585   -0.00582707   -0.00023511
H   -2.09926692   -3.13541793   -0.00769577    0.00593849    0.00468099    0.00001503
C    0.00415617   -3.07629805   -0.00276504    0.00644324   -0.00615434   -0.00053262
H   -0.00232714   -4.15690165    0.00412227   -0.00136177    0.00464274    0.00039777
   15
   -420.54043474
H   -0.00814607    1.67813536    0.00133550    0.00282678   -0.00037663    0.00076180
O   -1.15012148    1.23297577   -0.00541513    0.00041832    0.00184986   -0.00172293
O    1.15402676    1.23173812   -0.00541513    0.00005444    0.01130916    0.00037212
C   -0.74833874    0.00001143    0.00435177   -0.00569390   -0.00995785    0.00387306
C    0.74344191   -0.00057275   -0.00719364    0.00169272   -0.01248245   -0.00279846
C   -1.60302433   -1.09366590   -0.00901225   -0.00315735    0.01727153   -0.00194899
C    1.60173635   -1.10404430    0.00523509   -0.00599476   -0.00395267    0.00173754
C   -1.24905624   -2.46332111   -0.00528218    0.01179503   -0.01939373   -0.00021568
C    1.25962108   -2.44656617    0.00273098    0.00156547    0.01142061    0.00035072
H   -2.65883497   -0.85466343   -0.00208261    0.00313201   -0.00054644    0.00036754
H    2.66079519   -0.84637172   -0.00204528    0.00125287    0.00129620   -0.00063427
H   -2.10209812   -3.13015903    0.00811437    0.00248688    0.00383979    0.00075996
H    2.09989309   -3.14683927    0.00939147    0.00127202   -0.00327790    0.00010503
C   -0.00458350   -3.06458194   -0.00744909   -0.01080705    0.00620029   -0.00119392
H   -0.00266616   -4.15696098   -0.00215510   -0.00082703   -0.00314152    0.00018818
   15
   -420.53993887
H   -0.00245131    1.67402758    0.00637340    0.00251636   -0.00086526    0.00122767
O   -1.15847910    1.22942438   -0.00444967   -0.00621137    0.00508649    0.00047535
O    1.16037593    1.22536759   -0.00444967    0.00194593    0.00070664   -0.00122792
C   -0.74705444   -0.00370146   -0.00943962   -0.00285680   -0.01311167   -0.00358745
C    0.75039132    0.00177895    0.00014304    0.01275479   -0.01014842    0.00191135
C   -1.60994964   -1.09445077    0.00865873   -0.01448011    0.01983395    0.00223266
C    1.59736554   -1.09337251   -0.00189650   -0.01097679    0.01277900   -0.00013625
C   -1.26221826   -2.46218467    0.00691194   -0.00656805   -0.01428886    0.00109506
C    1.26730714   -2.44591121   -0.00032657    0.01706953    0.00836728   -0.00011751
H   -2.65250290   -0.86224236   -0.00171224    0.01299841   -0.00407610   -0.00062059
H    2.65743516   -0.85893363   -0.00387019   -0.00125647   -0.00186173   -0.00015790
H   -2.10298025   -3.13267421   -0.00108432    0.00724696    0.00622149   -0.00062745
H    2.10595672   -3.13444929    0.00301392   -0.00293205    0.00033967    0.00025210
C   -0.00415419   -3.07525679   -0.00031239   -0.00784077   -0.00923211   -0.00104366
H   -0.00794571   -4.16193526    0.00446573   -0.00141388    0.00033571    0.00032431
   15
   -420.54070187
H    0.00357465    1.68972566   -0.00220631   -0.00190946    0.00209706    0.00082492
O    1.15292571    1.22753122   -0.00812787   -0.00319923   -0.00328201    0.00010092
O   -1.15480851    1.22664016   -0.00812787    0.00052059   -0.00718434   -0.00218818
C    0.74793277    0.00212613   -0.00380674    0.00370939   -0.00259743   -0.00232621
C   -0.73605058    0.01411234    0.00968256    0.00712564    0.01451696    0.00444519
C    1.59894722   -1.10716461    0.00448772   -0.00893472   -0.00790930    0.00131984
C   -1.60102602   -1.09966010   -0.00134153    0.00228262   -0.00289960   -0.00142739
C    1.26642767   -2.45366715    0.00089895    0.00651561    0.01005436   -0.00060442
C   -1.26384148   -2.45387900   -0.00640449   -0.00428218    0.00304273   -0.00276229
H    2.66208187   -0.85281707   -0.00271294    0.00323082    0.00108701   -0.00024893
H   -2.66730017   -0.85036737    0.00646186   -0.00501749    0.00054950    0.00053695
H    2.11551758   -3.13885395   -0.00003034    0.00111863   -0.00093067   -0.00009455
H   -2.11417320   -3.14457551    0.00848054   -0.00329549   -0.00310541    0.00115788
C    0.00378994   -3.06789032    0.00288533    0.00354341    0.00022530    0.00161059
H   -0.00765573   -4.16065544   -0.00243741   -0.00140468   -0.00357740   -0.00034655
   15
   -420.54090957
H    0.00188488    1.68586515   -0.00758716    0.00006031    0.00259018   -0.00067446
O    1.15045627    1.23141414   -0.00071882   -0.00238006   -0.00227808    0.00132799
O   -1.15712472    1.22198241   -0.00071882    0.00017004    0.00107938    0.00058002
C    0.75175408    0.00652256   -0.00785484    0.00669908    0.00556155   -0.00239220
C   -0.74592635   -0.00302653   -0.00204775   -0.00449445   -0.00700496   -0.00032243
C    1.60663267   -1.10561780    0.00272645    0.00046807   -0.00414729    0.00265817
C   -1.60567570   -1.10621095    0.00688886    0.00117463   -0.00475629    0.00086313
C    1.26703904   -2.45717110   -0.00677892    0.00851676    0.00237308   -0.00226907
C   -1.25919955   -2.44863238    0.00819482   -0.00047226    0.01384268    0.00158118
H    2.66097273   -0.85737078   -0.00756640   -0.00326533   -0.00037116   -0.00078540
H   -2.66427779   -0.85582665    0.00114697   -0.00024030    0.00024876   -0.00056237
H    2.10548883   -3.14644396    0.00474514   -0.00251510    0.00061159    0.00083282
H   -2.11258917   -3.13811787    0.00142733   -0.00422543   -0.00277019   -0.00067778
C    0.00284198   -3.06898093   -0.00117101   -0.00040539   -0.00101748   -0.00029153
H    0.00574153   -4.16200021   -0.00014661    0.00090491   -0.00387547    0.00013249
   15
   -420.54051465
H    0.00816656    1.67437085   -0.00117811   -0.00429997   -0.00360786    0.00095558
O    1.14813235    1.23888062   -0.00892560   -0.00122505   -0.00180451   -0.00022472
O   -1.15937394    1.22108059   -0.00892560    0.00346673   -0.00899667   -0.00092523
C    0.74734795    0.01026987   -0.00646807   -0.00326789    0.00599917   -0.00139791
C   -0.73697435    0.01572594   -0.00320151    0.00758306    0.02230030    0.00158984
C    1.60865265   -1.10247811    0.00397361    0.01201151   -0.00543389    0.00059580
C   -1.59900703   -1.10992281   -0.00863218   -0.00230196   -0.00963758   -0.00169137
C    1.26804930   -2.45431111    0.00979049    0.00616883    0.00544373    0.00254143
C   -1.26057065   -2.45774930   -0.00223421   -0.01051986    0.00200785    0.00016574
H    2.65345577   -0.85980457   -0.00396185   -0.01023844   -0.00273291   -0.00037598
H   -2.65986528   -0.85934057    0.00007265   -0.00164451    0.00020592    0.00053405
H    2.10888917   -3.14516516   -0.00187510   -0.00138986   -0.00076907   -0.00090601
H   -2.10311405   -3.14075724    0.00363499    0.00220311    0.00194354    0.00036264
C    0.00955032   -3.07224303   -0.00211470    0.00451488   -0.01027013   -0.00120163
H    0.00210265   -4.15167777   -0.00289412   -0.00108710    0.00544325   -0.00002001
   15
   -420.54043468
H   -0.00340322    1.68582106    0.00541247   -0.00006230   -0.00131496    0.00131079
O   -1.15695307    1.23507436   -0.00645840   -0.00201061    0.00038979   -0.00164218
O    1.15724448    1.23715647   -0.00645840    0.00070335    0.00035016    0.00010225
C   -0.73847725    0.01386669    0.00202526    0.01270199    0.00979739    0.00156064
C    0.74428283    0.01356203   -0.00927268   -0.00370329    0.00421817   -0.00202297
C   -1.60760973   -1.10782418    0.00760993   -0.00645618   -0.01853524    0.00266279
C    1.60031717   -1.10247599   -0.00519399   -0.00447250   -0.00667966    0.00071353
C   -1.25006084   -2.44603317   -0.00530650    0.01035060    0.01189855   -0.00202804
C    1.26035905   -2.45427853   -0.00366249    0.00988634   -0.00255224   -0.00013439
H   -2.67120623   -0.86179864   -0.00840975   -0.00325514    0.00055693   -0.00115679
H    2.66616701   -0.84655779   -0.00667753    0.00522397    0.00196935   -0.00011759
H   -2.09904173   -3.13854736    0.00673739   -0.00245237   -0.00259654    0.00083223
H    2.09727313   -3.13341625    0.00550908   -0.00626655    0.00454702    0.00017326
C   -0.00395010   -3.06750919   -0.00579570   -0.01223952   -0.00897247   -0.00086583
H    0.00939201   -4.14449000    0.00945368    0.00203962    0.00700323    0.00061351
   15
   -420.54043366
H   -0.00652423    1.68153190    0.00272252    0.00384645   -0.00162699    0.00097335
O   -1.15252216    1.23890043   -0.00541365   -0.00443296    0.00399740   -0.00102872
O    1.15338032    1.22268197   -0.00541365   -0.00860430   -0.01504352   -0.00002400
C   -0.73595929    0.00906793    0.00030124    0.01178075   -0.00170110    0.00120484
C    0.74705441    0.01542047   -0.00438850    0.00129435    0.01951493   -0.00177169
C   -1.60674470   -1.09376492    0.00028471   -0.00808542    0.00327072    0.00067058
C    1.60047468   -1.10457809    0.00561574   -0.00022829   -0.00706638    0.00103179
C   -1.25049983   -2.44963657   -0.00551834    0.00517909    0.00056377   -0.00178925
C    1.24936621   -2.45239267    0.00575356   -0.01709806    0.00091774    0.00204352
H   -2.66566720   -0.84978242   -0.00314629   -0.00001580   -0.00029563   -0.00031707
H    2.66040679   -0.84857727   -0.00156395    0.00150614    0.00208889   -0.00045511
H   -2.09729704   -3.14361751    0.00788985   -0.00231111   -0.00286224    0.00099703
H    2.09640903   -3.14629810   -0.00690711    0.00155630   -0.00338109   -0.00095271
C    0.00954562   -3.06518477   -0.00480626    0.01647791   -0.00182890   -0.00076105
H   -0.00075251   -4.14723233   -0.00426648   -0.00083820    0.00356423    0.00017856
   15
   -420.54061140
H    0.00928146    1.67331387   -0.00052600   -0.00260498   -0.00462410   -0.00020398
O    1.15519512    1.23317384    0.00085606    0.00263842   -0.00740718    0.00105037
O   -1.16442063    1.23354770    0.00085606   -0.00060219    0.00046357   -0.00139167
C    0.74128479    0.01561737   -0.00606393   -0.00135454    0.01097313   -0.00317697
C   -0.74983283    0.01527517    0.00936323   -0.00019568    0.00920370    0.00441198
C    1.60150687   -1.09426545    0.00129812    0.00928309    0.00437100    0.00139158
C   -1.59848363   -1.11137764   -0.00410449   -0.00182111   -0.01054805   -0.00059003
C    1.25303672   -2.45411562   -0.00847849   -0.01226698   -0.00337090   -0.00174175
C   -1.25023499   -2.45721402   -0.00795062    0.00741683    0.00705096   -0.00166699
H    2.65483495   -0.85455708    0.00693984   -0.00457995   -0.00139016    0.00006572
H   -2.65420106   -0.85333920   -0.00794657    0.00119837    0.00195916   -0.00026550
H    2.10896647   -3.13969975    0.00407184    0.00334153   -0.00336661    0.00059327
H   -2.10691445   -3.14777111    0.00882927   -0.00566293   -0.00434579    0.00114693
C    0.00794982   -3.07185138   -0.00795112    0.00518723   -0.00553264    0.00010471
H    0.00900979   -4.14958494    0.00030684    0.00000999    0.00662779    0.00027185
   15
   -420.53994794
H    0.00969734    1.68173469    0.00056494    0.00312987    0.00000009   -0.00063499
O    1.14802813    1.22921608    0.00550009   -0.00786419   -0.01014027    0.00068442
O   -1.15859960    1.23960605    0.00550009   -0.00262304    0.01366968   -0.00007398
C    0.75262859    0.01572066   -0.00116842    0.01124016    0.02247793   -0.00114192
C   -0.75365232   -0.00116134    0.00446991   -0.01336909   -0.02332441    0.00141403
C    1.60583154   -1.11141624   -0.00061041    0.00038267   -0.01541560    0.00017576
C   -1.59462520   -1.10407341    0.00007206    0.01470317   -0.00520933   -0.00077552
C    1.26023664   -2.45759862   -0.00898785    0.00417627    0.00263681   -0.00161098
C   -1.25706254   -2.44606495   -0.00077547   -0.00376104    0.01909090   -0.00063988
H    2.66324047   -0.84705942    0.00908006    0.00055932    0.00292808    0.00045278
H   -2.66037923   -0.85368054    0.00663997   -0.00410777    0.00160915    0.00027278
H    2.10164224   -3.14096728   -0.00673814   -0.00319080    0.00196396    0.00029913
H   -2.10959883   -3.13548734    0.00444879   -0.00323056   -0.00328760    0.00024999
C    0.00116611   -3.07537643   -0.00026284    0.00281101   -0.01237330    0.00170187
H    0.00565016   -4.15435214   -0.00841093    0.00117684    0.00544640   -0.00037451
   15
   -420.54039102
H    0.00105913    1.68046397    0.00707834    0.00309844   -0.00055859    0.00142392
O    1.15303120    1.23178171   -0.00579029   -0.00077868    0.00420971   -0.00024956
O   -1.15889242    1.23688557   -0.00579029   -0.00586800    0.01136412   -0.00112592
C    0.74295065    0.00622289   -0.00796885    0.00158783    0.00041729   -0.00119943
C   -0.74439023   -0.00278431   -0.00170125    0.00439704   -0.01771787    0.00054802
C    1.59464240   -1.10798338   -0.00573142   -0.01029855   -0.00738341   -0.00117212
C   -1.61123332   -1.09543293    0.00501194   -0.01151404    0.01394088    0.00049596
C    1.26101447   -2.45373320    0.00323994    0.01363861   -0.00099418    0.00074527
C   -1.26280710   -2.45961380    0.00957754    0.00262076   -0.01169648    0.00071704
H    2.66115177   -0.86429613    0.00513254    0.00395453    0.00001872    0.00081359
H   -2.65713447   -0.85524104   -0.00252167    0.00937275   -0.00289890   -0.00032690
H    2.09622327   -3.13382704   -0.00384590   -0.00613582    0.00501124   -0.00044377
H   -2.09954266   -3.14836099    0.00293345    0.00340427    0.00135068   -0.00041916
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H    0.00363456   -4.15116299    0.00342129    0.00113710   -0.00328074   -0.00040939
   15
   -420.54082254
H    0.00110887    1.67608117    0.00769962   -0.00256702   -0.00150293    0.00087444
O    1.14792466    1.22783784   -0.00101592   -0.00105512   -0.00194504   -0.00134881
O   -1.14904239    1.22692122   -0.00101592    0.00865878   -0.00966819   -0.00055375
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C   -0.75210660    0.01115346    0.00069862   -0.00494617    0.01095998    0.00039857
C    1.60012090   -1.09396247   -0.00611525    0.00769671    0.01081803   -0.00228808
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C    1.25148606   -2.45379998   -0.00057701   -0.00823940   -0.00415497    0.00096755
C   -1.26392860   -2.45105531    0.00628254   -0.00306808   -0.00192667    0.00332645
H    2.65215702   -0.85933548    0.00402977   -0.00595394   -0.00254217    0.00065522
H   -2.66693102   -0.84641248   -0.00583490    0.00073194    0.00069987    0.00047095
H    2.10614983   -3.13780349   -0.00209988    0.00298548   -0.00202939    0.00005469
H   -2.10758918   -3.13452176   -0.00675189    0.00170765    0.00132085   -0.00082832
C   -0.00063584   -3.06381990   -0.00358696    0.00534743    0.00514058   -0.00113480
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   15
   -420.54026962
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O    1.14479387    1.23105628    0.00799550   -0.00311058    0.00387692    0.00303736
O   -1.15529697    1.23499291    0.00799550   -0.00265991    0.00840254    0.00061979
C    0.73963955   -0.00025265   -0.00932680   -0.00307981   -0.01046674   -0.00465238
C   -0.73859471    0.00079433    0.00518599    0.01058809   -0.00957810    0.00169394
C    1.60960824   -1.09304694    0.00199719    0.00263039    0.00946629    0.00172383
C   -1.60700237   -1.09372731    0.00181700   -0.00900532    0.01615708    0.00055208
C    1.26813686   -2.44840871    0.00292474    0.01295048   -0.00172712    0.00046978
C   -1.26306565   -2.46402856   -0.00342857    0.00365133   -0.01734294   -0.00038755
H    2.66260124   -0.84484831   -0.00532636   -0.00349809   -0.00143390   -0.00049702
H   -2.65798679   -0.85734888   -0.00378789    0.00628752   -0.00293400   -0.00039499
H    2.10239163   -3.14076697   -0.00058334   -0.00284035    0.00120695   -0.00036893
H   -2.10401850   -3.14759063   -0.00921167    0.00303169    0.00161873   -0.00000465
C   -0.00916932   -3.05901714    0.00055446   -0.01666409    0.00282486    0.00010250
H    0.00552457   -4.14847077   -0.00159583    0.00065531   -0.00099340    0.00000037
   15
   -420.54081394
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O    1.16285365    1.23340293   -0.00368634    0.00513537    0.00786403   -0.00068068
O   -1.15562178    1.23636228   -0.00368634   -0.00479025    0.00855070   -0.00004850
C    0.74293394    0.00393087   -0.00073144   -0.00819045   -0.00119969    0.00116801
C   -0.74330165    0.00065335   -0.00369218    0.00301897   -0.01372212   -0.00047129
C    1.61078208   -1.10860783   -0.00516055    0.00657622   -0.00824877   -0.00128834
C   -1.60872221   -1.09884115   -0.00157644   -0.00890767    0.00318637   -0.00063072
C    1.26180884   -2.45564088   -0.00168094    0.00069756    0.00314628   -0.00039827
C   -1.25090403   -2.45178965    0.00850031    0.00808271    0.00139240    0.00124989
H    2.66597735   -0.85508407    0.00477415   -0.00141621    0.00023543    0.00065189
H   -2.66012196   -0.84535895   -0.00157863    0.00386707    0.00035264    0.00011862
H    2.10044776   -3.14683089   -0.00148786   -0.00200335    0.00036426    0.00011254
H   -2.10122722   -3.13859087    0.00508784   -0.00183557   -0.00128219   -0.00047295
C    0.00211416   -3.06866950    0.00663963   -0.00168322    0.00135141    0.00055037
H    0.00452929   -4.16198146    0.00408736    0.00059475   -0.00408334   -0.00031813
   15
   -420.54071970
H   -0.00601049    1.68701058   -0.00088149    0.00131404    0.00032534    0.00056569
O   -1.15345778    1.23540355   -0.00473600   -0.00158961    0.00039386   -0.00116804
O    1.16256570    1.22306472   -0.00473600    0.00046976   -0.00880503   -0.00130647
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C    0.74080587    0.01105775    0.00989799   -0.00262428    0.00427491    0.00243723
C   -1.59719121   -1.11064243   -0.00100474    0.00385563   -0.01464360   -0.00082961
C    1.59664803   -1.09502361   -0.00434121   -0.00731938    0.00450592   -0.00285213
C   -1.25973320   -2.45880496   -0.00146609   -0.00193580   -0.00019998   -0.00131478
C    1.25022474   -2.44875161    0.00497075   -0.00906831    0.00051096    0.00176998
H   -2.66020569   -0.84895624   -0.00518855   -0.00407573    0.00236769    0.00008860
H    2.66988901   -0.85522260   -0.00037023    0.00823221    0.00078982    0.00071602
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H    2.11152905   -3.12847398   -0.00318342    0.00480140   -0.00230751   -0.00041631
C   -0.00178826   -3.06515417    0.00143345    0.00065613    0.00120014    0.00025034
H   -0.00040590   -4.14953988   -0.00734964   -0.00044633    0.00220914   -0.00048777
   15
   -420.54055917
H    0.00967996    1.68597632    0.00287534   -0.00254534   -0.00083694    0.00121256
O    1.15492991    1.23880475   -0.00696687    0.00147249    0.00640386   -0.00200994
O   -1.14622841    1.23890640   -0.00696687    0.00358289    0.00519817   -0.00034841
C    0.73900717    0.00631403    0.00698138   -0.00582312   -0.00784035    0.00382636
C   -0.73996911    0.01073892   -0.00188258    0.01020154    0.00172742   -0.00175733
C    1.59480422   -1.09549323   -0.00846391   -0.00484177    0.00744718   -0.00462051
C   -1.61141931   -1.10276213    0.00535067   -0.01490169   -0.00073503    0.00035999
C    1.25081944   -2.45842665    0.00902493   -0.01168541   -0.00784006    0.00330799
C   -1.25462700   -2.45817788    0.00999710    0.00818060   -0.00562263    0.00291684
H    2.66211010   -0.85225331    0.00937951    0.00495141    0.00073255    0.00134081
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H    2.10617260   -3.13807586   -0.00123637    0.00178614   -0.00136703   -0.00069666
H   -2.10782397   -3.14159167   -0.00920801   -0.00264221   -0.00093833   -0.00111733
C    0.00528486   -3.06826000   -0.00082397    0.00768384    0.00361435   -0.00234864
H   -0.00213407   -4.15568473   -0.00045150   -0.00070763    0.00015663    0.00018926
   15
   -420.54068183
H   -0.00967983    1.68003315    0.00172535    0.00069396   -0.00165920    0.00133813
O   -1.15701027    1.23206677   -0.00883350    0.00201026   -0.00427410   -0.00028869
O    1.14749495    1.23430761   -0.00883350   -0.00497668   -0.00228710   -0.00114056
C   -0.74790458    0.01308915   -0.00523665   -0.00028676    0.01051016   -0.00183048
C    0.74698037    0.01231847   -0.00001281    0.00792275    0.00557059    0.00043476
C   -1.60727600   -1.10281842    0.00755732   -0.00835554   -0.00625592    0.00208721
C    1.59406967   -1.10571972    0.00839067   -0.01179042   -0.01183878    0.00183632
C   -1.25265616   -2.45288948    0.00056748    0.00717866    0.00373688   -0.00105965
C    1.26528930   -2.45159046   -0.00247551    0.01277310    0.00555378   -0.00179367
H   -2.66025549   -0.84646657   -0.00056365    0.00283409    0.00127669   -0.00044642
H    2.65910130   -0.84662146    0.00116716    0.00463469    0.00214288   -0.00049052
H   -2.11330429   -3.13350550   -0.00201521   -0.00492582   -0.00187587   -0.00011799
H    2.09730295   -3.13919435   -0.00340543   -0.00640306    0.00254896    0.00018899
C    0.00369375   -3.06913837    0.00415749   -0.00175434   -0.00074756    0.00134579
H    0.00666882   -4.15987997   -0.00047063    0.00043721   -0.00234983   -0.00006445
   15
   -420.53985574
H    0.00410417    1.67777132    0.00178752   -0.00205860   -0.00208880    0.00088525
O   -1.14762949    1.23134264   -0.00604608    0.00220269    0.00167813   -0.00222782
O    1.16353285    1.24006487   -0.00604608    0.00918586    0.01696253   -0.00094828
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C    0.73736055   -0.00104601    0.00103936   -0.01505492   -0.01662677    0.00058518
C   -1.60278168   -1.10617019   -0.00644216   -0.00091324   -0.00357129   -0.00242364
C    1.61097074   -1.09498312   -0.00708461    0.00908983    0.01333714   -0.00210914
C   -1.25111753   -2.46146562   -0.00965219    0.01684172   -0.00772297   -0.00262259
C    1.26715089   -2.46176891    0.00000312    0.01326100   -0.01923057    0.00001023
H   -2.66550223   -0.84685660    0.00922829   -0.00406465    0.00250486    0.00121481
H    2.66383417   -0.84750940    0.00212486   -0.00341374   -0.00142700    0.00092286
H   -2.11412239   -3.13638538   -0.00096399   -0.00458009   -0.00090707    0.00090385
H    2.10081939   -3.13152560   -0.00288333   -0.01003612    0.00915138   -0.00018435
C   -0.00422909   -3.06394523    0.00660550   -0.01643352    0.00633767    0.00296647
H    0.00284198   -4.15254000   -0.00780748    0.00070050   -0.00036102   -0.00098129
   15
   -420.54059720
H    0.00348617    1.68473150    0.00405388   -0.00254813    0.00178755   -0.00074365
O    1.15553216    1.22770786    0.00864013    0.00086564    0.00114843   -0.00052384
O   -1.15634436    1.23314434    0.00864013   -0.00179715    0.00697242    0.00175482
C    0.75047434   -0.00389321    0.00714805    0.01202617   -0.01673979    0.00271311
C   -0.74572557    0.00527609   -0.00687809   -0.00219167   -0.00277494   -0.00280993
C    1.60148066   -1.09404550   -0.00304414   -0.00961083    0.01622463   -0.00000168
C   -1.59990621   -1.10762248   -0.00987535   -0.00046024   -0.00723957   -0.00215302
C    1.26238684   -2.45914711   -0.00476910    0.00284813   -0.01335110   -0.00089889
C   -1.24910672   -2.45126298    0.00305822    0.00355751    0.00398574    0.00192251
H    2.66496300   -0.84495881   -0.00926832    0.00296808    0.00091886   -0.00030144
H   -2.65651484   -0.85746921    0.00925317    0.00137670    0.00080454    0.00112670
H    2.10149291   -3.13306993   -0.00323464   -0.00708637    0.00519365    0.00041795
H   -2.10326330   -3.12969088   -0.00339949   -0.00167667    0.00064625   -0.00078196
C    0.00834074   -3.06607413    0.00242075    0.00185695   -0.00139329    0.00060703
H    0.00287718   -4.14808071   -0.00106082   -0.00013999    0.00387107   -0.00032703
   15
   -420.54022293
H    0.00977600    1.68315745   -0.00556889   -0.00224271    0.00024875    0.00059617
O    1.15733238    1.23258541   -0.00958862    0.00346151    0.00402246   -0.00002310
O   -1.14763899    1.22049827   -0.00958862    0.00720034   -0.01207380   -0.00108652
C    0.73745549    0.00576550   -0.00679376   -0.01526166    0.00668712   -0.00067728
C   -0.74262584    0.00720278    0.00135694    0.00057535    0.00956804    0.00165889
C    1.60680361   -1.11117113   -0.00836688    0.00951200   -0.02031076   -0.00153215
C   -1.60846203   -1.09957319    0.00257331   -0.00788008    0.00228693   -0.00021869
C    1.25760699   -2.44956672   -0.00061341   -0.00081015    0.00762499    0.00182311
C   -1.26803519   -2.45122421    0.00416352   -0.00871852    0.00604419    0.00204191
H    2.65968498   -0.85790922   -0.00002390   -0.00292732   -0.00023802    0.00056709
H   -2.65632663   -0.84990635   -0.00387635    0.00693962   -0.00177853   -0.00031798
H    2.09922544   -3.13036831   -0.00574729   -0.00372886    0.00335139   -0.00039444
H   -2.11575995   -3.14369010   -0.00499808   -0.00302741   -0.00250193   -0.00054394
C    0.00898446   -3.06366355   -0.00826743    0.01857212    0.00520826   -0.00227755
H   -0.00434214   -4.16327373   -0.00441184   -0.00165580   -0.00805024    0.00038487
   15
   -420.54056494
H   -0.00702681    1.67486127   -0.00709651    0.00113606   -0.00371638   -0.00174424
O   -1.14686983    1.23826247    0.00750227   -0.00078440    0.00085085    0.00253030
O    1.16014315    1.23345947    0.00750227   -0.00224527    0.00209600    0.00025887
C   -0.73587215    0.01337618   -0.00859305    0.00297715    0.00777917   -0.00359245
C    0.75301917    0.00807230    0.00565202    0.00105824   -0.00329847    0.00282212
C   -1.59648581   -1.09666042   -0.00674860   -0.00080091    0.00600410    0.00027994
C    1.61063055   -1.09948844   -0.00629406    0.01287793    0.00713370   -0.00175791
C   -1.26626040   -2.46375064   -0.00076882   -0.01121766   -0.01455329    0.00031855
C    1.25834275   -2.45627127    0.00653577    0.00319014   -0.01151933    0.00133210
H   -2.65481263   -0.85357358   -0.00772068    0.00104468   -0.00128142    0.00007042
H    2.65437450   -0.85421156   -0.00871505   -0.01066017   -0.00165247   -0.00000689
H   -2.09966595   -3.14541391   -0.00233441    0.00714282    0.00397470   -0.00009582
H    2.09985171   -3.12898111    0.00648193   -0.00568178    0.00586826   -0.00010600
C   -0.00117129   -3.06479225    0.00536809    0.00180890    0.00653356   -0.00005991
H    0.00449667   -4.15914706    0.00576924    0.00013678   -0.00415429   -0.00024931
   15
   -420.54057599
H   -0.00115506    1.67797656   -0.00036423   -0.00121179   -0.00106697   -0.00101145
O    1.14985019    1.22257566    0.00767596   -0.00344396   -0.01167420    0.00163129
O   -1.15874754    1.22611365    0.00767596    0.00189640   -0.00963865    0.00126646
C    0.74507975    0.00658756   -0.00613239    0.00640632    0.00166052   -0.00283285
C   -0.74697513    0.01424926   -0.00483293   -0.00352703    0.01494353   -0.00140030
C    1.60083117   -1.09306891    0.00898577   -0.00279326    0.00950520    0.00312171
C   -1.59529546   -1.10084313    0.00284693    0.00299386    0.00027210    0.00254514
C    1.25016109   -2.44769780    0.00162157   -0.00091334    0.00087539   -0.00071723
C   -1.25476979   -2.45663651   -0.00762543    0.00560849   -0.00006425   -0.00346606
H    2.66574918   -0.85603846   -0.00307495    0.00265215   -0.00017522   -0.00094724
H   -2.65406895   -0.84728747   -0.00197909   -0.00021939    0.00149438   -0.00058931
H    2.09896307   -3.13028644   -0.00375846   -0.00029157   -0.00003859   -0.00041073
H   -2.09995851   -3.14651389    0.00673133    0.00041570   -0.00216312    0.00097361
C   -0.00612600   -3.07442589    0.00663998   -0.00873762   -0.01235900    0.00188517
H    0.00950828   -4.14918561    0.00672147    0.00113852    0.00855594   -0.00004739
   15
   -420.54040930
H   -0.00608252    1.68723304    0.00694823    0.00361932    0.00190112    0.00167462
O   -1.16176405    1.23835763   -0.00808262   -0.00506640    0.01371789   -0.00196622
O    1.15315056    1.22853407   -0.00808262   -0.00285174   -0.00586095   -0.00026437
C   -0.75404063   -0.00390592    0.00036684   -0.00645329   -0.01699411    0.00309276
C    0.74892516    0.01246067   -0.00933979    0.00901334    0.01308237   -0.00264240
C   -1.60764035   -1.11101853   -0.00698882    0.00212707   -0.00375313   -0.00224167
C    1.60426314   -1.10531982    0.00430927    0.00188820   -0.00186328    0.00191791
C   -1.26391472   -2.46304495    0.00329925   -0.00527086   -0.00409304   -0.00017521
C    1.26439694   -2.46314182   -0.00066195    0.00202921   -0.01188293   -0.00197558
H   -2.66541392   -0.85410293    0.00304033   -0.00015627    0.00132602    0.00068522
H    2.65852840   -0.84804944    0.00089601   -0.00217531    0.00098332   -0.00024027
H   -2.11377304   -3.13842124    0.00916544    0.00024772    0.00288799    0.00025051
H    2.10820702   -3.13957084    0.00621271   -0.00338057    0.00353071    0.00044964
C    0.00447312   -3.06108610    0.00925695    0.00779343    0.01139975    0.00263529
H   -0.00704358   -4.15590291   -0.00819340   -0.00135690   -0.00434337   -0.00120002
   15
   -420.54043635
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O   -1.14661876    1.22128900   -0.00063755    0.00679032   -0.00626587   -0.00024493
C    0.73855354    0.01568019    0.00008084   -0.00801044    0.01379542   -0.00078558
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C    1.59403614   -1.09926534    0.00020352   -0.00946514   -0.00187973    0.00036893
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C    1.26117814   -2.45863260   -0.00153277   -0.00192048   -0.00708372   -0.00080504
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H   -2.10126921   -3.13705291    0.00996980    0.00808709    0.00694948    0.00081142
C    0.00750209   -3.06350102   -0.00003655    0.01251252    0.00350228    0.00044496
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   15
   -420.54055199
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O   -1.15150131    1.22922652    0.00273382    0.00036998   -0.00019644    0.00069633
O    1.16436127    1.23660149    0.00273382    0.00521953    0.00216039   -0.00018574
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C    0.74438916    0.01476260    0.00200576   -0.00384632    0.00433687    0.00062644
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C    1.60290693   -1.09368104    0.00371396    0.00136580    0.00949635   -0.00010491
C   -1.26856602   -2.45715520   -0.00229857   -0.00853786   -0.00305380   -0.00071039
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H   -2.66413709   -0.85792359   -0.00397809   -0.00108010   -0.00158168   -0.00080185
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C    0.00060276   -3.06920919   -0.00399278    0.00945313   -0.00686945   -0.00014052
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   15
   -420.54075946
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O    1.14804114    1.22594100   -0.00482027   -0.00272574    0.00473455   -0.00087235
O   -1.14627863    1.23242143   -0.00482027    0.00462223    0.00018927   -0.00122192
C    0.73469157   -0.00397223    0.00629761   -0.00779236   -0.00627414    0.00175332
C   -0.74153490    0.00686516    0.00855388    0.00475506    0.00008768    0.00257338
C    1.59653710   -1.10750901   -0.00683197    0.00278932    0.00316477   -0.00277435
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C    1.25631549   -2.46387860    0.00517560    0.00720799   -0.00657817    0.00108152
C   -1.26386423   -2.45101861    0.00389281   -0.00408469    0.00192907    0.00093785
H    2.65196659   -0.86077176   -0.00100254   -0.00225530   -0.00093238    0.00088337
H   -2.65668228   -0.84777327    0.00012752    0.00377216   -0.00093905    0.00088014
H    2.09864476   -3.13848720   -0.00150831   -0.00499748    0.00454490   -0.00030589
H   -2.10127689   -3.14386686   -0.00433718    0.00271470   -0.00083865   -0.00031047
C   -0.00657450   -3.07432976    0.00823995   -0.00321012   -0.01034454    0.00023674
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   15
   -420.54009622
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O   -1.16457147    1.22965076   -0.00828141   -0.00322815    0.00314825   -0.00030669
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C   -0.74210247    0.00626429   -0.00398521    0.00677246    0.00130545   -0.00168000
C    1.60682887   -1.09683953   -0.00124549    0.01960229    0.00907430    0.00026116
C   -1.59681789   -1.11074055    0.00690288    0.00019416   -0.00795550    0.00226937
C    1.25081929   -2.45776907   -0.00920451   -0.01567635   -0.00973096   -0.00282681
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H    2.65183002   -0.86378711   -0.00325768   -0.01079886   -0.00373472    0.00015913
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H    2.10427612   -3.14213490   -0.00658226    0.00274258   -0.00156483    0.00052628
H   -2.10141681   -3.12972707    0.00632353    0.00291594    0.00473222    0.00071823
C    0.00274799   -3.05866320    0.00904210    0.00394800    0.02152876    0.00386508
H   -0.00980895   -4.16291535   -0.00210574   -0.00181687   -0.01027473   -0.00079043
   15
   -420.54004471
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O    1.15826371    1.22128881   -0.00763712   -0.00455245   -0.01954458   -0.00182183
O   -1.16008948    1.22832831   -0.00763712   -0.00575232    0.00161826   -0.00161840
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C   -0.73830686    0.00456228    0.00329963    0.01107688    0.00270348    0.00046172
C    1.59639068   -1.09982398    0.00319824   -0.01391042   -0.00220237   -0.00128122
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C    1.26730253   -2.45065717    0.00353339    0.02061850    0.00048658    0.00036227
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C   -0.00252603   -3.06684360    0.00113541   -0.00834956    0.00221106    0.00063742
H   -0.00179117   -4.16264347   -0.00946538   -0.00019123   -0.00553747   -0.00036104
   15
   -420.54069785
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O   -1.15479270    1.22647879    0.00535538    0.00360265   -0.01006630    0.00023947
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C   -0.74207142    0.01321986    0.00736244    0.00647944    0.01265836   -0.00001063
C    1.60249062   -1.09723894    0.00590072   -0.00642853   -0.00097043    0.00085294
C   -1.60773588   -1.09246468    0.00751484   -0.00864577    0.00978774    0.00082742
C    1.26558834   -2.44911637   -0.00181962   -0.00129739    0.00760370   -0.00194370
C   -1.26147603   -2.45426789    0.00824555   -0.00450367   -0.00567618    0.00101098
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H    2.11520730   -3.14731894    0.00708329    0.00460553   -0.00542194    0.00080376
H   -2.09911811   -3.14764436    0.00110743    0.00162482   -0.00050071   -0.00034714
C    0.00479983   -3.06304268    0.00281049    0.00187670    0.00229355   -0.00000209
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   15
   -420.54087019
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O   -1.15031997    1.23351695    0.00365334    0.00332201   -0.00130375   -0.00059080
C    0.74675929    0.00399892   -0.00108153    0.00146378   -0.00141663   -0.00072857
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C    1.60310516   -1.10685801   -0.00776729   -0.00214751   -0.00191027   -0.00143035
C   -1.59727309   -1.09614521   -0.00339240    0.00663402    0.00794786   -0.00163199
C    1.26635612   -2.46276265   -0.00384502    0.00388754   -0.00825573    0.00083513
C   -1.25550593   -2.46032347    0.00643974   -0.00330449   -0.01222914    0.00319801
H    2.66475003   -0.86414084    0.00138469    0.00104424   -0.00057892    0.00056403
H   -2.66808575   -0.85342498   -0.00739193   -0.00679836    0.00100909   -0.00011002
H    2.11367071   -3.13323920   -0.00214039   -0.00370564    0.00436398    0.00011821
H   -2.10389115   -3.13572151   -0.00421525    0.00163952    0.00232889   -0.00068382
C    0.00795582   -3.06636468   -0.00788046    0.00460647    0.00608873   -0.00214543
H    0.00253826   -4.15686272   -0.00384000   -0.00042603   -0.00158325    0.00027037
   15
   -420.54056194
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O    1.14810840    1.22063358    0.00832167   -0.00246931   -0.01327845   -0.00023361
O   -1.15978139    1.22051941    0.00832167    0.00455206   -0.01213448    0.00017851
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C   -0.75399902    0.00813234    0.00458982   -0.00611612    0.01181209   -0.00063562
C    1.60965709   -1.10469936   -0.00066223    0.00887462   -0.00279845   -0.00118221
C   -1.60539082   -1.10619087    0.00623271    0.00004988   -0.00107329    0.00043729
C    1.25237551   -2.45800982    0.00292106   -0.00164304   -0.00776677    0.00063796
C   -1.25938787   -2.45890489    0.00149493   -0.00563262   -0.00868943    0.00009224
H    2.67107056   -0.86136761    0.00503213    0.00143793    0.00004482    0.00023736
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H    2.09828070   -3.13072394    0.00900630   -0.00380902    0.00479438    0.00012509
H   -2.09652918   -3.13042785    0.00409858    0.00855767    0.00728646    0.00001249
C   -0.00328614   -3.06978461   -0.00298577   -0.00039071   -0.00398933   -0.00142167
H   -0.00187063   -4.14936135    0.00992214    0.00004606    0.00551357    0.00058026
   15
   -420.54062842
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O    1.14874285    1.22818901    0.00820378   -0.00017634   -0.00538327    0.00149950
O   -1.16235725    1.22474833    0.00820378   -0.00088135   -0.00288669   -0.00057427
C    0.74031074    0.00336577   -0.00657689   -0.00323830   -0.00345885   -0.00284657
C   -0.73804981    0.01094175    0.00639849    0.00951039    0.01042992    0.00171827
C    1.60287321   -1.09303230   -0.00497571   -0.00501869    0.00573385   -0.00146476
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C    1.26015620   -2.44620356    0.00709793   -0.00456926    0.00705661    0.00390145
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H    2.67067917   -0.86187027    0.00671013    0.00406106   -0.00160535    0.00059834
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H    2.10361390   -3.14683688   -0.00619040    0.00206624   -0.00495791   -0.00133001
H   -2.11371748   -3.14556136   -0.00524402   -0.00614108   -0.00317604    0.00006885
C    0.00949259   -3.06610233   -0.00823158    0.00464187    0.00587248   -0.00247260
H   -0.00447420   -4.15991178    0.00292901   -0.00277767   -0.00415877    0.00080175
   15
   -420.54081722
H    0.00274850    1.68615030   -0.00804788   -0.00013485   -0.00017971   -0.00098877
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O   -1.16444078    1.23811199    0.00194270   -0.00537346    0.00767011    0.00037184
C    0.73701986    0.00820799    0.00822459   -0.00514729    0.00512525    0.00164442
C   -0.74427727    0.00871355    0.00690506    0.00900929   -0.00521922   -0.00004597
C    1.59934856   -1.10190941   -0.00339493    0.00525004   -0.00202690   -0.00172560
C   -1.60444694   -1.10074446    0.00628773   -0.00595396    0.00030232    0.00099103
C    1.25301143   -2.45480188    0.00236501   -0.01204764    0.00015601    0.00062347
C   -1.25127361   -2.45160981    0.00333535    0.00375717    0.00319521    0.00019577
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H   -2.66136704   -0.86020043   -0.00841425    0.00199444   -0.00067876   -0.00065989
H    2.11339133   -3.13149072    0.00583504    0.00308154   -0.00130821    0.00018735
H   -2.10720813   -3.13414995    0.00295595   -0.00331623   -0.00142409    0.00008238
C    0.00815863   -3.07214488   -0.00153793    0.01068790   -0.00928672   -0.00149372
H   -0.00458292   -4.14679231    0.00770773   -0.00113327    0.00873759    0.00040297
   15
   -420.54038484
H   -0.00592104    1.67373941    0.00001694    0.00221779   -0.00255386   -0.00120444
O   -1.15519966    1.22247575    0.00858047    0.00180727   -0.01122882    0.00119941
O    1.15240337    1.22708895    0.00858047   -0.00099818   -0.00253617    0.00175246
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C    0.73731988    0.00962820   -0.00971141   -0.00859411    0.00780971   -0.00222723
C   -1.59442601   -1.09460808   -0.00369251    0.00433035    0.01129522   -0.00059123
C    1.60338602   -1.10159198   -0.00440862    0.00350139   -0.00252393    0.00149300
C   -1.25421704   -2.45794177    0.00506210    0.00706039   -0.00867180    0.00180008
C    1.26775995   -2.44842546   -0.00598704    0.01479030    0.00536070   -0.00061803
H   -2.65650226   -0.85744389    0.00378382   -0.00071780   -0.00092693    0.00003725
H    2.65789627   -0.86407747   -0.00713484   -0.00408795   -0.00291957   -0.00045499
H   -2.09762494   -3.14584917    0.00666722    0.00125887   -0.00094560   -0.00040098
H    2.09864557   -3.14535886    0.00227666   -0.00332839    0.00036316    0.00039756
C   -0.00811237   -3.06026160   -0.00332042   -0.01776673    0.01139491   -0.00087347
H    0.00308545   -4.16269791    0.00414257    0.00069472   -0.00944320    0.00026687
   15
   -420.54052014
H    0.00344499    1.68655672   -0.00898890   -0.00025817   -0.00030007   -0.00099148
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O   -1.15929698    1.23514923    0.00090135    0.00109021   -0.00468618    0.00120185
C    0.73987099    0.00878089    0.00587744   -0.00477639    0.00008786    0.00164252
C   -0.75419605    0.01432060   -0.00108468   -0.00721952    0.00667269   -0.00206735
C    1.60455755   -1.11009508    0.00277534    0.00622859   -0.01209874    0.00085309
C   -1.60107410   -1.10198227    0.00714442    0.00135173    0.00233641    0.00241823
C    1.26613330   -2.45683221   -0.00941465    0.00969534    0.00257695   -0.00261653
C   -1.25818527   -2.46422050   -0.00120969    0.00172195   -0.01408871   -0.00058993
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H   -2.66073894   -0.85448066   -0.00748067   -0.00005463    0.00087700   -0.00091650
H    2.11468484   -3.13680083    0.00634962    0.00020907    0.00155899    0.00109448
H   -2.10071809   -3.13972994    0.00176580    0.00486682    0.00377142    0.00006222
C   -0.00858165   -3.06603936   -0.00595143   -0.01648415    0.00001291   -0.00019116
H    0.00662203   -4.14849434    0.00220313    0.00125665    0.00370623    0.00048130
   15
   -420.54040217
H   -0.00702619    1.68300727    0.00819384    0.00018010   -0.00035562    0.00201938
O   -1.15664775    1.23568255   -0.00938786   -0.00036384   -0.00033524   -0.00240256
O    1.14543701    1.22500816   -0.00938786   -0.01000300   -0.01581109   -0.00134407
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C    0.75416924    0.01087487   -0.00064599    0.01298948    0.01092261    0.00026762
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   15
   -420.54035228
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O    1.16084020    1.23775096   -0.00242884    0.00844160    0.01526463    0.00022547
O   -1.16205344    1.22930785   -0.00242884   -0.00503909    0.00586224   -0.00083403
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C   -0.73858204    0.00168360   -0.00153182    0.00726014   -0.00632783    0.00131559
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C    1.26400079   -2.45068347    0.00793045    0.00379163    0.01314265    0.00297417
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H   -2.09942854   -3.14407669    0.00233129   -0.00224241   -0.00318331    0.00019443
C   -0.00068519   -3.06000668    0.00261417   -0.00695276    0.00200274    0.00014829
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   15
   -420.54043916
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O   -1.14814570    1.22465039   -0.00447836    0.00495571   -0.00521597   -0.00225240
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C    1.59439477   -1.09818570   -0.00951341   -0.00908647    0.00838383   -0.00154978
C   -1.59937969   -1.11129488   -0.00960838    0.01323086   -0.01634299   -0.00257069
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H   -2.10261244   -3.14481854   -0.00390222   -0.00170902   -0.00269321    0.00015592
C   -0.00023204   -3.06298668   -0.00213055    0.00207456    0.00566525    0.00053885
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   15
   -420.54023196
H    0.00046263    1.67315457    0.00589141   -0.00071769   -0.00293330    0.00052720
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O    1.15657607    1.24017477    0.00055216    0.00230933    0.01167449   -0.00035202
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C    0.74752472    0.00313587    0.00229221   -0.00169312   -0.01239330   -0.00093493
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C    1.60906611   -1.09433996    0.00786060    0.00687079    0.00678931    0.00290699
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C    1.25069774   -2.44889035   -0.00774919   -0.01304654    0.00527159   -0.00241898
H   -2.67098850   -0.86259976    0.00466460   -0.00433561    0.00013228    0.00067501
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C    0.00392335   -3.07193829   -0.00007976    0.01125284   -0.01164724    0.00150244
H   -0.00024816   -4.15259832   -0.00227937   -0.00041716    0.00420598   -0.00012696
   15
   -420.54063076
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O    1.16093632    1.23664564   -0.00357734    0.00605826    0.01124570    0.00013926
O   -1.14641989    1.22473919   -0.00357734    0.00362661   -0.00006638    0.00048462
C    0.74604775    0.00042642    0.00032361   -0.00213101   -0.01398016   -0.00020152
C   -0.74755850   -0.00403796   -0.00215489   -0.01055376   -0.01334291   -0.00096261
C    1.60959975   -1.09276618    0.00741833    0.00244425    0.00752866    0.00125276
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C    1.26809789   -2.44533224    0.00426096    0.00997383    0.00382438    0.00018262
C   -1.25246185   -2.44784648    0.00254543   -0.00234394    0.00337915    0.00015734
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H    2.10348708   -3.13070841   -0.00420070   -0.00554063    0.00270020   -0.00031953
H   -2.09644107   -3.13197309   -0.00423220    0.00161751    0.00126513   -0.00034910
C    0.00776670   -3.06907681    0.00312759    0.00058619   -0.00782125    0.00006739
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   15
   -420.54090623
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O    1.16289304    1.23167152   -0.00658180    0.00183973   -0.00095074   -0.00080866
O   -1.16274751    1.23915150   -0.00658180   -0.00778855    0.00978758   -0.00213444
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C   -0.74334541    0.00882238    0.00859477   -0.00046963   -0.00482477    0.00324499
C    1.60191918   -1.10511393    0.00330890   -0.00654336   -0.00064183   -0.00005173
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C    1.25986417   -2.45976213    0.00164693    0.00066654   -0.00477464   -0.00050315
C   -1.26381599   -2.45505489   -0.00045001   -0.00631508    0.00068637    0.00025731
H    2.66550694   -0.85481265    0.00468822    0.00287359    0.00137737    0.00016662
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H    2.10602192   -3.14280958    0.00637813   -0.00045886    0.00073263    0.00025994
H   -2.11009061   -3.13594498   -0.00316781    0.00103280    0.00135060    0.00009347
C    0.00014928   -3.06111997   -0.00066206    0.00250432    0.00327654    0.00009842
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   15
   -420.54039234
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O   -1.15018605    1.23900934   -0.00652798   -0.00184621    0.00788576   -0.00177843
C    0.74354706    0.00416399   -0.00667560    0.00279719   -0.00079934   -0.00040099
C   -0.73862710    0.00568346    0.00106715    0.00683603   -0.00806173    0.00176183
C    1.59887328   -1.09841536   -0.00828724   -0.00715710    0.00065515   -0.00171435
C   -1.60007180   -1.09925494    0.00229251    0.00472791   -0.00314433   -0.00070819
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H    2.65936249   -0.85583778    0.00418181    0.00030767   -0.00115327    0.00074973
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H    2.09746409   -3.14017357    0.00774342   -0.00641219    0.00120290    0.00000095
H   -2.11518685   -3.14655665   -0.00015951   -0.00837768   -0.00752506   -0.00024105
C    0.00508397   -3.07572436   -0.00047217   -0.00000078   -0.01729385   -0.00041930
H   -0.00103765   -4.15448118   -0.00016139   -0.00083154    0.00547424   -0.00008699
   15
   -420.54070774
H   -0.00220418    1.67778713   -0.00506080    0.00119734   -0.00210461   -0.00132272
O   -1.16099286    1.22485140    0.00661665   -0.00277565   -0.00694729    0.00044381
O    1.16025315    1.22683169    0.00661665    0.00220867   -0.00540038    0.00037782
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C    0.73853347    0.01243173    0.00719056   -0.00772450    0.01223956    0.00157878
C   -1.59316486   -1.09738417   -0.00004683    0.00802730    0.00572080   -0.00151572
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C    1.25985847   -2.46355000   -0.00209842    0.00547215   -0.00533643    0.00171367
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H    2.65913200   -0.85930181   -0.00715810    0.00324331    0.00026708    0.00032142
H   -2.10209991   -3.13985702    0.00006057    0.00529686    0.00231084   -0.00025608
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C   -0.00542911   -3.07178392   -0.00966268   -0.00241935   -0.00746254   -0.00239049
H   -0.00518769   -4.14834389   -0.00090619    0.00037284    0.00781899    0.00047552
   15
   -420.54055864
H   -0.00733769    1.68838187   -0.00571095    0.00112462    0.00207718   -0.00132149
O   -1.15917244    1.22217119    0.00664106    0.00189640   -0.00215084    0.00082301
O    1.14844410    1.23180955    0.00664106   -0.00005847   -0.00358684    0.00048496
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C    0.73624973    0.01204377    0.00843919   -0.00638405    0.00774285    0.00080389
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C    1.60153723   -1.09535937   -0.00039608    0.01071339    0.00994075    0.00003799
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C    1.25748486   -2.46039077   -0.00656751    0.00486726   -0.01268821   -0.00222478
H   -2.67089818   -0.85889555   -0.00379384   -0.01121311    0.00242134   -0.00067440
H    2.65191237   -0.85410243   -0.00264953   -0.00638378   -0.00191041    0.00009388
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H    2.10389735   -3.13407531   -0.00081746   -0.00341004    0.00340929    0.00073976
C   -0.00678165   -3.07325612    0.00568636   -0.01165365   -0.00337546    0.00068026
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   15
   -420.54087477
H   -0.00339187    1.68431254   -0.00326711   -0.00096418   -0.00087924   -0.00049168
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O   -1.15469911    1.23222300    0.00219245    0.00165994    0.00177605   -0.00003204
C    0.73951211    0.00835929    0.00994169   -0.00649295   -0.00296435    0.00073178
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C    1.59923289   -1.10032751    0.00731915   -0.00161063   -0.00492977    0.00094159
C   -1.60587167   -1.09735687    0.00191971   -0.00909048    0.00674527    0.00028461
C    1.25674218   -2.45199370    0.00010645   -0.00771639   -0.00244786   -0.00030832
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H    2.10896774   -3.13230266    0.00332269    0.00099924   -0.00017062    0.00030839
H   -2.11050857   -3.14496008   -0.00726804   -0.00337483   -0.00253216    0.00014586
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H    0.00756092   -4.14673426   -0.00182158   -0.00006862   -0.00069098    0.00063144
   15
   -420.54001262
H    0.00415951    1.67417593   -0.00195412   -0.00212737   -0.00125264   -0.00028529
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O   -1.15865358    1.22360369    0.00094774    0.00415851   -0.01149713   -0.00084183
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C   -0.75296310    0.01306145    0.00777893   -0.01178540    0.01248642    0.00331706
C    1.59687175   -1.11089821    0.00627167   -0.01370104   -0.01546267    0.00307477
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C    1.25949477   -2.44476923   -0.00042242    0.00456620    0.02417889    0.00005638
C   -1.25111485   -2.44981542    0.00093009    0.00744425   -0.00123082    0.00038065
H    2.66290419   -0.86334978   -0.00945135    0.00396320    0.00080470   -0.00097035
H   -2.66833900   -0.85028755   -0.00704220   -0.00682157    0.00240880   -0.00035601
H    2.11396530   -3.14097028   -0.00579505    0.00644308   -0.00536881   -0.00032965
H   -2.09738417   -3.13138936    0.00055697    0.00196896    0.00082145    0.00005680
C   -0.00796814   -3.06535769   -0.00216317   -0.01685436   -0.00467720   -0.00110237
H    0.00926784   -4.14696323    0.00594095    0.00170722    0.00374148    0.00049530
   15
   -420.54064690
H   -0.00305853    1.69006703    0.00736745    0.00233133    0.00217829    0.00158499
O   -1.15721934    1.22594533   -0.00555890   -0.00246017   -0.00183625   -0.00136514
O    1.15945996    1.23440185   -0.00555890    0.00165498   -0.00330575   -0.00134014
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C    0.75061143    0.01503935    0.00395986    0.00395769    0.00569718    0.00062165
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C    1.60677905   -1.09262081    0.00537092   -0.00279050    0.00140132    0.00043735
C   -1.25748497   -2.45692069    0.00975656   -0.00725937   -0.01099026    0.00077060
C    1.25926915   -2.44541024   -0.00338623   -0.00256270   -0.00102541   -0.00279068
H   -2.66682334   -0.85882879    0.00502819   -0.00092990   -0.00144654   -0.00006153
H    2.66952211   -0.84634496    0.00882948    0.00213216    0.00086066    0.00019994
H   -2.09787791   -3.13597971    0.00389264    0.00433830    0.00362544   -0.00041277
H    2.09717855   -3.13488143    0.00934998   -0.00341455    0.00043423    0.00098896
C    0.00992049   -3.06430958    0.00578661    0.01220527    0.00341826    0.00111900
H   -0.00212962   -4.16006061   -0.00148975   -0.00209699   -0.00548126   -0.00036358
   15
   -420.54016262
H    0.00954064    1.67450814   -0.00716045   -0.00114541   -0.00276741   -0.00141166
O    1.16063840    1.23858357    0.00515662    0.00580674    0.00335628    0.00127506
O   -1.16171302    1.22104758    0.00515662    0.00070811   -0.01004171    0.00067081
C    0.74788152    0.01298461   -0.00031891   -0.00263529    0.01075740   -0.00083507
C   -0.75039584    0.00768733    0.00214304   -0.01227251    0.00155253    0.00053589
C    1.60907845   -1.10903047   -0.00058017    0.01258520   -0.01437143   -0.00024989
C   -1.59940800   -1.09478703   -0.00290660    0.00735771    0.01675482    0.00083683
C    1.26027395   -2.45499754    0.00562411   -0.00274987   -0.00064743    0.00166523
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H    2.09723344   -3.14255241    0.00562799   -0.00387182    0.00199387   -0.00040551
H   -2.10632355   -3.13775029    0.00472928    0.00308760    0.00329358    0.00082632
C    0.01003214   -3.06170335   -0.00468045    0.01637695    0.01167801   -0.00154658
H   -0.00664133   -4.16167719    0.00929348   -0.00244427   -0.00784727    0.00068048
   15
   -420.54065153
H   -0.00834325    1.68349577    0.00188441    0.00216013   -0.00080276    0.00073692
O   -1.16151502    1.23582339   -0.00450625   -0.00487620    0.00025337   -0.00120168
O    1.15658965    1.22435374   -0.00450625   -0.00143659   -0.01303492   -0.00045082
C   -0.74767752    0.01023363    0.00427809    0.00096479   -0.00045360    0.00175098
C    0.74441212    0.01454478   -0.00090561    0.00146775    0.01409357    0.00016472
C   -1.60947271   -1.09359131   -0.00038738   -0.00355577    0.00284155   -0.00102474
C    1.60843476   -1.09300972   -0.00726256    0.01032198    0.01288375   -0.00086753
C   -1.26542914   -2.44739791    0.00486355   -0.00310514    0.00193769    0.00038733
C    1.26485235   -2.46183654   -0.00334500    0.00411664   -0.02003607   -0.00078036
H   -2.66463347   -0.85018606   -0.00150327    0.00291415   -0.00120969    0.00013209
H    2.65947559   -0.84889159   -0.00714707   -0.00550369   -0.00160802    0.00031967
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H    2.11321252   -3.12923906    0.00129853   -0.00373768    0.00534993    0.00044150
C   -0.00071554   -3.05890865    0.00467596    0.00164953    0.00299263    0.00111247
H   -0.00333850   -4.14848610   -0.00531616    0.00056588   -0.00106866   -0.00068769
   15
   -420.54024425
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O   -1.15024432    1.23736142   -0.00872775    0.00154344    0.00698873   -0.00159422
O    1.15947104    1.23934174   -0.00872775    0.00356351    0.01149809   -0.00049372
C   -0.75271976    0.00462283   -0.00180161   -0.00831562   -0.00623252    0.00140956
C    0.75220691    0.00125991   -0.00867121    0.00853573   -0.01613799   -0.00218224
C   -1.61139727   -1.10594003   -0.00060102   -0.00043756   -0.00827309   -0.00002460
C    1.60378087   -1.10065910    0.00337890    0.00419607   -0.00089558    0.00032434
C   -1.25362236   -2.45021438    0.00242444    0.00659947    0.00602752    0.00141039
C    1.24921856   -2.44486248    0.00396361   -0.01544284    0.01354988    0.00201007
H   -2.67078733   -0.84665622   -0.00761777   -0.00162551    0.00255265   -0.00036464
H    2.65253565   -0.86054391    0.00755902   -0.00797209   -0.00140186    0.00009111
H   -2.10308435   -3.14011167   -0.00528913   -0.00262275   -0.00171078   -0.00035724
H    2.10455398   -3.14590161   -0.00972201    0.00714529   -0.00736950   -0.00099893
C    0.00476478   -3.06353809   -0.00450106    0.00754045    0.00608135   -0.00117780
H   -0.00322489   -4.16074818   -0.00966570   -0.00116209   -0.00671193   -0.00000986
   15
   -420.54077787
H   -0.00523822    1.68557485   -0.00634676    0.00336425    0.00085228    0.00029146
O   -1.14913440    1.23831646   -0.00705407   -0.00252310    0.01088098   -0.00098053
O    1.16051012    1.23018311   -0.00705407    0.00056161    0.00349956   -0.00081256
C   -0.74314817   -0.00326114    0.00608989    0.00363930   -0.01450357    0.00090368
C    0.74310953    0.00781284    0.00586918   -0.00203100    0.00102609    0.00184515
C   -1.61063511   -1.10418609    0.00704906   -0.00863996   -0.00090344    0.00101259
C    1.59884263   -1.10324594   -0.00293270   -0.00208443   -0.00078716   -0.00172897
C   -1.26495098   -2.45623333   -0.00423231   -0.00690694    0.00540980   -0.00297575
C    1.26578380   -2.45415508    0.00839885    0.00835199    0.00644540    0.00116663
H   -2.66134887   -0.85668186    0.00263114    0.00515582   -0.00139338   -0.00016974
H    2.65675864   -0.86281345   -0.00720971   -0.00168597   -0.00153036    0.00015822
H   -2.11497495   -3.13767678    0.00918700   -0.00072771    0.00049875    0.00113021
H    2.10798377   -3.14595181    0.00970633   -0.00047904   -0.00163009   -0.00006268
C    0.00245956   -3.07461948    0.00367080    0.00366027   -0.00663974    0.00049835
H    0.00463460   -4.16341307    0.00022819    0.00033236   -0.00113540   -0.00027720
   15
   -420.54043550
H    0.00141607    1.67276429    0.00410699   -0.00313629   -0.00393068   -0.00044003
O    1.14914890    1.23638835    0.00671029    0.00338940    0.00473516    0.00137169
O   -1.16489852    1.23419713    0.00671029   -0.00314286    0.00545874    0.00083572
C    0.73958993    0.00266576   -0.00667833    0.00026160   -0.01244805   -0.00276384
C   -0.74602434    0.01042208   -0.00351184    0.00642784   -0.00024323   -0.00117610
C    1.59668642   -1.09220295    0.00568950   -0.01066221    0.00485592    0.00222654
C   -1.61065435   -1.09610374    0.00500593   -0.01335356    0.00631457    0.00301372
C    1.24979530   -2.44716247   -0.00275090   -0.00845693    0.00427096   -0.00077513
C   -1.26324484   -2.45050458   -0.00682644   -0.00961527   -0.00338165   -0.00285730
H    2.67084749   -0.84611381    0.00385430    0.00950322    0.00179613   -0.00044923
H   -2.65488184   -0.85264585   -0.00737498    0.01032751   -0.00240932   -0.00092327
H    2.09709632   -3.13878467   -0.00481720    0.00099301   -0.00300961   -0.00022004
H   -2.10108852   -3.13087281    0.00568580    0.00540155    0.00409869    0.00078621
C    0.00544770   -3.06996567    0.00081359    0.01362347   -0.00518942    0.00132236
H   -0.00685119   -4.15816457    0.00099665   -0.00156807   -0.00083450    0.00005051
   15
   -420.54021011
H    0.00603405    1.68748575   -0.00070050    0.00020024   -0.00047716    0.00055968
O    1.15964563    1.23714746   -0.00508245    0.00175002   -0.00034915   -0.00000731
O   -1.15726526    1.23868101   -0.00508245   -0.00476717    0.01141682   -0.00187092
C    0.74524237    0.01427317   -0.00176147   -0.00536163    0.00875549   -0.00057542
C   -0.73793365    0.00545001    0.00943263    0.01140952   -0.00388468    0.00384004
C    1.60660334   -1.10193587   -0.00871714    0.00919570    0.00075779   -0.00261166
C   -1.60898522   -1.11119006   -0.00364681   -0.01391501   -0.01301367   -0.00179921
C    1.26591003   -2.46294421    0.00859522    0.01056148   -0.00825118    0.00273349
C   -1.26686163   -2.45603662    0.00284816   -0.01479056    0.00236648    0.00130487
H    2.65810641   -0.85507154   -0.00360108   -0.00504108   -0.00108295    0.00057949
H   -2.65413886   -0.85148353   -0.00989844    0.00727080   -0.00083843   -0.00002052
H    2.10769257   -3.13990960    0.00825540   -0.00450283    0.00374776   -0.00026490
H   -2.09980161   -3.13476275    0.00081661    0.00810432    0.00644411    0.00017800
C   -0.00021665   -3.07464195   -0.00264008   -0.00122822   -0.01416400   -0.00181690
H    0.00516400   -4.14974374   -0.00584285    0.00109131    0.00861135   -0.00023006
   15
   -420.54051468
H    0.00427887    1.69213569   -0.00318397   -0.00431081    0.00305360   -0.00111490
O    1.15334016    1.23684744    0.00609738    0.00182964    0.00183911    0.00157310
O   -1.15624234    1.22515926    0.00609738    0.00488324   -0.00673973   -0.00038074
C    0.75008645    0.00407591   -0.00384073    0.00782178   -0.00919669   -0.00219522
C   -0.74977227    0.01111932    0.00869450   -0.01307504    0.00521279    0.00227111
C    1.60045020   -1.09713828   -0.00584529   -0.00918731    0.00964895    0.00022658
C   -1.59450452   -1.10202498    0.00626681    0.01301422   -0.00409532    0.00145533
C    1.26071349   -2.46320019   -0.00965296    0.00235433   -0.01173113   -0.00155951
C   -1.26789272   -2.44642104   -0.00852593   -0.01321116    0.00930857   -0.00327196
H    2.67165333   -0.86203433    0.00061965    0.00608809   -0.00003986    0.00043132
H   -2.65824781   -0.85909897    0.00142685   -0.00187369   -0.00042423   -0.00051096
H    2.11298850   -3.13460492   -0.00344287   -0.00102738    0.00249477    0.00026232
H   -2.11087726   -3.13359030    0.00532122    0.00089387   -0.00013933    0.00096596
C    0.00143408   -3.06382192   -0.00014060    0.00483240    0.00473731    0.00166908
H    0.00132224   -4.15747486    0.00555091    0.00094917   -0.00382364    0.00018075
   15
   -420.54055507
H    0.00782939    1.68894869   -0.00227545   -0.00374494    0.00149466   -0.00053794
O    1.15506187    1.23196023    0.00278840    0.00458904    0.00230459    0.00008358
O   -1.16452971    1.23400623    0.00278840   -0.00358576    0.00665473   -0.00009528
C    0.74065810   -0.00008666    0.00522143    0.00269172   -0.01448088   -0.00013854
C   -0.74499539    0.00901694    0.00538769    0.00094288   -0.00409840    0.00136907
C    1.59343262   -1.09432161    0.00890668   -0.00813794    0.01618346    0.00177563
C   -1.59466987   -1.10412796   -0.00480188    0.01019703   -0.00337519   -0.00192054
C    1.25883090   -2.46265483   -0.00194146    0.00339772   -0.01412804   -0.00211603
C   -1.25136417   -2.45256298   -0.00215920    0.00261390    0.00684608   -0.00040434
H    2.66112994   -0.86024192    0.00174164    0.00401672   -0.00097325   -0.00048626
H   -2.66268639   -0.84572359    0.00758742   -0.00667523    0.00322193    0.00090239
H    2.10327443   -3.13031474    0.00542238   -0.00677267    0.00525611    0.00047521
H   -2.09937425   -3.14702055    0.00101982   -0.00265525   -0.00380063    0.00014459
C    0.00701561   -3.07468806    0.00255108    0.00306206   -0.00834004    0.00085325
H    0.00126010   -4.15160082    0.00627366    0.00003352    0.00730730    0.00009489
   15
   -420.54047514
H    0.00802637    1.68727176    0.00526725    0.00004996    0.00094954    0.00173766
O    1.15502575    1.22814224   -0.00852542   -0.00048458   -0.00474505   -0.00086767
O   -1.16411938    1.23067968   -0.00852542   -0.00545496    0.00045682   -0.00160872
C    0.74665035    0.00760619    0.00033475   -0.00078108    0.00802548   -0.00126397
C   -0.74224873    0.00871504    0.00491623    0.00045382   -0.00430275    0.00094193
C    1.60813665   -1.10961307    0.00979875    0.01281448   -0.01028585    0.00189741
C   -1.59645813   -1.09410606    0.00999806   -0.00023148    0.00438330    0.00218728
C    1.24986784   -2.45347326   -0.00107547   -0.01084308    0.00052630   -0.00116966
C   -1.24917575   -2.44609204   -0.00171150    0.01350901    0.00192429   -0.00209133
H    2.65398091   -0.85419892    0.00136307   -0.00772982    0.00009482   -0.00032346
H   -2.65287024   -0.84961068   -0.00733188    0.00194377   -0.00033543   -0.00083474
H    2.09763148   -3.13791337   -0.00651157    0.00036115    0.00056007   -0.00010471
H   -2.10973992   -3.12978973    0.00014576   -0.00535321   -0.00339330    0.00044846
C   -0.00097254   -3.05828193    0.00268286    0.00169304    0.01675755    0.00100868
H   -0.00285781   -4.16234770   -0.00082689    0.00009315   -0.01056500    0.00004342
   15
   -420.54044853
H    0.00068234    1.68211948   -0.00506689   -0.00032774    0.00070547   -0.00107177
O    1.14566738    1.22044102    0.00528928   -0.00848830   -0.01702182    0.00168591
O   -1.16177326    1.22770193    0.00528928   -0.00466641    0.00153629    0.00027459
C    0.75227120    0.00503493   -0.00234893    0.01488762    0.00324914   -0.00248559
C   -0.73710814    0.00756491    0.00630038    0.01074013    0.00552293    0.00094059
C    1.59954017   -1.09400796    0.00456867   -0.00800229    0.01088999    0.00091682
C   -1.60564486   -1.10093171    0.00686245   -0.01443542    0.00362676    0.00018691
C    1.25530266   -2.45160612    0.00940962   -0.00366990   -0.00611621    0.00105498
C   -1.25582529   -2.45687573    0.00323827    0.00190852   -0.01165643   -0.00012508
H    2.66111142   -0.84960992   -0.00509505    0.00097196    0.00045883   -0.00053880
H   -2.65312017   -0.86271735    0.00701419    0.00863051   -0.00286385   -0.00011034
H    2.10226759   -3.13401667    0.00586098   -0.00065132    0.00047184   -0.00034755
H   -2.09647205   -3.13542093   -0.00053307    0.00441244    0.00411492   -0.00001119
C    0.00095424   -3.05717457    0.00444181   -0.00092566    0.00930103   -0.00034815
H    0.00052765   -4.14849012    0.00239258   -0.00038521   -0.00212119   -0.00002258
   15
   -420.54084080
H    0.00433650    1.69204584    0.00851677   -0.00145007    0.00285352    0.00146886
O    1.15475275    1.23498650   -0.00452929    0.00393241    0.00640277   -0.00116036
O   -1.16349036    1.22443399   -0.00452929   -0.00382471    0.00067914   -0.00141236
C    0.74055222    0.00198347    0.00076226   -0.00583673   -0.00498830   -0.00030408
C   -0.73852040    0.00244486    0.00270323    0.00302051   -0.00851902    0.00141189
C    1.59768845   -1.10970754    0.00605924   -0.00251759   -0.00913098    0.00156176
C   -1.59692297   -1.09597950   -0.00144783    0.00260617    0.00700680   -0.00112074
C    1.26187051   -2.45788533   -0.00748606   -0.00164892    0.00294178   -0.00233953
C   -1.25665966   -2.44911776    0.00040346   -0.00244233    0.00079812    0.00012385
H    2.65574338   -0.85987598    0.00602117   -0.00040617   -0.00027671    0.00000425
H   -2.65463565   -0.84523209    0.00644714    0.00025913    0.00003787    0.00061249
H    2.10674648   -3.14745885   -0.00711830    0.00033239   -0.00132387    0.00024373
H   -2.10669352   -3.12984771   -0.00460086   -0.00052587    0.00050758   -0.00042024
C    0.00712984   -3.06136343    0.00320997    0.00757841    0.00841444    0.00100497
H    0.00879703   -4.15723168    0.00846473    0.00090221   -0.00531287    0.00032586
   15
   -420.54067353
H    0.00385900    1.67514377   -0.00889265    0.00153900   -0.00174888   -0.00088526
O    1.15227340    1.22816321   -0.00015730   -0.00159100   -0.00347792    0.00069053
O   -1.15903329    1.23308432   -0.00015730   -0.00417921    0.00907098    0.00058056
C    0.74479056    0.00758997   -0.00171920    0.00643515    0.00177005   -0.00043584
C   -0.74491756   -0.00118392   -0.00061677    0.00165133   -0.01333691   -0.00033475
C    1.59497963   -1.09707248    0.00017677   -0.01734692    0.00245365    0.00095744
C   -1.60499293   -1.09989477    0.00406953   -0.00609468    0.00911220    0.00024074
C    1.25849867   -2.45061916   -0.00446445    0.00585484    0.00349586   -0.00217475
C   -1.26166649   -2.45838717    0.00245095   -0.00017688   -0.00245860   -0.00089152
H    2.67141055   -0.84523331   -0.00263704    0.01092923    0.00272959   -0.00009411
H   -2.65438476   -0.85751998    0.00905016    0.00690389   -0.00202952    0.00020281
H    2.09654159   -3.14513910   -0.00168010   -0.00159660   -0.00148785    0.00036702
H   -2.10464609   -3.14709650    0.00082071    0.00094468   -0.00059951   -0.00018112
C   -0.00354200   -3.06935168    0.00967769   -0.00319364    0.00056631    0.00232320
H   -0.00012867   -4.16268193    0.00463538   -0.00006422   -0.00396514   -0.00036590
   15
   -420.54052630
H    0.00516349    1.68133183   -0.00977952   -0.00403342    0.00051396   -0.00009732
O    1.14826661    1.23591573   -0.00664230    0.00164317    0.00795472   -0.00086089
O   -1.16303776    1.22278593   -0.00664230    0.00172571   -0.00533018   -0.00013429
C    0.74778978   -0.00342925    0.00596167    0.00410093   -0.01378560    0.00247752
C   -0.74770222    0.01046859    0.00182585   -0.00367454    0.01350153   -0.00023614
C    1.60910916   -1.10615365   -0.00213068    0.00279267   -0.00754414   -0.00287110
C   -1.59844212   -1.10933420    0.00603663    0.00242266   -0.01028384    0.00027110
C    1.26510497   -2.44755820    0.00649370    0.01050238    0.01351260    0.00330595
C   -1.25993041   -2.45572005    0.00028323    0.00548396    0.00262214    0.00001218
H    2.66047588   -0.85970420    0.00942340   -0.00516805   -0.00152121    0.00071401
H   -2.65585623   -0.85452953    0.00613588    0.00043685    0.00095283   -0.00009891
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H   -2.11579559   -3.13451837    0.00324959   -0.00230868   -0.00043187    0.00024660
C   -0.00829594   -3.06138080   -0.00899290   -0.01692075   -0.00076970   -0.00235668
H    0.00856266   -4.14604585   -0.00481485    0.00130353    0.00191940    0.00047096
   15
   -420.54015775
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O    1.15453899    1.22067290    0.00980091   -0.00507995   -0.00566802    0.00221816
O   -1.15285709    1.23971009    0.00980091   -0.00490269    0.01023124    0.00193632
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C   -0.73752670    0.00959426   -0.00624243    0.01369785    0.00705324   -0.00247117
C    1.60865977   -1.10374106    0.00884394   -0.00125269   -0.00194302    0.00430585
C   -1.61257783   -1.10885220    0.00945257   -0.01639310   -0.01068191    0.00192463
C    1.25339155   -2.44848053   -0.00549075   -0.01155839    0.00845036   -0.00054292
C   -1.25099823   -2.45883981    0.00806174    0.01022644    0.00276970    0.00162182
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H   -2.11554379   -3.13876806    0.00469995   -0.00659975   -0.00218359   -0.00071647
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H    0.00985550   -4.15248008    0.00874225   -0.00045685    0.00624397    0.00097541
   15
   -420.54056350
H   -0.00327012    1.67993441   -0.00507883    0.00256829   -0.00069006    0.00070343
O    1.14612414    1.22964225   -0.00922466   -0.00737402   -0.01148038   -0.00144346
O   -1.15769942    1.23353557   -0.00922466   -0.00091857    0.00532709   -0.00080008
C    0.75152926    0.01557798    0.00823160    0.01026761    0.01331627    0.00353856
C   -0.75014408    0.00271180    0.00389336   -0.00455683   -0.00598256   -0.00042654
C    1.60678780   -1.09562563   -0.00956022    0.00060652    0.00368269   -0.00334397
C   -1.60316401   -1.10549305    0.00809688    0.00294385   -0.00280862   -0.00011265
C    1.25127445   -2.44928391    0.00564647   -0.00432427   -0.00022368    0.00259603
C   -1.25051798   -2.45715936    0.00729088    0.01474518    0.00153074    0.00235823
H    2.66866569   -0.85482210   -0.00908854    0.00085156    0.00052165    0.00052012
H   -2.66636123   -0.85038703    0.00492985   -0.00350308    0.00240895    0.00001452
H    2.09636757   -3.14146118    0.00050969    0.00083172   -0.00203299   -0.00027819
H   -2.10245750   -3.14836481   -0.00976599   -0.00330352   -0.00360600   -0.00101861
C   -0.00567391   -3.06930157   -0.00459517   -0.00902802   -0.00745485   -0.00288064
H    0.00094664   -4.14554881    0.00354427    0.00017145    0.00762176    0.00057303
   15
   -420.54077722
H   -0.00511194    1.68525408   -0.00416899    0.00124702    0.00035528   -0.00085736
O   -1.15348311    1.23224666    0.00264427   -0.00078913    0.00550472    0.00031323
O    1.14995022    1.22934273    0.00264427   -0.00261611   -0.00243127    0.00017001
C   -0.73766604    0.00235653    0.00144228    0.01501600    0.00099319    0.00084578
C    0.73807819    0.00811730    0.00195362   -0.00835176    0.00474118    0.00102991
C   -1.60997460   -1.11100698   -0.00989918   -0.00585325   -0.01389112   -0.00203216
C    1.60402919   -1.09994463   -0.00946960   -0.00368400   -0.00437242   -0.00150076
C   -1.25398651   -2.45684362    0.00090053    0.00386957   -0.00152765    0.00113255
C    1.26483617   -2.45096206   -0.00278894    0.00129253    0.00162353   -0.00003387
H   -2.67053748   -0.84478160   -0.00560137   -0.00378918    0.00279147    0.00060141
H    2.67154263   -0.85031555   -0.00661579    0.00594864    0.00065971    0.00049187
H   -2.09975386   -3.13719235   -0.00578286    0.00124702    0.00273772   -0.00042969
H    2.11613765   -3.13104529   -0.00409289    0.00086872    0.00037579    0.00001992
C    0.00341933   -3.06139948    0.00472866   -0.00302996    0.00420500    0.00042845
H   -0.00561557   -4.15159056    0.00613312   -0.00138459   -0.00167730   -0.00017921
   15
   -420.54028121
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O    1.14585400    1.22497314   -0.00762739   -0.00871268   -0.01581689   -0.00148771
O   -1.16038779    1.23575712   -0.00762739   -0.00424216    0.00993705   -0.00048994
C    0.74411161    0.01598202    0.00714668    0.00373143    0.02396784    0.00336060
C   -0.74185461    0.00205034    0.00017658    0.00999260   -0.00630745    0.00032206
C    1.59757678   -1.10744544   -0.00528411   -0.00266169   -0.01162332   -0.00318614
C   -1.61048218   -1.10750922   -0.00554321   -0.00794148   -0.00177700   -0.00156128
C    1.25947277   -2.45696996    0.00175763   -0.00631560   -0.00252040    0.00145235
C   -1.26424520   -2.46407113    0.00425598   -0.00534116   -0.00564781    0.00258920
H    2.65815681   -0.85267822    0.00991579    0.00162341    0.00128971    0.00098039
H   -2.66377954   -0.84703455   -0.00670207    0.00174555    0.00073359    0.00023673
H    2.11226944   -3.13710465    0.00306829    0.00130206   -0.00037092   -0.00003662
H   -2.10959343   -3.14812776   -0.00185474   -0.00014922    0.00128957   -0.00050142
C    0.00975753   -3.06104335   -0.00732283    0.01460417    0.01156038   -0.00282119
H    0.00842751   -4.15670916    0.00515172   -0.00030084   -0.00495766    0.00068647
   15
   -420.54034339
H   -0.00705381    1.67400037    0.00551896    0.00026675   -0.00483526   -0.00032802
O   -1.16299836    1.23779552    0.00714636   -0.00560609    0.00305163    0.00085449
O    1.15941598    1.23611750    0.00714636    0.00407975    0.00475166   -0.00044018
C   -0.74138059    0.01481948   -0.00157723    0.01133994    0.01217513   -0.00163011
C    0.74202293    0.00979412    0.00618980   -0.00855488    0.00041238    0.00204877
C   -1.60618410   -1.10787457   -0.00136890   -0.00969478   -0.01093284   -0.00058741
C    1.61038729   -1.10286734   -0.00160374    0.01713587   -0.00026939   -0.00127775
C   -1.25812129   -2.46123977    0.00243283    0.00631270   -0.00186714    0.00167963
C    1.26294937   -2.45461617    0.00067642    0.00724309    0.00306784    0.00000293
H   -2.66132181   -0.84771655    0.00568033    0.00069528    0.00148972    0.00037539
H    2.65377138   -0.85948671    0.00783194   -0.01080028   -0.00290662    0.00029638
H   -2.11460971   -3.13708687   -0.00586232   -0.00155727    0.00031478   -0.00068471
H    2.10450974   -3.14621477    0.00759749   -0.00038688   -0.00065586    0.00029816
C   -0.00609485   -3.07458052   -0.00156914   -0.01156694   -0.01360415   -0.00088369
H    0.00768529   -4.14773603    0.00587214    0.00109672    0.00985639    0.00027709
   15
   -420.54035408
H   -0.00228037    1.68117205    0.00971367   -0.00009138    0.00038795    0.00181044
O   -1.14598597    1.22900018   -0.00590098    0.00220380   -0.00137099   -0.00157723
O    1.15823818    1.22265318   -0.00590098    0.00067613    0.00020270   -0.00188686
C   -0.73898726    0.00471536    0.00396175    0.00849615    0.00772654    0.00100408
C    0.73974096   -0.00108842    0.00736082   -0.00800025   -0.00579321    0.00149473
C   -1.60403521   -1.10996365   -0.00178829    0.00192497   -0.01853360   -0.00098699
C    1.61061739   -1.09595140    0.00783436    0.00996572    0.01026902   -0.00006655
C   -1.25218507   -2.44993677   -0.00678167    0.01287173    0.00969674   -0.00245004
C    1.26593190   -2.45128519    0.00797012    0.01253799   -0.00121576   -0.00008675
H   -2.67160551   -0.85165120    0.00829569   -0.00694781    0.00265229    0.00084498
H    2.65849834   -0.85296580    0.00181497   -0.00750466   -0.00271528   -0.00009706
H   -2.11465047   -3.13080160    0.00093788   -0.00560244   -0.00226982    0.00083498
H    2.09628781   -3.14085412    0.00533920   -0.00592013    0.00324384   -0.00014245
C   -0.00558662   -3.06521876    0.00723955   -0.01421364    0.00040004    0.00195733
H   -0.00781858   -4.15635513   -0.00432354   -0.00038436   -0.00261774   -0.00065071
   15
   -420.53922163
H   -0.00922418    1.67737082   -0.00516866   -0.00177185   -0.00202729   -0.00008613
O   -1.15240009    1.22150219   -0.00319055    0.00551256   -0.00992258   -0.00126203
O    1.14537017    1.23775500   -0.00319055   -0.00014520    0.01116452    0.00131990
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C    0.73463513    0.00069649   -0.00763250   -0.01693757   -0.00575458   -0.00375641
C   -1.61264295   -1.10611319    0.00009605   -0.02230633   -0.01340495   -0.00107694
C    1.60722630   -1.11075264    0.00303819    0.01242234   -0.01666353    0.00114042
C   -1.25539483   -2.44537985    0.00370028    0.00679146    0.01528389   -0.00101389
C    1.26455106   -2.44686777    0.00206289    0.00966553    0.02402830   -0.00074846
H   -2.65260357   -0.85377344   -0.00443949    0.01174656   -0.00196534   -0.00006293
H    2.65302096   -0.86185384    0.00179748   -0.00824830   -0.00251482    0.00005487
H   -2.10048757   -3.14343639    0.00997276   -0.00186245   -0.00347257    0.00058827
H    2.11324385   -3.14200745    0.00029932    0.00356703   -0.00329220   -0.00008480
C   -0.00776424   -3.07537978    0.00917321   -0.01513848   -0.02202465    0.00174481
H   -0.00229899   -4.14753441   -0.00396765    0.00065186    0.01001895   -0.00065916
   15
   -420.54008191
H   -0.00508480    1.68820279    0.00359929    0.00020566    0.00336316    0.00134760
O    1.14468564    1.23082645   -0.00836444   -0.00300482    0.00409218   -0.00301624
O   -1.16076036    1.23223784   -0.00836444   -0.00347017    0.01103689    0.00041466
C    0.75028687   -0.00364348    0.00934150    0.01024572   -0.01500692    0.00595717
C   -0.74743684   -0.00275421   -0.00997572   -0.00365261   -0.01353599   -0.00400402
C    1.61173985   -1.09761034   -0.00937312   -0.00329461    0.00287044   -0.00247656
C   -1.60187403   -1.10440871    0.00184783    0.00841185   -0.00866470    0.00109891
C    1.26808080   -2.44661909   -0.00933435    0.01121693    0.00642230   -0.00159114
C   -1.25525291   -2.44435828    0.00823711    0.01047252    0.02062780    0.00192223
H    2.66979609   -0.84696729    0.00212648   -0.00012424    0.00009328    0.00087965
H   -2.66529074   -0.84930883   -0.00611723   -0.00369167    0.00187189   -0.00023498
H    2.11137933   -3.13032702   -0.00327904   -0.00150227    0.00174948    0.00069933
H   -2.11595654   -3.14479348   -0.00308799   -0.00950097   -0.00824502   -0.00116188
C   -0.00421040   -3.06511952    0.00209566   -0.01355968   -0.00031926   -0.00007446
H    0.00641030   -4.16146441    0.00832326    0.00126799   -0.00626334    0.00024310
   15
   -420.54049554
H   -0.00376411    1.67349371   -0.00947239   -0.00133731   -0.00402322   -0.00168115
O    1.15625345    1.23633465    0.00577266    0.00368111   -0.00041275    0.00036438
O   -1.16407294    1.22179405    0.00577266   -0.00173187   -0.00991314    0.00135187
C    0.74369926    0.01187507    0.00814310   -0.00840333    0.00466786    0.00092650
C   -0.73856879    0.01309028    0.00018340    0.00500644    0.01473738   -0.00043647
C    1.61007295   -1.09830199    0.00854417    0.01800185    0.00397708    0.00179949
C   -1.59516573   -1.10024458   -0.00905300    0.00584564    0.00483640   -0.00187955
C    1.26282869   -2.45572222   -0.00340146   -0.00225687   -0.00330419   -0.00035414
C   -1.25575060   -2.46172209   -0.00676789    0.00118266   -0.00846602   -0.00040244
H    2.65276932   -0.86307037   -0.00694039   -0.01242473   -0.00389986   -0.00075111
H   -2.66666289   -0.85522603    0.00776417   -0.00768334    0.00103204    0.00103089
H    2.11231985   -3.14117731   -0.00961223    0.00126636   -0.00107193   -0.00017887
H   -2.10598481   -3.14421060    0.00154972   -0.00094481   -0.00059853    0.00030436
C    0.00492798   -3.06690814   -0.00598672    0.00097021    0.00037538   -0.00081578
H   -0.00116489   -4.15152535    0.00722004   -0.00116121    0.00215070    0.00072066
   15
   -420.54050051
H   -0.00101278    1.68506391    0.00036502    0.00005628    0.00228263    0.00107090
O    1.15198589    1.22870222   -0.00755830   -0.00153984   -0.00092276   -0.00134401
O   -1.15417971    1.22882394   -0.00755830    0.00112509    0.00191989    0.00018000
C    0.75033944    0.00269075    0.00336719    0.00719390   -0.00318941    0.00145343
C   -0.75066734    0.00049258   -0.00603364   -0.01492078   -0.01125386   -0.00194459
C    1.61190239   -1.09721080    0.00892153    0.00689436    0.00705602    0.00075714
C   -1.59541873   -1.09791966    0.00182899    0.01409031    0.00702352   -0.00011112
C    1.26747086   -2.45418347    0.00279525    0.00672470   -0.00261428    0.00078424
C   -1.26554917   -2.45021621    0.00932300   -0.01751340    0.00690019    0.00302728
H    2.66035704   -0.85160103    0.00264493   -0.00722772   -0.00156933   -0.00048599
H   -2.65761365   -0.85215328   -0.00151411   -0.00128627    0.00002150   -0.00019252
H    2.10426028   -3.13903554   -0.00250896   -0.00486004    0.00257445   -0.00010462
H   -2.10030643   -3.14365901   -0.00012316    0.00299997   -0.00011787   -0.00079070
C    0.00770636   -3.07021169   -0.00734840    0.00977112   -0.00644181   -0.00280311
H   -0.00621558   -4.15971193   -0.00387226   -0.00149934   -0.00157917    0.00050368
   15
   -420.54043609
H    0.00151102    1.68792850   -0.00992729   -0.00183307    0.00297466    0.00008715
O   -1.14799432    1.22840702   -0.00917563    0.00588637   -0.00130065   -0.00029526
O    1.15891849    1.23031937   -0.00917563    0.00516830    0.00903748   -0.00112073
C   -0.75320111    0.00211326   -0.00097026   -0.01173872   -0.00188229    0.00078331
C    0.74035836   -0.00259505    0.00405240   -0.00657747   -0.00894089    0.00237497
C   -1.60034240   -1.10956560   -0.00884012    0.01466163   -0.01250478   -0.00292302
C    1.61008601   -1.10544566   -0.00343750    0.00541928   -0.00759904   -0.00208819
C   -1.26303628   -2.44925779    0.00650765   -0.00301637    0.01319117    0.00141238
C    1.25238574   -2.45046814    0.00771230   -0.01294294    0.00370888    0.00200916
H   -2.66773745   -0.85343737    0.00328259   -0.00578748    0.00225629    0.00113921
H    2.66858396   -0.85024264   -0.00255493    0.00111855    0.00111155    0.00045734
H   -2.11510110   -3.13859966    0.00327930   -0.00401178   -0.00253138   -0.00034294
H    2.10824951   -3.13374624   -0.00469837    0.00376701   -0.00102047   -0.00071881
C    0.00316377   -3.05782994    0.00665829    0.01065614    0.00908711   -0.00055906
H   -0.00330869   -4.15379313    0.00552092   -0.00077197   -0.00551743   -0.00021579
   15
   -420.54013386
H    0.00365917    1.68522447   -0.00602596    0.00199936    0.00151009   -0.00137470
O   -1.14562862    1.23897936    0.00604113    0.00099239    0.00872671    0.00064729
O    1.15629478    1.22999544    0.00604113   -0.00225978    0.00405075    0.00108085
C   -0.74762881    0.00057475    0.00313995   -0.00702591   -0.01155734    0.00160226
C    0.75017728    0.00259397    0.00049064    0.00742030   -0.00915634   -0.00136347
C   -1.59669379   -1.10547969   -0.00973701    0.00954222   -0.00519104   -0.00262028
C    1.60885034   -1.09626214    0.00583356    0.00712466    0.00887189    0.00111812
C   -1.24897782   -2.45504519    0.00460439    0.00991005    0.00522308    0.00063182
C    1.26761152   -2.44729840   -0.00179394    0.01669252    0.00567436   -0.00206239
H   -2.66585114   -0.85758116   -0.00064555   -0.00621045    0.00205629    0.00076442
H    2.65336178   -0.85653282    0.00836552   -0.01092427   -0.00300352    0.00000538
H   -2.09620575   -3.14411683    0.00736855   -0.00016419   -0.00207317   -0.00001848
H    2.10861187   -3.12933732    0.00233004   -0.00335632    0.00260693    0.00035605
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H    0.00262034   -4.15703134    0.00381441    0.00078835    0.00376704   -0.00050540
   15
   -420.54058910
H   -0.00839692    1.68558258   -0.00605811    0.00231285    0.00252138   -0.00072399
O   -1.15956214    1.22575056    0.00020406   -0.00448088    0.00074558    0.00133182
O    1.15256131    1.22150035    0.00020406   -0.00424786   -0.00862187    0.00065527
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C    0.75000427    0.00399957   -0.00504330    0.01207099    0.00105137    0.00002322
C   -1.60191383   -1.09958140    0.00246208   -0.00148612    0.00503213    0.00151972
C    1.59880527   -1.09852432   -0.00771744   -0.00475658    0.01505313   -0.00044273
C   -1.25085511   -2.45385214    0.00640408    0.01295117   -0.00419061   -0.00029417
C    1.26453063   -2.46420285   -0.00072466    0.00965939   -0.01506041   -0.00000027
H   -2.66005997   -0.85704557   -0.00800841    0.00096336   -0.00043869   -0.00063530
H    2.65333691   -0.84640940   -0.00926430   -0.00275517    0.00020957    0.00007884
H   -2.10101389   -3.13967194    0.00827048   -0.00141347   -0.00129506    0.00000085
H    2.10410158   -3.14154822   -0.00445116   -0.00502598    0.00414355   -0.00003919
C   -0.00666624   -3.06194380    0.00963642   -0.01538034    0.00864282    0.00150845
H   -0.00324455   -4.15314610   -0.00099471    0.00094022   -0.00205815   -0.00077839
   15
   -420.54065950
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O    1.15504186    1.22346916   -0.00122177   -0.00080633   -0.00050713    0.00099879
O   -1.14794018    1.23010451   -0.00122177    0.00137531    0.00449602   -0.00128641
C    0.74091827    0.00101516   -0.00897409   -0.00558155    0.00240859   -0.00409885
C   -0.74350144   -0.00141494    0.00395078    0.00536917   -0.00318227    0.00268239
C    1.61066547   -1.10213113    0.00822197    0.00868142    0.00303668    0.00220341
C   -1.60827896   -1.11014906   -0.00070913   -0.00592474   -0.00909166   -0.00041275
C    1.26683629   -2.45469798    0.00737792    0.01326803   -0.00015805    0.00133468
C   -1.25360960   -2.45480940   -0.00363007    0.01227206    0.00653015   -0.00072283
H    2.66090700   -0.85682527   -0.00220617   -0.00576899   -0.00198151   -0.00072693
H   -2.66395066   -0.86140851    0.00108818    0.00173970   -0.00004157   -0.00006261
H    2.10256756   -3.14119498    0.00283074   -0.00409760    0.00292350   -0.00051062
H   -2.10461702   -3.14676035    0.00301970   -0.00335066   -0.00306976    0.00062805
C   -0.00829155   -3.06760670   -0.00340727   -0.01860334   -0.00558922   -0.00077327
H   -0.00045526   -4.14913099   -0.00555746    0.00074961    0.00398092    0.00001998
   15
   -420.54021794
H    0.00846513    1.68023753   -0.00938452   -0.00072614    0.00111417   -0.00068651
O    1.15644938    1.22189155   -0.00256085   -0.00149218   -0.00730825    0.00088981
O   -1.15044671    1.22684425   -0.00256085    0.00373608   -0.00201046    0.00100138
C    0.74875598    0.00407428   -0.00895947    0.00297519    0.00831882   -0.00160787
C   -0.75155351    0.00334453   -0.00938348   -0.01133435    0.00126701   -0.00126372
C    1.61215675   -1.10369681    0.00673865    0.01981601    0.00771991    0.00286650
C   -1.59698682   -1.11048285    0.00212119    0.01392208   -0.01075225    0.00126093
C    1.24922935   -2.46231925   -0.00984310   -0.01070954   -0.01074153   -0.00245125
C   -1.26083388   -2.45500367   -0.00265321   -0.00165166   -0.00056323   -0.00010487
H    2.65348996   -0.86313357    0.00861875   -0.01290279   -0.00228805   -0.00054528
H   -2.66586360   -0.85513596    0.00477911   -0.00656132    0.00243445   -0.00032718
H    2.10189991   -3.14390287    0.00262573    0.00228371    0.00018394    0.00067500
H   -2.10356355   -3.13003585    0.00319081    0.00466058    0.00429698   -0.00005537
C   -0.00755489   -3.06005348   -0.00891847   -0.00292268    0.01809941   -0.00029502
H   -0.00241898   -4.16323972    0.00009095    0.00091858   -0.00970458    0.00064528
   15
   -420.54079098
H    0.00267228    1.68554079    0.00089900    0.00034375   -0.00046363   -0.00005525
O   -1.15349801    1.23750459    0.00084728   -0.00028032   -0.00227274    0.00062578
O    1.15403370    1.22351582    0.00084728   -0.00347264   -0.01216532    0.00023026
C   -0.74439747    0.01509606   -0.00636090    0.00673922    0.00622144   -0.00163140
C    0.74106269    0.01147267   -0.00554723    0.00070702    0.00930975   -0.00018752
C   -1.61110090   -1.09321923    0.00420232   -0.00827933    0.00442581    0.00041813
C    1.59947760   -1.09366981   -0.00467430   -0.00183243    0.00683695   -0.00014737
C   -1.26386573   -2.45173613    0.00733321   -0.00593992   -0.00012818    0.00338589
C    1.26340760   -2.45210156   -0.00734904    0.00717636   -0.00271368    0.00025868
H   -2.66870286   -0.85729678    0.00670368    0.00203971   -0.00174203   -0.00015507
H    2.66181308   -0.85492288    0.00505568    0.00123441   -0.00119307    0.00029573
H   -2.11588400   -3.13175536   -0.00922377   -0.00108572    0.00012609   -0.00141016
H    2.10677621   -3.13300145   -0.00804591   -0.00315971    0.00155155   -0.00004772
C    0.00398759   -3.07263239   -0.00931250    0.00491162   -0.01119335   -0.00251099
H    0.00996586   -4.15458493    0.00583468    0.00089957    0.00351544    0.00093213
   15
   -420.54060042
H   -0.00957238    1.68475119   -0.00096326    0.00280995    0.00076615    0.00042739
O   -1.15860458    1.23221400   -0.00408932   -0.00317947    0.00433622    0.00039965
O    1.15600298    1.23792712   -0.00408932    0.00236495    0.00987746   -0.00008567
C   -0.74894160   -0.00070499   -0.00696849   -0.00799992   -0.01233024   -0.00184049
C    0.74762018    0.00668902   -0.00405868   -0.00119556   -0.00442245   -0.00051957
C   -1.60063275   -1.09817130    0.00702250    0.00426744    0.01119334    0.00258567
C    1.61196284   -1.10626983    0.00540506    0.01103547   -0.00916387    0.00172668
C   -1.25733009   -2.46270237   -0.00155795   -0.00088317   -0.01205322   -0.00119483
C    1.25203044   -2.44713972   -0.00160485   -0.00521322    0.00841196   -0.00062372
H   -2.66168535   -0.84762408   -0.00059338   -0.00159384    0.00115207   -0.00074036
H    2.66113938   -0.85275096    0.00134370   -0.00562834    0.00033736   -0.00046442
H   -2.10081244   -3.13478780    0.00452359    0.00563060    0.00463337    0.00017635
H    2.10246574   -3.13299363    0.00004088    0.00170766   -0.00056526    0.00000961
C   -0.00378447   -3.07218973   -0.00228496   -0.00144286   -0.00921565   -0.00044535
H   -0.00051951   -4.14915732    0.00880628   -0.00067241    0.00710044    0.00059112
   15
   -420.54084393
H   -0.00164579    1.67858329    0.00590219   -0.00133471   -0.00236845    0.00025628
O   -1.15553585    1.23997444    0.00263683   -0.00240966    0.00376597   -0.00125248
O    1.15526753    1.23358010    0.00263683   -0.00091108    0.00342218   -0.00021527
C   -0.74204734    0.01587939    0.00875035    0.00289976    0.00527528    0.00321151
C    0.75039314    0.00302210    0.00333324    0.00575825   -0.00984953   -0.00002310
C   -1.60005208   -1.09787805   -0.00957984    0.00547231   -0.00760636   -0.00317949
C    1.60175130   -1.10211823   -0.00436421   -0.00975711   -0.00061177   -0.00156246
C   -1.25923863   -2.44473039   -0.00325615   -0.00126719    0.00946539   -0.00082024
C    1.26052549   -2.45442413    0.00422837    0.00360943   -0.00120978    0.00151978
H   -2.66914421   -0.85859404    0.00477997   -0.00543013    0.00000342    0.00109630
H    2.67172701   -0.85421640   -0.00347504    0.00683280    0.00141770    0.00040930
H   -2.11293880   -3.13086427    0.00574061   -0.00325317   -0.00238073    0.00074547
H    2.11015886   -3.12833821   -0.00423679   -0.00166047    0.00280441   -0.00045112
C    0.00070095   -3.06537244    0.00316688   -0.00008406   -0.00085459    0.00109957
H    0.00857481   -4.15449758   -0.00979491    0.00153676   -0.00122316   -0.00083664
   15
   -420.54070387
H   -0.00813669    1.68060554   -0.00828592    0.00202672    0.00121614   -0.00122112
O   -1.15811921    1.22433240    0.00227919   -0.00161334   -0.00192483    0.00166881
O    1.15578853    1.22698725    0.00227919    0.00078716    0.00300178    0.00068797
C   -0.74842056   -0.00155057   -0.00851175   -0.01085798   -0.01063510   -0.00194003
C    0.74596215    0.00187467   -0.00131523    0.00330879   -0.00209387    0.00002640
C   -1.59347945   -1.09726918   -0.00638752    0.01874244    0.01125890    0.00100231
C    1.60067502   -1.10886923    0.00458466   -0.00484334   -0.00844791    0.00186976
C   -1.25393050   -2.45519883   -0.00787484   -0.00146662   -0.00204061   -0.00251475
C    1.26385826   -2.45399630    0.00102074    0.00148356    0.00231564   -0.00123447
H   -2.67013917   -0.85754671   -0.00640430   -0.00977007    0.00124037   -0.00006631
H    2.65969851   -0.85335999   -0.00684309    0.00085975    0.00090425   -0.00082681
H   -2.10453620   -3.13878571    0.00744108   -0.00159313   -0.00092740    0.00089072
H    2.11115048   -3.13018387    0.00720904   -0.00223237    0.00275229    0.00025922
C    0.00757064   -3.06314764    0.00557304    0.00703580    0.00274721    0.00164560
H   -0.00754488   -4.14983743    0.00654973   -0.00186865    0.00073121   -0.00024737
   15
   -420.54044665
H    0.00875700    1.69030021   -0.00425716   -0.00428490    0.00040551   -0.00120448
O    1.14679436    1.23844773    0.00608849    0.00117641    0.00021647    0.00163622
O   -1.16421501    1.22588674    0.00608849    0.00011803   -0.00166649    0.00195142
C    0.73485059    0.00898461   -0.00718884   -0.01237162    0.00517401   -0.00242318
C   -0.73607826    0.01277375   -0.00968698    0.01723449    0.01073200   -0.00235387
C    1.59612003   -1.10746233    0.00923527    0.00440162   -0.00863906    0.00226929
C   -1.60802786   -1.10712240   -0.00208117   -0.01124364   -0.01312951    0.00048664
C    1.25396161   -2.46148263    0.00344116   -0.00555149    0.00380033    0.00161092
C   -1.26279561   -2.44745887    0.00448912   -0.00798562    0.00701664    0.00307444
H    2.65504159   -0.86152625    0.00577646   -0.00010931   -0.00034526   -0.00077159
H   -2.65802712   -0.84786977   -0.00276110    0.00397516   -0.00013088   -0.00032011
H    2.11032706   -3.14765241   -0.00533446    0.00413243   -0.00332939   -0.00072615
H   -2.10113625   -3.13074973   -0.00753072    0.00440943    0.00328461   -0.00097796
C    0.00109340   -3.07268983   -0.00915314    0.00641802   -0.01064456   -0.00321148
H   -0.00976165   -4.14925052    0.00509288   -0.00030814    0.00732919    0.00095916
   15
   -420.54009681
H    0.00285791    1.68537052    0.00389560   -0.00005465    0.00120275    0.00117417
O   -1.14967324    1.23638733   -0.00645940   -0.00050699    0.00705417   -0.00008472
O    1.15598845    1.22524662   -0.00645940    0.00204951    0.00317092   -0.00117929
C   -0.74188529    0.00174231   -0.00765283    0.00228267   -0.01189473   -0.00233184
C    0.73562097   -0.00227421   -0.00276286   -0.00993511   -0.00986925    0.00184498
C   -1.59669081   -1.09554611    0.00949593    0.01249760    0.01477221    0.00185068
C    1.60648095   -1.09426614   -0.00814725    0.00904651    0.01786374   -0.00112981
C   -1.26639328   -2.46348527    0.00609185   -0.01221998   -0.01454304    0.00167946
C    1.25082202   -2.46082788   -0.00741044   -0.01524932   -0.01165191   -0.00066471
H   -2.66894346   -0.86013712    0.00458099   -0.00689215   -0.00053645   -0.00053325
H    2.66325860   -0.85745714    0.00323122   -0.00202816   -0.00160868    0.00052284
H   -2.10412285   -3.13747048   -0.00617099    0.00738782    0.00532653   -0.00095440
H    2.11540500   -3.13798013    0.00040748    0.00573814   -0.00219383    0.00049210
C   -0.00045592   -3.07049814   -0.00508348    0.00728508   -0.00533221   -0.00125793
H    0.00637138   -4.14647977    0.00527887    0.00062308    0.00830662    0.00057202
   15
   -420.54050428
H    0.00850723    1.68084887   -0.00744298   -0.00200061    0.00044429   -0.00050139
O    1.15796862    1.23113709   -0.00206590    0.00402067    0.00513669    0.00090013
O   -1.15352974    1.23091408   -0.00206590   -0.00135655    0.00629194    0.00133350
C    0.74679468   -0.00203027   -0.00663496    0.00224504   -0.01412881   -0.00037418
C   -0.74540894    0.00051377   -0.00853543   -0.00161901   -0.01003567   -0.00287322
C    1.60668776   -1.09283168   -0.00449539   -0.00068328    0.01378005   -0.00035383
C   -1.60891772   -1.09783415    0.00954912   -0.01090108    0.00564507    0.00250374
C    1.25221822   -2.45221770    0.00648369   -0.01357849   -0.00126392    0.00110790
C   -1.25893837   -2.44829280    0.00844548    0.00542334    0.00315864    0.00073947
H    2.66824617   -0.85779438   -0.00930790    0.00044711   -0.00090706   -0.00032983
H   -2.65209378   -0.85310420   -0.00659752    0.01082338   -0.00232720   -0.00102335
H    2.11153301   -3.14331813    0.00973199    0.00697207   -0.00522920    0.00012155
H   -2.11326295   -3.13304006    0.00473450   -0.00335515   -0.00163833   -0.00025267
C   -0.00004958   -3.06135677    0.00286948    0.00211900    0.00890965   -0.00048503
H    0.00891017   -4.16066758   -0.00599668    0.00141509   -0.00776133   -0.00051494
   15
   -420.54050516
H    0.00556726    1.69223301   -0.00713460   -0.00223897    0.00214457   -0.00033931
O    1.16071581    1.23620713   -0.00259516    0.00830619    0.01267320    0.00051633
O   -1.16063524    1.23069197   -0.00259516   -0.00439422    0.00190326   -0.00083356
C    0.73682753   -0.00318468    0.00137302   -0.00894867   -0.01977273   -0.00167129
C   -0.73780510    0.00695552    0.00783192    0.00660244   -0.00684906    0.00267018
C    1.59586501   -1.10098798    0.00951673   -0.00673247    0.00803686    0.00145367
C   -1.59483861   -1.09363734   -0.00326241    0.00222315    0.00826283   -0.00105382
C    1.25900392   -2.45959012    0.00743342    0.00297749   -0.00172653    0.00129954
C   -1.24875509   -2.44794921   -0.00908694    0.01185406    0.00045967   -0.00237494
H    2.66289108   -0.86393001   -0.00588251    0.00415851   -0.00101011   -0.00072616
H   -2.65726857   -0.86160564    0.00211148   -0.00055225   -0.00151003    0.00044893
H    2.10519451   -3.14552486   -0.00752397    0.00002643   -0.00066854   -0.00085523
H   -2.10099981   -3.13646948    0.00009197   -0.00248270   -0.00329280    0.00103965
C   -0.00536304   -3.06775905    0.00062628   -0.01145285   -0.00152281    0.00068273
H   -0.00471058   -4.15092547   -0.00808786    0.00067966    0.00296047   -0.00025936
   15
   -420.54058044
H    0.00874240    1.68661303    0.00326624   -0.00091446    0.00156966   -0.00010045
O    1.16161567    1.23594563    0.00339523    0.00673479    0.01274646   -0.00078350
O   -1.15134990    1.23354271    0.00339523   -0.00046960    0.00749917    0.00092687
C    0.74045979   -0.00076474    0.00680500   -0.00293829   -0.01350162    0.00172965
C   -0.74620864   -0.00186133   -0.00337658   -0.00617090   -0.02130326   -0.00175839
C    1.59547668   -1.10195183    0.00316861   -0.00663491    0.00522085    0.00145264
C   -1.60106103   -1.09364976   -0.00484322    0.00851365    0.00977412   -0.00054729
C    1.25746291   -2.46221873   -0.00919723    0.00030352   -0.00792095   -0.00232422
C   -1.26455452   -2.44469424    0.00264055   -0.00720230    0.00559979    0.00017843
H    2.65955478   -0.85164690   -0.00671343    0.00356457    0.00093464   -0.00055692
H   -2.66227210   -0.86058384   -0.00307745    0.00031681   -0.00213844    0.00019775
H    2.11062961   -3.13562024   -0.00664073   -0.00009840    0.00179041    0.00066173
H   -2.10311223   -3.13675744    0.00836543    0.00189142   -0.00058084    0.00005834
C   -0.00310982   -3.06420768    0.00167752    0.00156167   -0.00061990    0.00123686
H    0.00051152   -4.15043821   -0.00398797    0.00153231    0.00100283   -0.00037188
   15
   -420.54014874
H   -0.00130617    1.67288338    0.00669018    0.00276311   -0.00248700    0.00194902
O   -1.15794155    1.23056403   -0.00996443   -0.00353290   -0.00202791   -0.00212377
O    1.16046217    1.22100577   -0.00996443   -0.00240613   -0.01610193   -0.00195980
C   -0.75084803    0.00538261    0.00616243   -0.00501445   -0.00216432    0.00198889
C    0.75106935    0.01524730    0.00541096    0.01317078    0.01645869    0.00192898
C   -1.61255075   -1.09399308   -0.00198636   -0.00955263    0.01720754   -0.00094632
C    1.59506090   -1.09458441   -0.00731447   -0.00811748    0.01460514   -0.00252091
C   -1.26607615   -2.46266168    0.00400570   -0.00856348   -0.01454641   -0.00028583
C    1.26420307   -2.46073059   -0.00001486    0.00216416   -0.00894471    0.00042127
H   -2.66216734   -0.85654490   -0.00982593    0.00743736   -0.00244043    0.00017509
H    2.65893824   -0.86419503    0.00153184    0.00061404   -0.00163564    0.00111620
H   -2.10257265   -3.14730858    0.00288717    0.00436523    0.00281390    0.00005640
H    2.11433971   -3.14670768   -0.00935325    0.00167727   -0.00231722   -0.00037367
C    0.00302984   -3.06668086    0.00916539    0.00514524   -0.00133414    0.00079688
H    0.00048243   -4.15035598    0.00844355   -0.00017640    0.00301072   -0.00021877
   15
   -420.54024938
H   -0.00646683    1.67645830   -0.00822562   -0.00274878   -0.00328795   -0.00147120
O   -1.15882386    1.23385273    0.00454663    0.00144401   -0.00350713    0.00185693
O    1.15766128    1.23934166    0.00454663    0.00860716    0.01328476    0.00195608
C   -0.75002984    0.01532121   -0.00979104   -0.00273238    0.01012059   -0.00275563
C    0.73615456    0.00154135   -0.00915671   -0.01319953   -0.01411993   -0.00201376
C   -1.59821940   -1.10065979    0.00815971    0.01288310   -0.00055562    0.00369748
C    1.61208450   -1.09794568    0.00046263    0.01125026   -0.00072267    0.00133754
C   -1.26775141   -2.45611405   -0.00732955   -0.00986829   -0.00154868   -0.00412433
C    1.24978609   -2.44823799   -0.00128654   -0.01314830    0.00202814   -0.00041221
H   -2.67018385   -0.86221719    0.00306105   -0.00666163    0.00007544   -0.00085068
H    2.67043826   -0.85161225    0.00048975    0.00029590   -0.00019731   -0.00022015
H   -2.10251297   -3.14816954    0.00862821    0.00339453    0.00014401    0.00096778
H    2.10951038   -3.13102571   -0.00638445    0.00520245   -0.00193097   -0.00041466
C   -0.00183367   -3.06253699    0.00679873    0.00577569    0.00732161    0.00309092
H   -0.00089039   -4.16078340   -0.00373185   -0.00050703   -0.00701239   -0.00064607
   15
   -420.54019279
H    0.00706147    1.68625658    0.00251766   -0.00188103    0.00118845    0.00065449
O   -1.14638095    1.23501730   -0.00366867    0.00260392    0.00424156   -0.00057372
O    1.16152864    1.23667964   -0.00366867    0.00561990    0.01563520   -0.00127907
C   -0.74528758    0.00423036   -0.00005125   -0.00272831   -0.00707263    0.00033893
C    0.74141234   -0.00316854    0.00466761   -0.00581974   -0.01397897    0.00246110
C   -1.60800525   -1.09797951   -0.00817930   -0.00413400    0.00282740   -0.00142361
C    1.59871138   -1.11070897   -0.00783761   -0.00889682   -0.01139963   -0.00273759
C   -1.26843907   -2.44925126   -0.00324747   -0.01506990    0.00710517    0.00000604
C    1.25606351   -2.45663448    0.00758319   -0.00111186    0.00544399    0.00248650
H   -2.65702357   -0.84746032   -0.00432734    0.00621960   -0.00118188    0.00051645
H    2.66912554   -0.85016643   -0.00640402    0.00870932    0.00313145    0.00047221
H   -2.10150169   -3.14360067   -0.00319457    0.00361826    0.00044953    0.00024162
H    2.10437474   -3.13650250   -0.00067411   -0.00113483    0.00121155   -0.00055000
C    0.00490877   -3.07437757    0.00111335    0.01290747   -0.01854208   -0.00012511
H    0.00869335   -4.14579112   -0.00794418    0.00108612    0.01102050   -0.00048938
   15
   -420.54071258
H    0.00305890    1.68024921    0.00998669   -0.00013074    0.00073526    0.00188631
O    1.15661758    1.23000976   -0.00616072    0.00322587    0.00666578   -0.00191236
O   -1.15508965    1.22030647   -0.00616072    0.00108351   -0.00812246   -0.00219432
C    0.74343213   -0.00025819    0.00850383   -0.00343627   -0.00496816    0.00158248
C   -0.74535395    0.00196869    0.00990486   -0.00493398   -0.00064056    0.00216181
C    1.60522664   -1.10779559    0.00177127   -0.00373558   -0.00686179   -0.00159865
C   -1.60221764   -1.09374187   -0.00070201    0.00594336    0.01609914   -0.00074854
C    1.26031786   -2.45435235    0.00959396    0.00405091    0.00374050    0.00182838
C   -1.25828611   -2.46112904   -0.00738454    0.00701291   -0.01056714   -0.00108525
H    2.66992912   -0.85117953   -0.00065118    0.00480888    0.00187685    0.00020446
H   -2.66901700   -0.84754492   -0.00092907   -0.00495990    0.00095301    0.00037954
H    2.10864115   -3.13434695    0.00366437   -0.00033391    0.00163467   -0.00045848
H   -2.11312767   -3.14095339   -0.00999523   -0.00196727   -0.00107684    0.00040776
C   -0.00479461   -3.06903634   -0.00113680   -0.00649418   -0.00469518   -0.00038317
H   -0.00151473   -4.14892366   -0.00545381   -0.00012839    0.00531602   -0.00007195
   15
   -420.54034386
H    0.00139920    1.68976343    0.00869632   -0.00266950    0.00196549    0.00082361
O    1.15915761    1.23598033    0.00069112    0.00585207    0.00480125    0.00050972
O   -1.16329440    1.22280633    0.00069112   -0.00309025    0.00074432   -0.00131310
C    0.74272148    0.00408967   -0.00613967   -0.00478492   -0.00622059   -0.00292043
C   -0.73638614    0.00406169    0.00423609    0.00573560    0.00112842    0.00255154
C    1.59461252   -1.10593598    0.00335460   -0.01228250   -0.00803899    0.00002270
C   -1.59290252   -1.11062786   -0.00316704    0.00696927   -0.00410380   -0.00057552
C    1.25163724   -2.45610135    0.00701768   -0.01719709    0.00265722    0.00206318
C   -1.26530361   -2.46102471   -0.00485261   -0.01086622   -0.00180096   -0.00127212
H    2.66930536   -0.85350956    0.00903993    0.01020807    0.00269915    0.00035774
H   -2.65684630   -0.86218632   -0.00140293   -0.00319504   -0.00029108    0.00016459
H    2.11253374   -3.14519376   -0.00965213    0.00699120   -0.00529442   -0.00131722
H   -2.11203399   -3.13932980   -0.00199107    0.00106847    0.00222704    0.00045779
C    0.00942948   -3.06000237    0.00313732    0.01826121    0.00844984    0.00063056
H    0.00298640   -4.14657316   -0.00173908   -0.00099531    0.00112781   -0.00018159
   15
   -420.54073481
H    0.00659064    1.67364105   -0.00688091   -0.00079062   -0.00323366   -0.00032432
O    1.14634875    1.23471264   -0.00277493   -0.00211285    0.00118931    0.00022284
O   -1.15419151    1.22391361   -0.00277493    0.00183378   -0.00480148    0.00076420
C    0.73962126    0.00717584   -0.00122292   -0.01173246    0.00513859   -0.00019697
C   -0.73599192    0.00672633   -0.00376763    0.01096525    0.00470283   -0.00127404
C    1.61024492   -1.10114081    0.00325493    0.00812706    0.00093426    0.00123024
C   -1.60589511   -1.09306375    0.00278961   -0.00570451    0.01206291    0.00045811
C    1.26732514   -2.45781135   -0.00172327    0.00729352   -0.00389990   -0.00124090
C   -1.25925152   -2.45687498    0.00962990    0.00774060   -0.00874910    0.00176431
H    2.66545000   -0.86303041   -0.00318423   -0.00333216   -0.00237989   -0.00039456
H   -2.66503521   -0.85428075   -0.00613297    0.00035581   -0.00161267   -0.00043190
H    2.11028501   -3.14406249    0.00159722   -0.00074448    0.00079884    0.00040670
H   -2.11181325   -3.14451389    0.00173608   -0.00330747   -0.00264481   -0.00068722
C   -0.00355965   -3.06187134    0.00309561   -0.00829178    0.00037118   -0.00032328
H   -0.00555421   -4.14660914    0.00286621   -0.00030522    0.00219820    0.00002690
   15
   -420.54044670
H   -0.00997318    1.69025360   -0.00968679    0.00142248    0.00373104   -0.00048203
O   -1.15290306    1.22896176   -0.00432539   -0.00159221    0.00517724    0.00075394
O    1.15025325    1.22567533   -0.00432539   -0.00679917   -0.00600133   -0.00118392
C   -0.73893233   -0.00060122   -0.00333447    0.00173758   -0.00468895   -0.00136494
C    0.75380415    0.00337469    0.00915605    0.01467138   -0.00468171    0.00390411
C   -1.60054729   -1.10732122   -0.00538767    0.00649223   -0.01200181   -0.00052548
C    1.59602888   -1.09955938   -0.00378360   -0.01306458    0.00868192   -0.00360069
C   -1.26260268   -2.45002525    0.00087729   -0.00170305    0.00450082    0.00079549
C    1.25669613   -2.45641685    0.00867056   -0.00286317   -0.00059830    0.00332305
H   -2.66522491   -0.85253378   -0.00730595   -0.00454803    0.00109916    0.00011601
H    2.66033454   -0.85411849    0.00950974    0.00261316    0.00089750    0.00094660
H   -2.10693568   -3.13017325    0.00283885    0.00226299    0.00247186    0.00006061
H    2.11090863   -3.14751804   -0.00236945    0.00531757   -0.00421763   -0.00088564
C   -0.00616049   -3.05678024   -0.00334307   -0.00540341    0.01544428   -0.00240100
H    0.00215748   -4.15986906    0.00633157    0.00143293   -0.00972940    0.00054430
   15
   -420.54049756
H   -0.00978752    1.69156634    0.00145133    0.00364843    0.00135618    0.00058274
O   -1.14693084    1.23744423   -0.00310231    0.00063061    0.00516162   -0.00063952
O    1.15716076    1.22801969   -0.00310231   -0.00220254   -0.00393005   -0.00091249
C   -0.73802673    0.00286076    0.00376294    0.01130231   -0.00140140   -0.00034759
C    0.73584015    0.01439998    0.00540707   -0.01557875    0.01504125    0.00230065
C   -1.60409286   -1.11154424    0.00928372   -0.00253837   -0.01153944    0.00223353
C    1.60920070   -1.10417453   -0.00944839    0.01511956   -0.00702274   -0.00373477
C   -1.26568922   -2.46138925    0.00008343   -0.01192107    0.00025007   -0.00229230
C    1.26085634   -2.45442010    0.00853833   -0.00240705    0.00047481    0.00288377
H   -2.66387587   -0.85999291   -0.00526716   -0.00122891   -0.00007736   -0.00076464
H    2.65733425   -0.84817038    0.00163648   -0.00561194   -0.00052224    0.00101559
H   -2.10810739   -3.13950163    0.00938407    0.00341761    0.00370223    0.00075621
H    2.10918084   -3.13884294   -0.00294344    0.00046952   -0.00004334   -0.00088315
C    0.00375709   -3.06933110    0.00551851    0.00886936   -0.00589581   -0.00023022
H   -0.00923528   -4.15022501    0.00860852   -0.00196607    0.00454744    0.00003186
   15
   -420.54042219
H   -0.00269186    1.67974271   -0.00863274    0.00212580   -0.00132408   -0.00169239
O   -1.14906088    1.23214349    0.00606772    0.00306047    0.00274050    0.00165140
O    1.14960570    1.23141569    0.00606772   -0.00202616   -0.00126104   -0.00002640
C   -0.74393507    0.00033899   -0.00297890    0.00328104   -0.00787426   -0.00116791
C    0.73504971    0.01167244    0.00695933   -0.00764285    0.00457804    0.00304310
C   -1.60349213   -1.10080843   -0.00861958   -0.00872229    0.00718345   -0.00124907
C    1.59858598   -1.09252501   -0.00745251   -0.00323481    0.00643597   -0.00315008
C   -1.25224648   -2.46133057   -0.00039965    0.01157047   -0.01018086    0.00078738
C    1.25008767   -2.44989289   -0.00093825   -0.01144297    0.00196289    0.00103795
H   -2.65245462   -0.84997206   -0.00410307    0.00606599   -0.00028079    0.00021446
H    2.66664958   -0.84731688    0.00972598    0.00580003    0.00100096    0.00090623
H   -2.10708017   -3.13229160    0.00974137    0.00067774    0.00215063    0.00037242
H    2.10869212   -3.14690349    0.00490790    0.00775420   -0.00731459    0.00029735
C   -0.00591066   -3.06987033   -0.00672764   -0.00824217   -0.00598036   -0.00074285
H    0.00845497   -4.14548531   -0.00881382    0.00098114    0.00821279   -0.00028365
   15
   -420.53992214
H    0.00612751    1.68347627    0.00177463   -0.00136461    0.00087574   -0.00036722
O    1.15959236    1.22108354    0.00381748   -0.00245436   -0.01203441   -0.00106285
O   -1.15083403    1.22154091    0.00381748    0.00574734   -0.01742304    0.00102549
C    0.74941528    0.00899937    0.00889023    0.00518172    0.01352639    0.00389440
C   -0.74615513    0.01548781   -0.00459217   -0.00233602    0.02724649   -0.00236429
C    1.60088460   -1.10941568   -0.00787977   -0.00605299   -0.01626215   -0.00218589
C   -1.60734062   -1.11102066   -0.00451381   -0.01000653   -0.01831689    0.00025199
C    1.25597854   -2.44757921   -0.00380096    0.00305942    0.01938531    0.00051803
C   -1.26117400   -2.45087498   -0.00335608   -0.00005711    0.01403746   -0.00018403
H    2.66628909   -0.84906684   -0.00373000    0.00529733    0.00294385    0.00033217
H   -2.65428767   -0.84952762   -0.00569026    0.00628068    0.00052181   -0.00006053
H    2.11038758   -3.13648205   -0.00058383    0.00420873   -0.00297886    0.00032495
H   -2.10244542   -3.14829345    0.00482273   -0.00024455   -0.00268287    0.00040270
C   -0.00687285   -3.07511924   -0.00619103   -0.00762268   -0.01267276   -0.00031034
H   -0.00165117   -4.15604939   -0.00855115    0.00034973    0.00390411   -0.00021575
   15
   -420.54041294
H   -0.00331431    1.67554089    0.00577319    0.00161192   -0.00242518   -0.00032148
O    1.14674098    1.22370683    0.00767573   -0.00683044   -0.01600121   -0.00024130
O   -1.15937606    1.22461714    0.00767573    0.00104260   -0.01158006    0.00128427
C    0.74313165    0.01535039    0.00521102    0.00060881    0.02063708    0.00158420
C   -0.74516502    0.01190646   -0.00444344   -0.00008007    0.01029445   -0.00260338
C    1.60078068   -1.10219958    0.00100222   -0.00052741   -0.00236673   -0.00117900
C   -1.60120786   -1.09199650    0.00064871   -0.00210586    0.01659821   -0.00013692
C    1.25240988   -2.45424907    0.00667899   -0.00331303   -0.00132497    0.00299916
C   -1.25845759   -2.46330952    0.00659564    0.00318301   -0.01283943    0.00286439
H    2.66782506   -0.86384734    0.00340542    0.00401363    0.00014622   -0.00007633
H   -2.66077895   -0.85151670    0.00282957    0.00041957   -0.00053795   -0.00010421
H    2.10158528   -3.13624586   -0.00102384   -0.00017182    0.00004904   -0.00056846
H   -2.11283394   -3.14072961    0.00128271   -0.00096668   -0.00045040   -0.00058016
C   -0.00076312   -3.07385418   -0.00982683    0.00369681   -0.00692097   -0.00355347
H   -0.00118563   -4.15155005   -0.00054303   -0.00059815    0.00680437    0.00063428
   15
   -420.54048383
H   -0.00846811    1.67830525   -0.00863129    0.00253714   -0.00062490   -0.00115745
O   -1.15668251    1.22860226    0.00212184   -0.00188246    0.00331497    0.00079444
O    1.15565350    1.23027828    0.00212184   -0.00177404   -0.00719503    0.00149043
C   -0.74831577   -0.00167595   -0.00185292   -0.01136211   -0.01336827    0.00033991
C    0.75236045    0.01409408   -0.00498547    0.00756511    0.00814124   -0.00248486
C   -1.59500207   -1.10112452   -0.00516584    0.01912456    0.00010607   -0.00007324
C    1.60636767   -1.09343679    0.00817117   -0.00185282    0.00696306    0.00147326
C   -1.26073349   -2.44921792   -0.00675219   -0.00573623    0.00946189   -0.00020389
C    1.25236447   -2.45139074    0.00788687   -0.01364119    0.00118604    0.00215302
H   -2.67026742   -0.85193481   -0.00391747   -0.00995096    0.00199296    0.00006386
H    2.67102101   -0.85125149    0.00198941    0.00288453    0.00101422   -0.00056021
H   -2.10637444   -3.13717379   -0.00957289   -0.00004490   -0.00113071    0.00003940
H    2.11394863   -3.14366341   -0.00667033    0.00782951   -0.00643251   -0.00124228
C    0.00106570   -3.06912639   -0.00291299    0.00637442   -0.00324165   -0.00121284
H   -0.00060575   -4.15639551    0.00491356   -0.00010425   -0.00010742    0.00058134
   15
   -420.54066426
H    0.00675344    1.68101099   -0.00857117   -0.00217026   -0.00167111   -0.00204955
O    1.14534307    1.23964169    0.00941887   -0.00219189    0.00463474    0.00238668
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   15
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   15
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   15
   -420.53801976
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   15
   -420.53643960
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O   -1.92185701   -1.28494590   -0.02945282   -0.00282941   -0.01598141   -0.00703306
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C   -0.78631628   -0.72824051    0.04521247    0.01079523    0.04037859    0.01853371
C    0.28025151    1.55751843   -0.00546886   -0.02154077   -0.01662843   -0.00184463
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C    1.65942766    1.23748153   -0.01058434   -0.00222706   -0.00359069    0.00258212
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C    2.29843915    0.01090911   -0.03537309   -0.00627140   -0.03855006   -0.01470423
H    3.38204508    0.02472274    0.02917091   -0.00134643   -0.00034611    0.00367947
   15
   -420.53502174
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O   -1.91738671   -1.28604504   -0.03243820   -0.00172475   -0.01641669   -0.00761941
C   -0.80894335    0.74695494    0.04822683   -0.05870695    0.03897798    0.00306720
C   -0.78434597   -0.72580236    0.04922375    0.01140799    0.04172265    0.02010422
C    0.27857256    1.55697412   -0.00597854   -0.02291140   -0.01499038   -0.00208151
C    0.38579862   -1.59514669   -0.04715515    0.02614959   -0.01711443   -0.02589797
C    1.65689271    1.23449143   -0.01190094    0.00057234    0.00003995    0.00279802
C    1.68196984   -1.21434436    0.05722829   -0.01499253    0.04049953    0.02094629
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H    2.29339334    2.10582445   -0.01744326   -0.00534043   -0.00484173    0.00121160
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C    2.29761634    0.00997533   -0.03846522   -0.00207719   -0.03808558   -0.01568036
H    3.37495112    0.02192459    0.02974161   -0.00557235   -0.00076120    0.00370012
   15
   -420.53395329
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O   -1.91289725   -1.28695827   -0.03533721   -0.00017140   -0.01648739   -0.00813515
C   -0.80866745    0.74763522    0.05285390   -0.05660164    0.03823306    0.00341569
C   -0.78254776   -0.72399403    0.05293127    0.01172393    0.04222156    0.02149762
C    0.27723945    1.55665648   -0.00645675   -0.02380897   -0.01336463   -0.00232249
C    0.38536438   -1.59384370   -0.05029105    0.02548142   -0.01488658   -0.02756942
C    1.65434974    1.23150170   -0.01325982    0.00284273    0.00285322    0.00298606
C    1.68076097   -1.21465879    0.06163111   -0.01574861    0.04018933    0.02210995
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H    2.38209732   -2.04492241    0.00987449   -0.00165091    0.00394880   -0.00554300
C    2.29682540    0.00961585   -0.04132035    0.00175063   -0.03635539   -0.01657926
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   15
   -420.53334367
H   -2.59525508    0.48561235   -0.03343004    0.00632454    0.00790153   -0.00035014
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O   -1.90840626   -1.28768481   -0.03814405    0.00184738   -0.01618498   -0.00854657
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C   -0.78092644   -0.72282301    0.05631402    0.01172198    0.04185459    0.02268841
C    0.27626564    1.55654134   -0.00689990   -0.02415575   -0.01207170   -0.00253574
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C    1.65176510    1.22847080   -0.01466382    0.00403353    0.00404946    0.00315249
C    1.67979003   -1.21557980    0.06569984   -0.01635459    0.03902338    0.02310075
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H    2.27968097    2.08908458   -0.02279939   -0.01153305   -0.01319030    0.00151141
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C    2.29600917    0.00980460   -0.04392487    0.00459184   -0.03340678   -0.01743546
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   15
   -420.53329013
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O   -1.90393665   -1.28822811   -0.04085405    0.00433849   -0.01551430   -0.00885492
C   -0.80562092    0.74729274    0.06194600   -0.04605865    0.03365444    0.00440875
C   -0.77948195   -0.72228379    0.05935400    0.01138631    0.04062935    0.02366603
C    0.27565632    1.55660939   -0.00730476   -0.02390864   -0.01131847   -0.00271601
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C    1.64912137    1.22538140   -0.01611548    0.00368624    0.00300637    0.00330525
C    1.67906618   -1.21708990    0.06941951   -0.01680215    0.03709937    0.02390789
H    0.06595218    2.61267654   -0.06602455    0.00316897   -0.00690770   -0.00010257
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C    2.29512530    0.01049709   -0.04626580    0.00593793   -0.02932950   -0.01828048
H    3.36207938    0.01469839    0.02746928   -0.01292070   -0.00222050    0.00370365
   15
   -420.53376231
H   -2.59538083    0.48647293   -0.03800446    0.00607341    0.00675002   -0.00040845
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C   -0.80300893    0.74633888    0.06639602   -0.03826642    0.03008797    0.00505867
C   -0.77820924   -0.72235785    0.06203643    0.01072796    0.03855403    0.02440980
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C    1.64642400    1.22224961   -0.01761710    0.00162460   -0.00053506    0.00345697
C    1.67859618   -1.21916013    0.07277795   -0.01707831    0.03452365    0.02452221
H    0.06583067    2.61299676   -0.07086298    0.00309650   -0.00658304   -0.00016339
H    0.13633674   -2.65512273    0.02218780    0.00078500   -0.00760407    0.00662706
H    2.27394276    2.08139721   -0.02924025   -0.01235808   -0.01432754    0.00174770
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C    2.29415374    0.01163185   -0.04833035    0.00554574   -0.02426678   -0.01912166
H    3.36205022    0.01297003    0.02538182   -0.01221659   -0.00271861    0.00379595
   15
   -420.53457487
H   -2.59712033    0.48500271   -0.04018482    0.00462433    0.00476394   -0.00050950
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O   -1.89517980   -1.28879954   -0.04597084    0.01067191   -0.01310268   -0.00912309
C   -0.79981968    0.74493085    0.07076945   -0.02939893    0.02589666    0.00579744
C   -0.77709839   -0.72301384    0.06435009    0.00978223    0.03566525    0.02491371
C    0.27550674    1.55725952   -0.00798935   -0.02154118   -0.01170312   -0.00294345
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C    1.64370399    1.21912867   -0.01917100   -0.00201559   -0.00633453    0.00362080
C    1.67838417   -1.22175168    0.07576586   -0.01717947    0.03140344    0.02493389
H    0.06515472    2.61449023   -0.07567175    0.00282541   -0.00543415   -0.00027445
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H    2.27441292    2.08142453   -0.03292252   -0.01043935   -0.01175695    0.00180847
H    2.38350055   -2.04962888    0.03843151   -0.00076582    0.00403295   -0.00498830
C    2.29310034    0.01313256   -0.05010582    0.00350076   -0.01840323   -0.01993846
H    3.36419676    0.01173081    0.02261027   -0.00989563   -0.00319705    0.00393456
   15
   -420.53549177
H   -2.59968415    0.48268303   -0.04227330    0.00262408    0.00219094   -0.00063613
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O   -1.89096432   -1.28885495   -0.04837461    0.01442283   -0.01140961   -0.00907487
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C   -0.77613514   -0.72420813    0.06628739    0.00859265    0.03200140    0.02516194
C    0.27593071    1.55784722   -0.00826576   -0.01946057   -0.01264296   -0.00297200
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C    1.64101587    1.21610544   -0.02077967   -0.00680925   -0.01372803    0.00380491
C    1.67843168   -1.22481753    0.07837704   -0.01710221    0.02785803    0.02513047
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C    2.29199558    0.01491080   -0.05157991    0.00017960   -0.01196726   -0.02068854
H    3.36810705    0.01106668    0.01913020   -0.00635357   -0.00364151    0.00408554
   15
   -420.53623754
H   -2.60271791    0.47997224   -0.04424696    0.00045559   -0.00061730   -0.00078794
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O   -1.88691273   -1.28878120   -0.05067555    0.01846556   -0.00942556   -0.00890891
C   -0.79225157    0.74101172    0.07924081   -0.01048489    0.01633501    0.00747211
C   -0.77530163   -0.72588542    0.06784455    0.00724521    0.02763661    0.02515878
C    0.27664829    1.55862628   -0.00849725   -0.01685597   -0.01374635   -0.00298242
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C    1.63843138    1.21329060   -0.02244590   -0.01216419   -0.02180894    0.00400710
C    1.67873753   -1.22830417    0.08060854   -0.01685058    0.02398691    0.02509938
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H    2.38522026   -2.05636948    0.05823953    0.00003328    0.00340806   -0.00404848
C    2.29088898    0.01686961   -0.05274135   -0.00385358   -0.00522496   -0.02131664
H    3.37315172    0.01105732    0.01491512   -0.00215740   -0.00402875    0.00420145
   15
   -420.53660121
H   -2.60583618    0.47737028   -0.04607866   -0.00154371   -0.00326822   -0.00093757
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O   -1.88307079   -1.28860074   -0.05287553    0.02271057   -0.00720885   -0.00862885
C   -0.78815757    0.73864481    0.08331350   -0.00136548    0.01127839    0.00836411
C   -0.77457758   -0.72797983    0.06902164    0.00582319    0.02265957    0.02490109
C    0.27762021    1.55961305   -0.00868367   -0.01381636   -0.01472995   -0.00297495
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C    1.63603071    1.21080519   -0.02417272   -0.01749052   -0.02965728    0.00422157
C    1.67929798   -1.23215322    0.08246084   -0.01644384    0.01988934    0.02483064
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H    2.28474030    2.09105471   -0.04592045   -0.00015146    0.00188917    0.00172595
H    2.38610786   -2.06069033    0.06928175    0.00046839    0.00295861   -0.00342683
C    2.28984073    0.01890739   -0.05358069   -0.00797435    0.00154454   -0.02177363
H    3.37858401    0.01177202    0.00994489    0.00209092   -0.00433240    0.00423626
   15
   -420.53658731
H   -2.60868369    0.47535061   -0.04774181   -0.00307782   -0.00545567   -0.00106516
O   -1.99800572    1.26871083   -0.00680301    0.01671146    0.00982743   -0.00488847
O   -1.87948651   -1.28833872   -0.05497774    0.02702911   -0.00481369   -0.00823679
C   -0.78404208    0.73610741    0.08725970    0.00704619    0.00620465    0.00926911
C   -0.77394158   -0.73041624    0.06982252    0.00441332    0.01718275    0.02440477
C    0.27880070    1.56082209   -0.00882511   -0.01047063   -0.01530231   -0.00298243
C    0.37152558   -1.57707426   -0.05926648   -0.00592512   -0.00615047   -0.02968332
C    1.63389388    1.20876695   -0.02596336   -0.02233877   -0.03651128    0.00443387
C    1.68010688   -1.23630284    0.08393800   -0.01588676    0.01565726    0.02432059
H    0.05824741    2.62664920   -0.09406506    0.00068760    0.00289189   -0.00116129
H    0.12611888   -2.62751497   -0.01801862    0.00362309    0.00440213    0.00454232
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   15
   -420.53635117
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O   -1.87620879   -1.28802219   -0.05698656    0.03129781   -0.00232189   -0.00777535
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   15
   -420.53598684
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O   -1.87328592   -1.28767931   -0.05890724    0.03537271    0.00018395   -0.00723641
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   15
   -420.53562563
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O   -1.87076398   -1.28733843   -0.06074588    0.03910386    0.00262615   -0.00665053
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C    1.62973132    1.20624308   -0.03174852   -0.03121102   -0.04643426    0.00488348
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   15
   -420.53539227
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   15
   -420.53516091
H   -2.61366915    0.48264658   -0.05301732   -0.00003277   -0.00381739   -0.00096405
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C   -0.77143252   -0.74469871    0.06855466    0.00076830   -0.01222995    0.01918513
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C    1.62923172    1.20797165   -0.03596976   -0.03117366   -0.04236449    0.00481351
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   15
   -420.53486148
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C   -0.76491740    0.72142502    0.10752796    0.03540534   -0.01962224    0.01431161
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C    1.62969152    1.20981656   -0.03818999   -0.02933967   -0.03729974    0.00459670
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H    3.38181608    0.03878510   -0.04383116    0.00468363   -0.00275446    0.00149787
   15
   -420.53454729
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C   -0.76332309    0.71967795    0.11021906    0.03677897   -0.02255789    0.01503567
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C    1.63059368    1.21222349   -0.04047954   -0.02648098   -0.03063630    0.00423771
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H    2.38517018   -2.10699090    0.16757153    0.00169848   -0.00048216    0.00360443
C    2.28822207    0.02748392   -0.04856145   -0.00373988    0.02996038   -0.01797677
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   15
   -420.53410625
H   -2.61508220    0.49639017   -0.05402793    0.00644509    0.00403493   -0.00048743
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C   -0.76228409    0.71827131    0.11268288    0.03751899   -0.02497373    0.01571872
C   -0.77015812   -0.75180670    0.06417444    0.00282585   -0.02520095    0.01516659
C    0.28960036    1.57716547   -0.00815414    0.01256210    0.00502104   -0.00492878
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C    1.63189531    1.21509237   -0.04283300   -0.02288373   -0.02294676    0.00374164
C    1.69420750   -1.27277747    0.08390075   -0.00898136   -0.01398453    0.01272304
H    0.04128406    2.62576359   -0.11937656    0.00018944   -0.00243783   -0.00151465
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C    2.28874102    0.02677087   -0.04657800    0.00090385    0.02883507   -0.01683015
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   15
   -420.53367601
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   15
   -420.53337020
H   -2.62103342    0.50287737   -0.05420246    0.00772064    0.00649354   -0.00038564
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C    2.28967720    0.02407119   -0.04186673    0.00816645    0.02389238   -0.01425143
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   15
   -420.53336852
H   -2.62605857    0.50445512   -0.05418289    0.00675142    0.00600392   -0.00046531
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C   -0.76929305   -0.75557727    0.05772619    0.00700653   -0.03020856    0.01148990
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C    1.63764704    1.22531167   -0.05019496   -0.01267870   -0.00174387    0.00184601
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C    2.28998598    0.02215904   -0.03917797    0.00966068    0.02027891   -0.01277007
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   15
   -420.53371846
H   -2.63228490    0.50496769   -0.05407913    0.00480835    0.00444517   -0.00061608
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O   -1.87067762   -1.28791978   -0.07468137    0.04012815    0.00982274   -0.00245174
C   -0.76380045    0.71665290    0.12006921    0.03617407   -0.02900831    0.01796378
C   -0.76918690   -0.75594186    0.05520538    0.00851982   -0.02991680    0.01038801
C    0.29174763    1.58537298   -0.00620801    0.01431787    0.01322350   -0.00531818
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C    1.64000955    1.22890109   -0.05271780   -0.01111879    0.00225363    0.00131479
C    1.70496812   -1.28768613    0.07843865   -0.00582807   -0.02017155    0.00453081
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H    2.37580520   -2.13577220    0.21364753   -0.00090803   -0.00133680    0.00748601
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   15
   -420.53435549
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O   -1.87320772   -1.28856076   -0.07603840    0.03625585    0.00854308   -0.00229364
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C   -0.76920951   -0.75585524    0.05252747    0.00998940   -0.02869622    0.00932774
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   15
   -420.53513751
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O   -1.87614858   -1.28929835   -0.07736937    0.03184082    0.00692855   -0.00218317
C   -0.76787213    0.71843232    0.12216516    0.03340807   -0.02771195    0.01873295
C   -0.76938308   -0.75533577    0.04970848    0.01137287   -0.02663326    0.00830262
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C    1.64523813    1.23595444   -0.05781779   -0.01140821    0.00459116    0.00068511
C    1.71092305   -1.29338930    0.07517171   -0.00428880   -0.02039131    0.00069702
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   15
   -420.53581713
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O   -1.87945024   -1.29011432   -0.07867554    0.02701452    0.00505989   -0.00212106
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C   -0.76972849   -0.75441454    0.04676393    0.01264795   -0.02382005    0.00730046
C    0.29112473    1.58960945   -0.00392057    0.01221430    0.00906751   -0.00407215
C    0.37744908   -1.56228709   -0.01188397   -0.01459791    0.02582455   -0.00052749
C    1.64810763    1.23938183   -0.06038537   -0.01247863    0.00391257    0.00056038
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H    2.37130278   -2.15036807    0.22625430   -0.00296523   -0.00188802    0.00886240
C    2.28995661    0.01212732   -0.02675879   -0.00046263    0.00080846   -0.00506256
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   15
   -420.53632164
H   -2.66079301    0.50324961   -0.05212145   -0.00612112   -0.00441327   -0.00152958
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O   -1.88305808   -1.29098750   -0.07995763    0.02191356    0.00298613   -0.00208673
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C   -0.77026501   -0.75313392    0.04370899    0.01379506   -0.02038420    0.00630206
C    0.29052995    1.59070964   -0.00302489    0.01092213    0.00673308   -0.00346438
C    0.38084185   -1.56487315   -0.00749741   -0.01022586    0.02020460    0.00087118
C    1.65116564    1.24275047   -0.06296152   -0.01343792    0.00290467    0.00049435
C    1.71713632   -1.29786735    0.07186032   -0.00256943   -0.01901340   -0.00267255
H    0.02369639    2.63977375   -0.12656916   -0.00141665    0.00099466   -0.00235853
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C    2.28982539    0.00939182   -0.02338374   -0.00493425   -0.00464112   -0.00279571
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   15
   -420.53660249
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O   -1.88691436   -1.29189446   -0.08121603    0.01667628    0.00077644   -0.00206903
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C   -0.77100994   -0.75154571    0.04055876    0.01479239   -0.01645054    0.00530152
C    0.28977039    1.59170793   -0.00207688    0.00932409    0.00447526   -0.00282492
C    0.38438906   -1.56776448   -0.00312386   -0.00571493    0.01440885    0.00212827
C    1.65442615    1.24607475   -0.06554500   -0.01383812    0.00220883    0.00037076
C    1.72030778   -1.29966921    0.07025280   -0.00160267   -0.01789074   -0.00413377
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H    2.33854815    2.09979229   -0.18703490    0.00556016    0.00563187   -0.00048244
H    2.37075652   -2.15845255    0.22682556   -0.00415528   -0.00238325    0.00929997
C    2.28976837    0.00672643   -0.01996637   -0.00906368   -0.00998428   -0.00053899
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   15
   -420.53677300
H   -2.67051829    0.50546806   -0.04966355   -0.00865065   -0.00540372   -0.00171688
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O   -1.89095980   -1.29281016   -0.08245096    0.01143522   -0.00150687   -0.00206143
C   -0.78177954    0.72679871    0.12293261    0.02231410   -0.01972417    0.01940745
C   -0.77197832   -0.74970921    0.03732840    0.01562626   -0.01215675    0.00429482
C    0.28887018    1.59263815   -0.00108615    0.00744035    0.00257074   -0.00219182
C    0.38802261   -1.57087403    0.00121761   -0.00114276    0.00891882    0.00330424
C    1.65789476    1.24936476   -0.06813388   -0.01332830    0.00222760    0.00012960
C    1.72350338   -1.30120079    0.06870757   -0.00054858   -0.01658875   -0.00542195
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H    2.34693880    2.10792522   -0.19789724    0.00867310    0.00950919   -0.00137594
H    2.37155359   -2.16187429    0.22461724   -0.00462340   -0.00266114    0.00935719
C    2.28984747    0.00421173   -0.01654078   -0.01243002   -0.01506457    0.00164966
H    3.38024894    0.10307376   -0.14890099    0.00765814    0.00886266   -0.00598928
   15
   -420.53693862
H   -2.67313914    0.50801327   -0.04797741   -0.00852936   -0.00446267   -0.00168135
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C    0.28785778    1.59352882   -0.00006224    0.00529779    0.00122825   -0.00158717
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C    1.72670717   -1.30248167    0.06724409    0.00059756   -0.01519550   -0.00652832
H    0.01899623    2.65017116   -0.12336734   -0.00266341    0.00559601   -0.00287285
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H    2.35378153    2.11436411   -0.20851372    0.01079130    0.01217592   -0.00214405
H    2.37318136   -2.16481674    0.22072595   -0.00498051   -0.00295149    0.00930481
C    2.29011319    0.00192430   -0.01313993   -0.01472887   -0.01971966    0.00368352
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   15
   -420.53717842
H   -2.67423742    0.51134898   -0.04598914   -0.00749988   -0.00264084   -0.00157301
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C   -0.79094014    0.73290555    0.12156365    0.01318061   -0.01362457    0.01925922
C   -0.77463305   -0.74555365    0.03068846    0.01671978   -0.00303706    0.00223199
C    0.28676555    1.59440008    0.00098574    0.00294249    0.00058241   -0.00103900
C    0.39527276   -1.57742860    0.00973303    0.00788988    0.00039862    0.00566386
C    1.66540875    1.25582479   -0.07331059   -0.00902408    0.00532157   -0.00090518
C    1.72990180   -1.30353282    0.06587910    0.00185086   -0.01379048   -0.00745834
H    0.01830877    2.65191331   -0.12129604   -0.00276149    0.00586445   -0.00287379
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H    2.35869737    2.11863121   -0.21874698    0.01179376    0.01345799   -0.00272896
H    2.37570398   -2.16722771    0.21516123   -0.00522007   -0.00325538    0.00913752
C    2.29060009   -0.00006567   -0.00979452   -0.01579462   -0.02381093    0.00550987
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   15
   -420.53751173
H   -2.67399668    0.51515000   -0.04371858   -0.00570200   -0.00011863   -0.00139689
O   -2.05027051    1.28564306    0.01075904   -0.01929356    0.01389844   -0.00770080
O   -1.90364592   -1.29535099   -0.08601598   -0.00310082   -0.00822379   -0.00200103
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C   -0.77633585   -0.74337219    0.02731005    0.01691858    0.00153544    0.00118378
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C    0.39875299   -1.58074529    0.01387123    0.01218283   -0.00221190    0.00690295
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C    1.73306835   -1.30437536    0.06462659    0.00319405   -0.01246657   -0.00816557
H    0.01811588    2.65261032   -0.11870875   -0.00268282    0.00539812   -0.00278023
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   15
   -420.53786446
H   -2.67273688    0.51896637   -0.04119721   -0.00337997    0.00279997   -0.00117720
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O   -1.90787484   -1.29604462   -0.08715850   -0.00721356   -0.01024362   -0.00194798
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C   -0.77829414   -0.74121378    0.02391376    0.01684554    0.00596420    0.00012927
C    0.28448611    1.59611216    0.00312166   -0.00216427    0.00146316   -0.00012353
C    0.40204940   -1.58402984    0.01790502    0.01616721   -0.00374098    0.00815739
C    1.67344627    1.26194110   -0.07842774   -0.00032074    0.01273202   -0.00287704
C    1.73618646   -1.30502921    0.06349736    0.00463633   -0.01129065   -0.00868478
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C    2.29228257   -0.00291648   -0.00337642   -0.01415236   -0.02988207    0.00838181
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   15
   -420.53816853
H   -2.67086992    0.52227714   -0.03846423   -0.00091858    0.00575054   -0.00094171
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O   -1.91202240   -1.29662220   -0.08827895   -0.01082922   -0.01208145   -0.00186692
C   -0.80594011    0.74346853    0.11733801   -0.00489005   -0.00262014    0.01839867
C   -0.78050679   -0.73914527    0.02051551    0.01646627    0.01015363   -0.00092654
C    0.28337592    1.59693987    0.00419576   -0.00476282    0.00283268    0.00025621
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H    2.36113590    2.11738647   -0.24630685    0.00793244    0.00887144   -0.00304515
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C    2.29345360   -0.00368571   -0.00034711   -0.01167098   -0.03171002    0.00939917
H    3.37377771    0.08244777   -0.16121309    0.00232043    0.00733415   -0.00648319
   15
   -420.53827338
H   -2.66883383    0.52455911   -0.03556130    0.00128096    0.00825701   -0.00073269
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O   -1.91604765   -1.29706285   -0.08937822   -0.01387707   -0.01373000   -0.00177399
C   -0.81092025    0.74714533    0.11536627   -0.01173255    0.00138485    0.01794999
C   -0.78296798   -0.73722986    0.01713125    0.01573504    0.01401155   -0.00197467
C    0.28233762    1.59772429    0.00526600   -0.00727392    0.00458103    0.00060862
C    0.40785712   -1.59042221    0.02558457    0.02266672   -0.00446841    0.01044645
C    1.68148639    1.26726989   -0.08336614    0.01167508    0.02353374   -0.00577494
C    1.74218887   -1.30583851    0.06163682    0.00778361   -0.00959662   -0.00912288
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H    0.08522315   -2.60804171   -0.18519188   -0.00370259    0.00378830   -0.00970347
H    2.35861423    2.11320458   -0.25438445    0.00471213    0.00493740   -0.00263792
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C    2.29480024   -0.00397652    0.00254037   -0.00846185   -0.03269405    0.01017357
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   15
   -420.53814150
H   -2.66701818    0.52536658   -0.03252596    0.00278693    0.00992910   -0.00056483
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O   -1.91991603   -1.29734798   -0.09045738   -0.01633068   -0.01513288   -0.00165748
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C    0.28140911    1.59843927    0.00632705   -0.00961287    0.00646156    0.00095276
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C    1.68528858    1.26944313   -0.08571584    0.01816421    0.02938232   -0.00744046
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   15
   -420.53780754
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O   -1.92359972   -1.29746167   -0.09151776   -0.01816582   -0.01629486   -0.00151918
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C   -0.78858574   -0.73408545    0.01046790    0.01310302    0.02048413   -0.00402199
C    0.28062556    1.59905679    0.00737363   -0.01167172    0.00818342    0.00133040
C    0.41230800   -1.59654928    0.03263639    0.02639846   -0.00417348    0.01193579
C    1.68881644    1.27117260   -0.08795306    0.02435008    0.03478841   -0.00909599
C    1.74771915   -1.30606216    0.06032418    0.01120038   -0.00894489   -0.00879369
H    0.02318678    2.64699953   -0.09907563   -0.00072424   -0.00352634   -0.00149241
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H    2.35171191    2.10302373   -0.26922922   -0.00279762   -0.00435364   -0.00137217
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C    2.29782427   -0.00307586    0.00784576   -0.00175623   -0.03217062    0.01121146
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   15
   -420.53739307
H   -2.66494546    0.52157662   -0.02616098    0.00280093    0.00975841   -0.00045774
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O   -1.92707792   -1.29739082   -0.09256093   -0.01937916   -0.01717543   -0.00137002
C   -0.82437286    0.75780285    0.10785521   -0.03242088    0.01356802    0.01624053
C   -0.79170248   -0.73295421    0.00721973    0.01117893    0.02301294   -0.00499950
C    0.28001809    1.59955111    0.00840007   -0.01339824    0.00949866    0.00173502
C    0.41394738   -1.59951682    0.03589675    0.02706348   -0.00434803    0.01225243
C    1.69197723    1.27237752   -0.09005295    0.02961825    0.03899344   -0.01057391
C    1.75024331   -1.30596922    0.05986891    0.01295079   -0.00902425   -0.00835625
H    0.02490516    2.64634761   -0.09413896   -0.00043275   -0.00499482   -0.00126815
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C    2.29940171   -0.00189223    0.01024777    0.00060962   -0.03071739    0.01164029
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   15
   -420.53698691
H   -2.66469139    0.51700850   -0.02285107    0.00136610    0.00796866   -0.00050300
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O   -1.93033685   -1.29712538   -0.09358857   -0.01997961   -0.01777415   -0.00120680
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C    0.27961266    1.59990266    0.00940016   -0.01470192    0.01016188    0.00220368
C    0.41517849   -1.60241806    0.03897225    0.02694017   -0.00499335    0.01225968
C    1.69469203    1.27299522   -0.09199343    0.03338083    0.04126776   -0.01167976
C    1.75257165   -1.30573954    0.05953979    0.01468877   -0.00935727   -0.00774840
H    0.02670383    2.64658347   -0.08897271   -0.00031290   -0.00574394   -0.00111112
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H    2.42757129   -2.16153368    0.11814270   -0.00182913   -0.00476940    0.00393574
C    2.30097159   -0.00024505    0.01247375    0.00164852   -0.02850912    0.01209114
H    3.36174827    0.03098606   -0.14589129   -0.01290919    0.00023917   -0.00352119
   15
   -420.53674252
H   -2.66467444    0.51101626   -0.01945018   -0.00065794    0.00542070   -0.00058468
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O   -1.93336968   -1.29665859   -0.09460252   -0.01999885   -0.01807932   -0.00104248
C   -0.83107191    0.76398747    0.10160563   -0.04412358    0.02095723    0.01491983
C   -0.79840624   -0.73176404    0.00096414    0.00612779    0.02650468   -0.00682185
C    0.27942896    1.60010150    0.01036689   -0.01555198    0.01007225    0.00272732
C    0.41600323   -1.60524310    0.04186277    0.02606467   -0.00619802    0.01197138
C    1.69690447    1.27299201   -0.09375796    0.03522710    0.04107289   -0.01225471
C    1.75467797   -1.30536813    0.05932764    0.01637158   -0.00991917   -0.00698917
H    0.02856003    2.64784089   -0.08360443   -0.00036290   -0.00567168   -0.00101720
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H    2.34618521    2.09498403   -0.28983577   -0.00888741   -0.01212677   -0.00047089
H    2.43686222   -2.15717048    0.10121753   -0.00083798   -0.00471651    0.00286737
C    2.30251833    0.00183225    0.01451684    0.00116498   -0.02556605    0.01259796
H    3.36475941    0.01946375   -0.14052801   -0.01240204   -0.00133035   -0.00323240
   15
   -420.53666967
H   -2.66453503    0.50405087   -0.01594454   -0.00290133    0.00258510   -0.00065279
O   -2.03574603    1.26899409    0.03095080    0.02667194   -0.01230292   -0.00382470
O   -1.93617615   -1.29598696   -0.09560465   -0.01947333   -0.01809364   -0.00087537
C   -0.83346378    0.76663199    0.09813744   -0.04866121    0.02412175    0.01423883
C   -0.80191696   -0.73175787   -0.00201574    0.00306255    0.02744632   -0.00764620
C    0.27947988    1.60014896    0.01129233   -0.01595970    0.00923687    0.00328967
C    0.41643470   -1.60797370    0.04457259    0.02453239   -0.00797169    0.01143208
C    1.69858677    1.27237098   -0.09533795    0.03504557    0.03826442   -0.01222678
C    1.75653689   -1.30484651    0.05922099    0.01795160   -0.01068329   -0.00608665
H    0.03048264    2.65010678   -0.07804993   -0.00058332   -0.00477741   -0.00101088
H    0.13144945   -2.66000669   -0.10826777   -0.00091524   -0.00737862   -0.00745701
H    2.34724748    2.09628684   -0.29651107   -0.00795200   -0.01101756   -0.00099649
H    2.44630292   -2.15195987    0.08377688    0.00021669   -0.00456371    0.00173637
C    2.30404931    0.00429528    0.01636941   -0.00081185   -0.02194630    0.01313819
H    3.36997951    0.00818140   -0.13458056   -0.01024244   -0.00294492   -0.00311989
   15
   -420.53672714
H   -2.66387735    0.49661967   -0.01232087   -0.00493176   -0.00017088   -0.00070706
O   -2.03464719    1.26771309    0.03348831    0.03243476   -0.01119801   -0.00342172
O   -1.93876217   -1.29511037   -0.09659686   -0.01846129   -0.01781077   -0.00071109
C   -0.83512125    0.76891239    0.09445399   -0.05206560    0.02679889    0.01354668
C   -0.80547360   -0.73216600   -0.00488010   -0.00031071    0.02784219   -0.00840300
C    0.27977161    1.60005755    0.01216795   -0.01595826    0.00777173    0.00388013
C    0.41649588   -1.61058309    0.04710981    0.02246614   -0.01027406    0.01069017
C    1.69974141    1.27117428   -0.09673374    0.03305377    0.03311790   -0.01163432
C    1.75812459   -1.30416318    0.05920621    0.01938231   -0.01161829   -0.00505675
H    0.03251347    2.65322231   -0.07231415   -0.00096878   -0.00319552   -0.00101043
H    0.14060168   -2.66491875   -0.08999977    0.00035938   -0.00657732   -0.00636058
H    2.34971994    2.09954790   -0.30300100   -0.00561753   -0.00812482   -0.00195000
H    2.45570444   -2.14592907    0.06602436    0.00130056   -0.00428947    0.00055692
C    2.30559398    0.00708940    0.01802335   -0.00392104   -0.01772383    0.01366243
H    3.37702513   -0.00257030   -0.12806998   -0.00681755   -0.00458244   -0.00310554
   15
   -420.53674913
H   -2.66233974    0.48921392   -0.00857030   -0.00644612   -0.00251939   -0.00071384
O   -2.03391488    1.26655906    0.03606473    0.03665754   -0.01003205   -0.00311107
O   -1.94113916   -1.29403201   -0.09758098   -0.01702519   -0.01724058   -0.00055089
C   -0.83599308    0.77078827    0.09056572   -0.05418058    0.02891339    0.01285086
C   -0.80902526   -0.73299447   -0.00761749   -0.00391954    0.02770951   -0.00908196
C    0.28030421    1.59984914    0.01298489   -0.01562367    0.00591251    0.00446513
C    0.41621792   -1.61303670    0.04948557    0.01998647   -0.01293317    0.00980707
C    1.70039789    1.26947890   -0.09795415    0.02974334    0.02628995   -0.01061570
C    1.75941947   -1.30330399    0.05926777    0.02062981   -0.01270075   -0.00392396
H    0.03471945    2.65690527   -0.06639621   -0.00142418   -0.00112870   -0.00104762
H    0.14968813   -2.66865629   -0.07058800    0.00172246   -0.00513955   -0.00517803
H    2.35318985    2.10425407   -0.30913557   -0.00234330   -0.00402374   -0.00320960
H    2.46487191   -2.13912700    0.04817208    0.00238680   -0.00390347   -0.00065487
C    2.30719865    0.01015091    0.01947085   -0.00761252   -0.01301869    0.01408341
H    3.38528775   -0.01249699   -0.12099921   -0.00266014   -0.00621007   -0.00312668
   15
   -420.53673984
H   -2.65965233    0.48225251   -0.00469205   -0.00722672   -0.00423194   -0.00066550
O   -2.03359668    1.26551890    0.03867653    0.03900469   -0.00896865   -0.00290207
O   -1.94332336   -1.29275835   -0.09855882   -0.01523482   -0.01638246   -0.00040278
C   -0.83604743    0.77222777    0.08648318   -0.05489720    0.03039730    0.01213899
C   -0.81251746   -0.73424125   -0.01021766   -0.00769846    0.02705896   -0.00968053
C    0.28107266    1.59955152    0.01373436   -0.01502797    0.00392954    0.00500404
C    0.41563802   -1.61529460    0.05171315    0.01727959   -0.01573230    0.00884724
C    1.70060551    1.26738706   -0.09901434    0.02571324    0.01860049   -0.00936118
C    1.76040268   -1.30225267    0.05938858    0.02166441   -0.01388691   -0.00271429
H    0.03718022    2.66078955   -0.06028945   -0.00184941    0.00107890   -0.00108631
H    0.15846443   -2.67147402   -0.05024446    0.00309269   -0.00331282   -0.00397129
H    2.35707653    2.10967787   -0.31469060    0.00128885    0.00055782   -0.00459761
H    2.47360967   -2.13162532    0.03043790    0.00344408   -0.00335891   -0.00187992
C    2.30891835    0.01340886    0.02070562   -0.01127186   -0.00799789    0.01433813
H    3.39402709   -0.02130656   -0.11336606    0.00163168   -0.00778625   -0.00309721
   15
   -420.53665639
H   -2.65567612    0.47604223   -0.00069457   -0.00716558   -0.00519781   -0.00056611
O   -2.03371906    1.26458069    0.04132132    0.03931716   -0.00813323   -0.00277778
O   -1.94533501   -1.29129912   -0.09953208   -0.01316398   -0.01525887   -0.00027070
C   -0.83527346    0.77320842    0.08221711   -0.05419674    0.03124349    0.01140740
C   -0.81589313   -0.73589656   -0.01267157   -0.01156931    0.02591366   -0.01018730
C    0.28206801    1.59919433    0.01440818   -0.01423176    0.00210037    0.00549844
C    0.41479694   -1.61731480    0.05380700    0.01448227   -0.01839016    0.00786704
C    1.70042456    1.26501410   -0.09993305    0.02150797    0.01082945   -0.00806858
C    1.76105860   -1.30099133    0.05955036    0.02245300   -0.01514441   -0.00144616
H    0.03997265    2.66447969   -0.05398782   -0.00222410    0.00320571   -0.00106853
H    0.16668400   -2.67369712   -0.02918499    0.00439412   -0.00136031   -0.00279521
H    2.36073392    2.11500436   -0.31941856    0.00474812    0.00494094   -0.00593518
H    2.48172813   -2.12352127    0.01304207    0.00442382   -0.00268444   -0.00309804
C    2.31080777    0.01678760    0.02172386   -0.01435570   -0.00286925    0.01438341
H    3.40247849   -0.02871618   -0.10517700    0.00551340   -0.00925202   -0.00294945
   15
   -420.53657238
H   -2.65042226    0.47075632    0.00340419   -0.00625322   -0.00537464   -0.00041771
O   -2.03428557    1.26373498    0.04399768    0.03758106   -0.00756628   -0.00271692
O   -1.94719751   -1.28966703   -0.10050225   -0.01089640   -0.01389758   -0.00015437
C   -0.83368175    0.77371744    0.07777861   -0.05209653    0.03144923    0.01063815
C   -0.81909390   -0.73794313   -0.01497156   -0.01544064    0.02431448   -0.01060047
C    0.28327840    1.59880489    0.01499893   -0.01335146    0.00067254    0.00592489
C    0.41373681   -1.61905750    0.05578192    0.01176454   -0.02059122    0.00690041
C    1.69991811    1.26247669   -0.10072961    0.01755766    0.00363406   -0.00689846
C    1.76137538   -1.29950096    0.05973398    0.02296757   -0.01642813   -0.00015708
H    0.04316269    2.66759752   -0.04749343   -0.00247181    0.00497580   -0.00102262
H    0.17411484   -2.67567284   -0.00762026    0.00550644    0.00040537   -0.00168125
H    2.36354540    2.11945209   -0.32308103    0.00761476    0.00858152   -0.00706547
H    2.48905160   -2.11493580   -0.00379651    0.00529802   -0.00187003   -0.00428403
C    2.31291300    0.02020981    0.02252490   -0.01642249    0.00216999    0.01419937
H    3.40994958   -0.03446268   -0.09645842    0.00856325   -0.01052488   -0.00267939
   15
   -420.53657007
H   -2.64405374    0.46642684    0.00757764   -0.00457333   -0.00478413   -0.00023091
O   -2.03527662    1.26297536    0.04670490    0.03393231   -0.00727831   -0.00269582
O   -1.94893650   -1.28787749   -0.10147065   -0.00850983   -0.01232648   -0.00005951
C   -0.83130397    0.77375170    0.07317933   -0.04867418    0.03105600    0.00981432
C   -0.82206132   -0.74035683   -0.01711141   -0.01923265    0.02229519   -0.01090872
C    0.28469061    1.59840460    0.01550017   -0.01243070   -0.00017638    0.00628098
C    0.41249853   -1.62048973    0.05765251    0.00928174   -0.02205909    0.00596367
C    1.69914551    1.25988301   -0.10142158    0.01414671   -0.00249970   -0.00597061
C    1.76134520   -1.29776222    0.05991999    0.02321484   -0.01768402    0.00112921
H    0.04679531    2.66982754   -0.04081567   -0.00255835    0.00619587   -0.00092927
H    0.18055834   -2.67771391    0.01424889    0.00636352    0.00164097   -0.00065652
H    2.36499869    2.12237086   -0.32547593    0.00961158    0.01112290   -0.00789557
H    2.49542313   -2.10601538   -0.01986438    0.00604962   -0.00092227   -0.00542765
C    2.31526489    0.02359960    0.02311152   -0.01716852    0.00690855    0.01379610
H    3.41589472   -0.03831962   -0.08726168    0.01050409   -0.01150953   -0.00222527
   15
   -420.53676414
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O   -2.03665106    1.26229852    0.04944271    0.02862912   -0.00723318   -0.00267741
O   -1.95057899   -1.28594824   -0.10243836   -0.00608375   -0.01060796    0.00001535
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C    2.31787455    0.02688548    0.02348978   -0.01642523    0.01117755    0.01320341
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   15
   -420.53714113
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O   -1.95215242   -1.28389876   -0.10340621   -0.00370814   -0.00877680    0.00005923
C   -0.82441450    0.77242755    0.06354924   -0.03843759    0.02874214    0.00795513
C   -0.82707010   -0.74615832   -0.02089363   -0.02616514    0.01723237   -0.01119600
C    0.28806494    1.59761203    0.01621366   -0.01061415    0.00024274    0.00678860
C    0.40963249   -1.62234986    0.06113658    0.00535032   -0.02201865    0.00417452
C    1.69699724    1.25487595   -0.10254278    0.00946243   -0.01048283   -0.00510164
C    1.76023378   -1.29346494    0.06022209    0.02281440   -0.01994171    0.00356552
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   15
   -420.53764166
H   -2.62176538    0.45757061    0.02019741    0.00312005    0.00014703    0.00040279
O   -2.04029651    1.26119185    0.05500877    0.01465959   -0.00731499   -0.00252268
O   -1.95368367   -1.28174976   -0.10437471   -0.00146025   -0.00690515    0.00006820
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C   -0.82900680   -0.74946968   -0.02253167   -0.02911366    0.01431109   -0.01116136
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C    0.40806403   -1.62277825    0.06277720    0.00399408   -0.02052510    0.00325789
C    1.69569230    1.25258295   -0.10298509    0.00827885   -0.01206094   -0.00520934
C    1.75915858   -1.29087245    0.06030139    0.02215756   -0.02082312    0.00467066
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C    2.32379878    0.03289740    0.02365912   -0.01034999    0.01777185    0.01162449
H    3.42226169   -0.03706141   -0.05771189    0.00854400   -0.01245967   -0.00021149
   15
   -420.53820628
H   -2.61480519    0.45501741    0.02431023    0.00560301    0.00196831    0.00059102
O   -2.04240990    1.26076255    0.05783521    0.00693720   -0.00703030   -0.00233181
O   -1.95519816   -1.27952243   -0.10534394    0.00056332   -0.00504473    0.00003421
C   -0.81521658    0.76937221    0.05343972   -0.02494845    0.02501353    0.00574869
C   -0.83050390   -0.75299724   -0.02400111   -0.03157953    0.01123477   -0.01099816
C    0.29208192    1.59679166    0.01651749   -0.00890098    0.00332504    0.00709655
C    0.40643470   -1.62289721    0.06436862    0.00303581   -0.01828166    0.00230441
C    1.69426132    1.25047036   -0.10334823    0.00782241   -0.01203396   -0.00565848
C    1.75774873   -1.28796542    0.06031020    0.02119374   -0.02145208    0.00566965
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H    0.19425076   -2.68885613    0.10121080    0.00659594   -0.00109433    0.00306387
H    2.35286859    2.11325644   -0.32041642    0.00710658    0.00772431   -0.00746001
H    2.50913593   -2.07066161   -0.07251695    0.00738382    0.00364486   -0.00918003
C    2.32702176    0.03552392    0.02347394   -0.00526532    0.01994928    0.01075088
H    3.42095160   -0.03217646   -0.04761067    0.00549653   -0.01203188    0.00055961
   15
   -420.53864673
H   -2.60884457    0.45211674    0.02831697    0.00749572    0.00331149    0.00074685
O   -2.04460215    1.26041242    0.06068801   -0.00060441   -0.00615010   -0.00203947
O   -1.95671875   -1.27723781   -0.10631356    0.00227793   -0.00325729   -0.00003856
C   -0.80999934    0.76726252    0.04824607   -0.01751012    0.02286589    0.00450806
C   -0.83152426   -0.75669454   -0.02530443   -0.03345300    0.00806844   -0.01069789
C    0.29429870    1.59631912    0.01650950   -0.00802187    0.00556451    0.00720293
C    0.40475907   -1.62274037    0.06592527    0.00242321   -0.01559782    0.00130332
C    1.69271139    1.24853793   -0.10362548    0.00796379   -0.01055263   -0.00639128
C    1.75601881   -1.28473440    0.06023344    0.01991745   -0.02177165    0.00654327
H    0.07092225    2.66440907   -0.00554087   -0.00028690    0.00218285    0.00005866
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H    2.50932076   -2.06293342   -0.08193125    0.00731649    0.00476862   -0.00987088
C    2.33032314    0.03784974    0.02312617    0.00078614    0.02134561    0.00990390
H    3.41866363   -0.02513003   -0.03760982    0.00164858   -0.01129237    0.00128341
   15
   -420.53897341
H   -2.60422137    0.44863128    0.03218987    0.00856796    0.00387779    0.00085862
O   -2.04678805    1.26013130    0.06356383   -0.00757203   -0.00446495   -0.00163412
O   -1.95826483   -1.27491612   -0.10728269    0.00361643   -0.00160084   -0.00016975
C   -0.80451761    0.76480722    0.04298438   -0.00987796    0.02063325    0.00318408
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C    0.29663654    1.59576243    0.01639262   -0.00703020    0.00790976    0.00728964
C    0.40304645   -1.62234789    0.06746225    0.00209506   -0.01280975    0.00027621
C    1.69104058    1.24676372   -0.10380580    0.00848623   -0.00797176   -0.00732328
C    1.75398807   -1.28117473    0.06005790    0.01835158   -0.02169767    0.00728623
H    0.07636508    2.66103706    0.00164028    0.00050414    0.00002775    0.00026705
H    0.19387659   -2.69410104    0.14204119    0.00523379   -0.00527156    0.00496815
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H    2.50819010   -2.05606210   -0.08957038    0.00713379    0.00578384   -0.01044969
C    2.33361209    0.03985349    0.02262852    0.00728814    0.02205655    0.00914549
H    3.41608345   -0.01605778   -0.02784158   -0.00253428   -0.01022405    0.00196429
   15
   -420.53904525
H   -2.60112689    0.44446116    0.03590869    0.00870761    0.00351079    0.00093660
O   -2.04888885    1.25990004    0.06645809   -0.01368235   -0.00190664   -0.00111931
O   -1.95985153   -1.27257613   -0.10824984    0.00450603   -0.00010909   -0.00036253
C   -0.79888652    0.76203998    0.03767462   -0.00225878    0.01839138    0.00178843
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C    0.29908047    1.59508632    0.01616554   -0.00586944    0.01010828    0.00736148
C    0.40130196   -1.62176144    0.06899503    0.00196368   -0.01026539   -0.00073569
C    1.68924139    1.24510933   -0.10387534    0.00905058   -0.00481754   -0.00830274
C    1.75168020   -1.27728754    0.05977239    0.01651419   -0.02118101    0.00787994
H    0.08171708    2.65765886    0.00877369    0.00128971   -0.00203640    0.00045325
H    0.19220999   -2.69549158    0.16120068    0.00441396   -0.00709488    0.00591061
H    2.33051232    2.09200548   -0.30262642   -0.00350464   -0.00612187   -0.00419832
H    2.50577650   -2.05022968   -0.09532985    0.00686021    0.00663469   -0.01092512
C    2.33679108    0.04152454    0.02199245    0.01357789    0.02209721    0.00851571
H    3.41395586   -0.00514814   -0.01842582   -0.00647545   -0.00895032    0.00251571
   15
   -420.53901382
H   -2.59958515    0.43967108    0.03945848    0.00793145    0.00222176    0.00097447
O   -2.05083534    1.25968956    0.06936494   -0.01882554    0.00151406   -0.00050562
O   -1.96148888   -1.27023470   -0.10921283    0.00488205    0.00118661   -0.00061405
C   -0.79322100    0.75899462    0.03233788    0.00515058    0.01618555    0.00033473
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C    0.30161281    1.59425795    0.01582718   -0.00444665    0.01184691    0.00741462
C    0.39952763   -1.62101925    0.07053883    0.00195129   -0.00819778   -0.00167638
C    1.68730587    1.24352792   -0.10381948    0.00918613   -0.00178666   -0.00916643
C    1.74912294   -1.27308074    0.05936795    0.01442890   -0.02013531    0.00831137
H    0.08683817    2.65464176    0.01582582    0.00199300   -0.00372524    0.00061738
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H    2.32340582    2.08593081   -0.29490335   -0.00706584   -0.01073472   -0.00313623
H    2.50212858   -2.04558861   -0.09912352    0.00653732    0.00727028   -0.01131993
C    2.33976592    0.04286215    0.02122743    0.01892337    0.02158394    0.00804036
H    3.41298074    0.00737031   -0.00946107   -0.00950774   -0.00750096    0.00293136
   15
   -420.53893616
H   -2.59946007    0.43448963    0.04283239    0.00643127    0.00025530    0.00098784
O   -2.05256907    1.25946144    0.07227744   -0.02308382    0.00547404    0.00018394
O   -1.96318111   -1.26790653   -0.11016881    0.00471085    0.00227089   -0.00091992
C   -0.78763289    0.75570446    0.02699614    0.01218621    0.01404344   -0.00116340
C   -0.83043447   -0.77222662   -0.02897810   -0.03335827   -0.00422533   -0.00812606
C    0.30421199    1.59325134    0.01537675   -0.00269514    0.01286358    0.00743938
C    0.39772374   -1.62015223    0.07210785    0.00197238   -0.00683853   -0.00250276
C    1.68523265    1.24197467   -0.10362538    0.00836824    0.00031279   -0.00974813
C    1.74634773   -1.26857013    0.05883801    0.01216136   -0.01855231    0.00859842
H    0.09160245    2.65228619    0.02276700    0.00256532   -0.00478522    0.00076649
H    0.18665303   -2.69423858    0.19617617    0.00270800   -0.00890185    0.00752233
H    2.31755896    2.08177141   -0.28661178   -0.00977050   -0.01415235   -0.00234908
H    2.49730440   -2.04225253   -0.10088114    0.00617199    0.00764004   -0.01157716
C    2.34245660    0.04387403    0.02034067    0.02266848    0.02057079    0.00771354
H    3.41369593    0.02123747   -0.00102217   -0.01106613   -0.00592718    0.00321957
   15
   -420.53892195
H   -2.60048695    0.42926690    0.04602883    0.00448834   -0.00207221    0.00098559
O   -2.05404159    1.25917118    0.07518780   -0.02660345    0.00961092    0.00092954
O   -1.96492628   -1.26560390   -0.11111431    0.00398225    0.00313817   -0.00127902
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C   -0.82887098   -0.77606291   -0.02956026   -0.03109962   -0.00699800   -0.00714894
C    0.30685144    1.59205133    0.01481389   -0.00055461    0.01299384    0.00742054
C    0.39589005   -1.61918086    0.07371453    0.00195735   -0.00627460   -0.00316444
C    1.68303451    1.24041862   -0.10328437    0.00620951    0.00083598   -0.00993955
C    1.74338883   -1.26377978    0.05817834    0.00975940   -0.01636588    0.00870495
H    0.09590745    2.65078046    0.02957027    0.00296532   -0.00504513    0.00091147
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H    2.31345110    2.08013371   -0.27789165   -0.01111765   -0.01576281   -0.00195316
H    2.49136881   -2.04028772   -0.10055456    0.00580414    0.00771796   -0.01175678
C    2.34480703    0.04457544    0.01933712    0.02438243    0.01910687    0.00751175
H    3.41637690    0.03616999    0.00683857   -0.01080525   -0.00423182    0.00340982
   15
   -420.53904342
H   -2.60231758    0.42441571    0.04904783    0.00233884   -0.00438146    0.00098710
O   -2.05521283    1.25877196    0.07808760   -0.02956816    0.01362788    0.00170856
O   -1.96671612   -1.26333668   -0.11204526    0.00270358    0.00380869   -0.00168584
C   -0.77710552    0.74851828    0.01638861    0.02451166    0.00997030   -0.00422988
C   -0.82683841   -0.77979359   -0.03003449   -0.02790700   -0.00960338   -0.00605104
C    0.30949881    1.59065596    0.01413890    0.00197697    0.01220589    0.00734522
C    0.39402688   -1.61811366    0.07536880    0.00182697   -0.00652346   -0.00362043
C    1.68074440    1.23885229   -0.10279359    0.00249287   -0.00057090   -0.00971614
C    1.74028247   -1.25874273    0.05738727    0.00730217   -0.01358446    0.00862930
H    0.09968103    2.65017081    0.03620919    0.00318611   -0.00446212    0.00107033
H    0.17912776   -2.68676796    0.22577766    0.00126211   -0.00751988    0.00846719
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H    2.48438822   -2.03970783   -0.09811289    0.00544142    0.00748598   -0.01183492
C    2.34679135    0.04498848    0.01821990    0.02400411    0.01720530    0.00739236
H    3.42097654    0.05186248    0.01408627   -0.00871839   -0.00240756    0.00354282
   15
   -420.53920242
H   -2.60457103    0.42034836    0.05188908    0.00032292   -0.00636434    0.00099594
O   -2.05604899    1.25821864    0.08096800   -0.03217807    0.01709406    0.00250148
O   -1.96853617   -1.26111248   -0.11295708    0.00091943    0.00431107   -0.00212557
C   -0.77235234    0.74468383    0.01116914    0.02955346    0.00802694   -0.00576440
C   -0.82438496   -0.78337926   -0.03041737   -0.02382368   -0.01204297   -0.00484242
C    0.31211584    1.58907702    0.01335293    0.00486406    0.01060650    0.00721375
C    0.39213622   -1.61694696    0.07707756    0.00154446   -0.00751396   -0.00385295
C    1.67841827    1.23729684   -0.10215632   -0.00262326   -0.00381529   -0.00916234
C    1.73706571   -1.25350102    0.05646597    0.00485903   -0.01022482    0.00835816
H    0.10288343    2.65035371    0.04265510    0.00322627   -0.00313224    0.00125501
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H    2.31113243    2.08518220   -0.25937803   -0.00917847   -0.01264482   -0.00229675
H    2.47642798   -2.04047110   -0.09354214    0.00507978    0.00694269   -0.01180673
C    2.34841495    0.04514190    0.01699086    0.02182659    0.01487801    0.00731178
H    3.42712410    0.06798641    0.02069643   -0.00514416   -0.00044816    0.00365770
   15
   -420.53928397
H   -2.60688755    0.41741797    0.05455083   -0.00135817   -0.00774356    0.00101796
O   -2.05652030    1.25747214    0.08382003   -0.03459969    0.01977356    0.00328950
O   -1.97036627   -1.25893707   -0.11384476   -0.00130062    0.00468342   -0.00259981
C   -0.76804498    0.74072798    0.00603681    0.03373257    0.00611574   -0.00728001
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   15
   -420.53914167
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   15
   -420.53878178
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O   -1.97395243   -1.25474816   -0.11552633   -0.00664192    0.00516043   -0.00356722
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C    1.67205564    1.23327065   -0.09945932   -0.02139998   -0.01878227   -0.00701571
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   15
   -420.53826905
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C    0.38443069   -1.61087878    0.08447847   -0.00148751   -0.01469317   -0.00281440
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C    1.72380375   -1.23160876    0.05160848   -0.00335147    0.00728385    0.00512283
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H    2.43613700   -2.05426667   -0.05440616    0.00331740    0.00229717   -0.01040627
C    2.35216198    0.04394371    0.01097849    0.00744538    0.00251191    0.00708122
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   15
   -420.53768811
H   -2.61219260    0.41987186    0.06329470   -0.00253184   -0.00527174    0.00122150
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O   -1.97723578   -1.25079289   -0.11704631   -0.01237488    0.00555116   -0.00448301
C   -0.75632404    0.72426666   -0.01317195    0.04107590   -0.00152047   -0.01288604
C   -0.80835628   -0.79792394   -0.03163859    0.00616372   -0.02195864    0.00206108
C    0.32311503    1.57947745    0.00786273    0.02078118   -0.00000857    0.00583539
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C    1.66925675    1.23186295   -0.09710968   -0.03106564   -0.02655888   -0.00636377
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   15
   -420.53720666
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O   -1.97868327   -1.24890854   -0.11773257   -0.01504951    0.00579455   -0.00489272
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C    0.38065932   -1.60663488    0.08845730   -0.00353287   -0.01582206   -0.00181796
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   15
   -420.53692269
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O   -1.97996031   -1.24708997   -0.11836337   -0.01743504    0.00609954   -0.00524890
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C   -0.80190851   -0.80161373   -0.03219483    0.01935166   -0.02483732    0.00477705
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C    0.37884600   -1.60415673    0.09049171   -0.00442871   -0.01484493   -0.00138379
C    1.66830724    1.23203445   -0.09437092   -0.03496971   -0.02904128   -0.00656459
C    1.71425884   -1.21610310    0.04712305   -0.00673419    0.02088264    0.00046160
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   15
   -420.53691479
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O   -2.04738092    1.24569313    0.10228704   -0.04868898    0.01324650    0.00768335
O   -1.98103995   -1.24534066   -0.11893466   -0.01941579    0.00647541   -0.00555264
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C    1.66861392    1.23277230   -0.09285387   -0.03442333   -0.02806955   -0.00689075
C    1.71126180   -1.21147753    0.04558018   -0.00730246    0.02468935   -0.00142092
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C    2.35380261    0.04211243    0.00324501    0.00649164   -0.00867348    0.00724160
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   15
   -420.53709257
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O   -1.98189980   -1.24366488   -0.11944304   -0.02089530    0.00693552   -0.00578779
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C    2.35400449    0.04188907    0.00104089    0.00943668   -0.01032388    0.00737974
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   15
   -420.53738943
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O   -1.98252315   -1.24206787   -0.11988582   -0.02180245    0.00749400   -0.00595915
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C    0.37384734   -1.59551897    0.09669867   -0.00599206   -0.00638047   -0.00030673
C    1.67074939    1.23548014   -0.08950085   -0.02845345   -0.02202943   -0.00769907
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C    2.35406259    0.04182106   -0.00127481    0.01328208   -0.01137560    0.00753008
H    3.43583809    0.17445751    0.04766243    0.00211806    0.01406017    0.00342610
   15
   -420.53775514
H   -2.61333261    0.44037651    0.06955844    0.00289511    0.00661958    0.00148519
O   -2.03563877    1.23790330    0.10902273   -0.04594840    0.00744669    0.00882458
O   -1.98289978   -1.24055590   -0.12026104   -0.02208283    0.00811864   -0.00606605
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C   -0.79317810   -0.80438220   -0.03431067    0.03878085   -0.02756020    0.00896187
C    0.32611087    1.56720307   -0.00164611    0.02556578    0.00679436    0.00527019
C    0.37235442   -1.59238014    0.09878406   -0.00609144   -0.00266262    0.00013039
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C    1.70294694   -1.20001971    0.04120189   -0.00763681    0.03223819   -0.00750323
H    0.10394484    2.62664351    0.08997531    0.00385577   -0.00007679    0.00264848
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H    2.34912236   -2.08439336    0.07857645   -0.00377506   -0.00574138   -0.00270046
C    2.35391937    0.04192434   -0.00370434    0.01753252   -0.01184321    0.00767024
H    3.42789210    0.17357856    0.04646938   -0.00322296    0.01374265    0.00303352
   15
   -420.53807562
H   -2.61482033    0.44108100    0.06967943    0.00203870    0.00618604    0.00140732
O   -2.03065692    1.23511423    0.11107315   -0.04237666    0.00690555    0.00913215
O   -1.98302650   -1.23913617   -0.12056753   -0.02171283    0.00885150   -0.00609543
C   -0.75833722    0.69747515   -0.03870701    0.02436627   -0.01430225   -0.01921517
C   -0.79230718   -0.80404746   -0.03514351    0.04117959   -0.02734726    0.00962474
C    0.32523818    1.56497759   -0.00351019    0.02398643    0.00909908    0.00530653
C    0.37095337   -1.58920084    0.10086726   -0.00598803    0.00089768    0.00071413
C    1.67457979    1.23950086   -0.08568360   -0.01745640   -0.01225124   -0.00823982
C    1.70040645   -1.19713338    0.03992798   -0.00739543    0.03328307   -0.00951785
H    0.10075874    2.62043235    0.09146176    0.00419454   -0.00224436    0.00249158
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H    2.33765566   -2.08579851    0.10136343   -0.00513957   -0.00604435   -0.00131067
C    2.35351136    0.04220608   -0.00624978    0.02152314   -0.01178807    0.00775959
H    3.42052409    0.17022968    0.04473058   -0.00839305    0.01315436    0.00261781
   15
   -420.53837302
H   -2.61666555    0.44068425    0.06954788    0.00052509    0.00491200    0.00127398
O   -2.02519561    1.23224629    0.11302003   -0.03746646    0.00692565    0.00939309
O   -1.98290752   -1.23781692   -0.12080494   -0.02068137    0.00966024   -0.00605496
C   -0.76050793    0.69430790   -0.04127686    0.01994689   -0.01560535   -0.01955915
C   -0.79205739   -0.80329976   -0.03612166    0.04234943   -0.02670389    0.01010425
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   15
   -420.53875189
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   15
   -420.53931270
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   15
   -420.54005016
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   15
   -420.54088179
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   15
   -420.54162328
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   15
   -420.54207854
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   15
   -420.54208969
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   15
   -420.54165380
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   15
   -420.54084400
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   15
   -420.53979707
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   15
   -420.53869437
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   15
   -420.53761177
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O   -1.97259615   -1.23374278   -0.11919368    0.02158934    0.02041936   -0.00120033
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C    0.29605290    1.52631962   -0.03337812   -0.01790730   -0.01507710   -0.00162691
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   15
   -420.53662519
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   15
   -420.53569610
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O   -1.97223244   -1.23590976   -0.11846362    0.02622068    0.02012795   -0.00025705
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   15
   -420.53479104
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O   -1.97248460   -1.23733704   -0.11809158    0.02733638    0.01943289    0.00015397
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C   -0.83624633   -0.76281117   -0.06699402   -0.03063046    0.01728441    0.00068369
C    0.29139165    1.51951581   -0.04055078   -0.03060661   -0.01793031   -0.00336315
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C    1.71009247    1.28989826   -0.03948615    0.01357310    0.00279476    0.00011508
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C    2.32438325    0.05625887   -0.05805524    0.00019079    0.01019456   -0.00363954
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   15
   -420.53388053
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O   -1.97304603   -1.23898440   -0.11772125    0.02756712    0.01835068    0.00052826
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C   -0.83865075   -0.76027121   -0.06966175   -0.03335944    0.02047087   -0.00027381
C    0.29067882    1.51777505   -0.04285158   -0.03440987   -0.01858460   -0.00395138
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C    1.71148236    1.29432259   -0.03602304    0.01688700    0.01089300    0.00193499
C    1.67256942   -1.20589853    0.05609493   -0.01203134   -0.01034815   -0.01577297
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H    2.36601176   -1.99506624    0.35888744    0.00199520    0.00329024    0.01106936
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   15
   -420.53303325
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O   -1.97391933   -1.24083959   -0.11735685    0.02689202    0.01689431    0.00085981
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C   -0.84055222   -0.75804054   -0.07232539   -0.03491637    0.02347654   -0.00120193
C    0.29048558    1.51631552   -0.04509265   -0.03767973   -0.01944221   -0.00454897
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C    1.71261712    1.29858226   -0.03258928    0.02003602    0.01896492    0.00383571
C    1.67212812   -1.20740580    0.05961348   -0.01193720   -0.01307041   -0.01404396
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H    3.38687042   -0.07558946   -0.03953303   -0.01193892   -0.01252599    0.00010752
   15
   -420.53235443
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O   -1.97509689   -1.24288609   -0.11700216    0.02534297    0.01509072    0.00115178
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C   -0.84192720   -0.75616455   -0.07497089   -0.03529180    0.02624028   -0.00210269
C    0.29086112    1.51515041   -0.04726489   -0.04018707   -0.02067386   -0.00518246
C    0.34948183   -1.54295415    0.11888267    0.00587444    0.02126610    0.01339186
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H   -0.03049700    2.54307571    0.04160702   -0.00183744   -0.00750528    0.00027567
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C    2.32049788    0.05635437   -0.06784143    0.01640098    0.00538111   -0.00691569
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   15
   -420.53201117
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O   -1.97656118   -1.24510350   -0.11666052    0.02298233    0.01298906    0.00142285
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C   -0.84276997   -0.75468493   -0.07758462   -0.03451841    0.02868912   -0.00297842
C    0.29184303    1.51429848   -0.04935871   -0.04169074   -0.02238304   -0.00585707
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C    1.71394344    1.30613669   -0.02592354    0.02378511    0.03163799    0.00738268
C    1.67177906   -1.20979394    0.06725801   -0.01073215   -0.01724648   -0.01005767
H   -0.03559549    2.53964926    0.03593830   -0.00203535   -0.00835818    0.00007154
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C    2.31880339    0.05618797   -0.07091746    0.01837666    0.00365021   -0.00816279
H    3.37513450   -0.08410245   -0.05241386   -0.01799147   -0.01288755   -0.00002200
   15
   -420.53214002
H   -2.56273910    0.41311547    0.05693855   -0.00098475   -0.00386025   -0.00120970
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O   -1.97828552   -1.24746805   -0.11633498    0.01990790    0.01065941    0.00167103
C   -0.76224280    0.67177182   -0.04242292   -0.01730029    0.00570518   -0.00366483
C   -0.84309215   -0.75363860   -0.08015336   -0.03266681    0.03075228   -0.00382507
C    0.29345385    1.51378554   -0.05136393   -0.04201357   -0.02456267   -0.00656473
C    0.34606465   -1.54106258    0.11660294    0.00342477    0.02412453    0.01169741
C    1.71407948    1.30924169   -0.02274492    0.02343908    0.03472948    0.00881034
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   15
   -420.53271931
H   -2.56292710    0.40979584    0.05722724   -0.00248125   -0.00534367   -0.00129341
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O   -1.98023515   -1.24995338   -0.11602839    0.01624439    0.00817365    0.00190913
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C    0.29569833    1.51364439   -0.05326988   -0.04103126   -0.02708225   -0.00729122
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C    1.67207337   -1.21114970    0.07550851   -0.00839924   -0.01929505   -0.00561044
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H    2.40683056   -1.97282484    0.33933926    0.00663967    0.00766329    0.00760915
C    2.31460004    0.05571193   -0.07667960    0.01456120    0.00083930   -0.01074905
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   15
   -420.53359080
H   -2.56267698    0.40742917    0.05774797   -0.00338095   -0.00620660   -0.00131513
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O   -1.98236864   -1.25253136   -0.11574345    0.01213547    0.00561816    0.00213642
C   -0.75170937    0.67022408   -0.03971418   -0.00019290    0.00435502   -0.00338559
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C    1.67242032   -1.21139657    0.07977800   -0.00695648   -0.01941646   -0.00330735
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H    2.41191445   -1.97197113    0.33073030    0.00704796    0.00805203    0.00668768
C    2.31214814    0.05544477   -0.07932672    0.00939440   -0.00024019   -0.01200144
H    3.38026295   -0.07943104   -0.07172882   -0.00996782   -0.01305089    0.00001618
   15
   -420.53456043
H   -2.56182821    0.40616989    0.05850426   -0.00359354   -0.00637262   -0.00126542
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O   -1.98463952   -1.25517308   -0.11548273    0.00773283    0.00307359    0.00235943
C   -0.74637335    0.66934545   -0.03828210    0.00785856    0.00306361   -0.00327553
C   -0.84128461   -0.75337456   -0.08746392   -0.02188258    0.03390312   -0.00617106
C    0.30200847    1.51463011   -0.05674010   -0.03507883   -0.03211866   -0.00871506
C    0.34063589   -1.54092073    0.11189511   -0.00292393    0.02186018    0.00872554
C    1.71252569    1.31543261   -0.01407071    0.01266156    0.02947086    0.01149146
C    1.67287236   -1.21135060    0.08409747   -0.00543697   -0.01892197   -0.00098722
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H    2.33746626    2.18878785    0.08995741   -0.00283333   -0.00467068    0.00439624
H    2.41573129   -1.97256296    0.32091745    0.00733269    0.00815968    0.00575103
C    2.30955564    0.05518114   -0.08179248    0.00304578   -0.00122027   -0.01317381
H    3.38653124   -0.07317748   -0.07816969   -0.00423569   -0.01278101   -0.00001480
   15
   -420.53541888
H   -2.56034258    0.40604755    0.05948749   -0.00311065   -0.00582690   -0.00115352
O   -1.93543342    1.19015618    0.13726840    0.03168979   -0.01463742    0.00473593
O   -1.98699797   -1.25784976   -0.11524876    0.00318659    0.00061475    0.00257702
C   -0.74115522    0.66842094   -0.03680053    0.01516199    0.00141278   -0.00313886
C   -0.83993821   -0.75429764   -0.08972950   -0.01706575    0.03374732   -0.00687427
C    0.30598428    1.51583236   -0.05828294   -0.03024678   -0.03401695   -0.00935781
C    0.33886818   -1.54155981    0.11004136   -0.00547776    0.01989753    0.00763741
C    1.71153397    1.31654205   -0.01151179    0.00710783    0.02468614    0.01210220
C    1.67340657   -1.21101924    0.08843187   -0.00390042   -0.01783134    0.00131996
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H    3.39355897   -0.06462714   -0.08460718    0.00169853   -0.01218408   -0.00009617
   15
   -420.53604322
H   -2.55830608    0.40696455    0.06067729   -0.00199920   -0.00462018   -0.00097201
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O   -1.98939259   -1.26053354   -0.11504403   -0.00135177   -0.00170376    0.00279669
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C   -0.83833419   -0.75573018   -0.09189119   -0.01191609    0.03293325   -0.00753388
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C    0.33718333   -1.54249953    0.10807219   -0.00807163    0.01775954    0.00648301
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C    1.67399982   -1.21041893    0.09274635   -0.00241275   -0.01618802    0.00360084
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H    3.40028862   -0.05388823   -0.09102650    0.00710796   -0.01120484   -0.00023129
   15
   -420.53645391
H   -2.55591673    0.40870559    0.06204142   -0.00040175   -0.00288193   -0.00074715
O   -1.94049279    1.19307222    0.13825608    0.01546734   -0.01222827    0.00559529
O   -1.99177200   -1.26319817   -0.11487101   -0.00574230   -0.00383120    0.00300755
C   -0.73149920    0.66653853   -0.03369802    0.02679924   -0.00274838   -0.00270936
C   -0.83655018   -0.75765986   -0.09393903   -0.00661551    0.03146103   -0.00814510
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C    1.67462968   -1.20957446    0.09700643   -0.00103229   -0.01405285    0.00584210
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H    2.41915063   -1.98292099    0.28593872    0.00764693    0.00661353    0.00296880
C    2.30189762    0.05456163   -0.08793220   -0.01509831   -0.00437924   -0.01605191
H    3.40575447   -0.04113778   -0.09740365    0.01143660   -0.00983698   -0.00040699
   15
   -420.53667587
H   -2.55345896    0.41096067    0.06353959    0.00146484   -0.00081714   -0.00049130
O   -1.94333235    1.19474422    0.13865701    0.00730391   -0.01163543    0.00589360
O   -1.99408651   -1.26581955   -0.11473209   -0.00986859   -0.00573037    0.00320894
C   -0.72723707    0.66564337   -0.03208358    0.03097956   -0.00511646   -0.00239187
C   -0.83466613   -0.76006445   -0.09586378   -0.00133481    0.02935780   -0.00870740
C    0.32028286    1.52256973   -0.06202951   -0.01050772   -0.03415964   -0.01084180
C    0.33421697   -1.54515547    0.10385902   -0.01282918    0.01423224    0.00386991
C    1.70824656    1.31792656   -0.00497066   -0.00824125    0.01132151    0.01410104
C    1.67527529   -1.20851798    0.10117823    0.00022848   -0.01152340    0.00803499
H   -0.05283965    2.55296079   -0.00875109   -0.00778980    0.00161365   -0.00044473
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C    2.29968832    0.05446533   -0.08951126   -0.01897085   -0.00555350   -0.01679709
H    3.40918189   -0.02662260   -0.10370716    0.01433881   -0.00808683   -0.00060946
   15
   -420.53682457
H   -2.55126468    0.41336231    0.06512593    0.00332428    0.00128920   -0.00022932
O   -1.94625516    1.19654828    0.13899115   -0.00042997   -0.01115015    0.00613351
O   -1.99628942   -1.26837617   -0.11462958   -0.01362769   -0.00737474    0.00340071
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C   -0.83276170   -0.76291221   -0.09765692    0.00377154    0.02666996   -0.00922835
C    0.32550843    1.52586113   -0.06295947   -0.00302908   -0.03194160   -0.01117812
C    0.33300708   -1.54681898    0.10165459   -0.01473325    0.01335623    0.00235885
C    1.70730375    1.31796356   -0.00320243   -0.01175046    0.00869693    0.01489642
C    1.67591767   -1.20728757    0.10522855    0.00132251   -0.00872859    0.01019974
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H    2.41458542   -1.99592276    0.25966908    0.00740439    0.00422574    0.00117152
C    2.29776387    0.05445298   -0.09083646   -0.02123083   -0.00672056   -0.01744882
H    3.41005165   -0.01065595   -0.10990101    0.01559709   -0.00604582   -0.00081004
   15
   -420.53697425
H   -2.54966445    0.41553580    0.06675388    0.00488261    0.00312065    0.00000548
O   -1.94917380    1.19847867    0.13925575   -0.00739971   -0.01049657    0.00632821
O   -1.99833815   -1.27084938   -0.11456561   -0.01693669   -0.00875825    0.00357243
C   -0.72016136    0.66412265   -0.02875224    0.03621912   -0.01005415   -0.00156325
C   -0.83091389   -0.76616259   -0.09931058    0.00854515    0.02347580   -0.00971082
C    0.33077978    1.52963411   -0.06372052    0.00449075   -0.02861268   -0.01143919
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C    1.70653720    1.31786753   -0.00165951   -0.01409495    0.00732902    0.01573941
C    1.67654016   -1.20592538    0.10912479    0.00229747   -0.00577181    0.01228667
H   -0.04564950    2.55859835   -0.01936183   -0.00767378    0.00136769   -0.00075987
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C    2.29615839    0.05454211   -0.09189794   -0.02180728   -0.00779018   -0.01802598
H    3.40813817    0.00639583   -0.11594911    0.01513458   -0.00379386   -0.00099375
   15
   -420.53710507
H   -2.54893496    0.41715623    0.06838191    0.00587051    0.00435570    0.00018090
O   -1.95200947    1.20052768    0.13944859   -0.01329694   -0.00937467    0.00650837
O   -2.00019523   -1.27322348   -0.11454216   -0.01973399   -0.00987475    0.00372612
C   -0.71742722    0.66357153   -0.02704785    0.03747238   -0.01246952   -0.00106707
C   -0.82919471   -0.76976741   -0.10081744    0.01285142    0.01986426   -0.01016606
C    0.33598352    1.53383853   -0.06430867    0.01177138   -0.02431018   -0.01164493
C    0.33127573   -1.55075236    0.09716426   -0.01712463    0.01375186   -0.00108276
C    1.70598223    1.31765914   -0.00035456   -0.01517575    0.00725106    0.01658978
C    1.67712806   -1.20447595    0.11283533    0.00313188   -0.00278533    0.01432094
H   -0.03996787    2.56102077   -0.02447681   -0.00711215    0.00029847   -0.00095065
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H    2.40472422   -2.01193746    0.23256449    0.00656343    0.00130033   -0.00064940
C    2.29488061    0.05474877   -0.09268696   -0.02070280   -0.00866879   -0.01854057
H    3.40352427    0.02412876   -0.12181887    0.01297903   -0.00143220   -0.00113545
   15
   -420.53715307
H   -2.54925130    0.41800443    0.06997826    0.00610031    0.00477153    0.00029624
O   -1.95469547    1.20268241    0.13956759   -0.01791454   -0.00758049    0.00669258
O   -2.00182897   -1.27548580   -0.11456095   -0.02198080   -0.01073223    0.00385972
C   -0.71525875    0.66320880   -0.02532735    0.03797762   -0.01476567   -0.00053584
C   -0.82766912   -0.77367218   -0.10217062    0.01656902    0.01594119   -0.01060432
C    0.34100982    1.53840959   -0.06472083    0.01861339   -0.01924290   -0.01180207
C    0.33079035   -1.55302789    0.09493030   -0.01755670    0.01475067   -0.00294983
C    1.70565511    1.31733967    0.00069958   -0.01495501    0.00838538    0.01741392
C    1.67766874   -1.20298433    0.11632946    0.00386706    0.00011340    0.01627720
H   -0.03301054    2.56339670   -0.02942064   -0.00625181   -0.00126798   -0.00114251
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H    2.33843193    2.22363429    0.04778365    0.00362070    0.01268585    0.00330704
H    2.39797938   -2.02043075    0.21910654    0.00584697   -0.00016631   -0.00154465
C    2.29391399    0.05508615   -0.09319571   -0.01805417   -0.00925879   -0.01900482
H    3.39659621    0.04211927   -0.12748503    0.00927206    0.00093800   -0.00121888
   15
   -420.53701111
H   -2.55065407    0.41800681    0.07152229    0.00552079    0.00427951    0.00034203
O   -1.95717950    1.20492244    0.13961068   -0.02117858   -0.00505200    0.00688411
O   -2.00321389   -1.27762661   -0.11462350   -0.02365732   -0.01133737    0.00397043
C   -0.71366373    0.66306913   -0.02359879    0.03785314   -0.01689063    0.00001967
C   -0.82639322   -0.77781774   -0.10336347    0.01959968    0.01181778   -0.01103690
C    0.34575542    1.54327102   -0.06495457    0.02485133   -0.01370510   -0.01192614
C    0.33056986   -1.55552667    0.09274096   -0.01751149    0.01592047   -0.00483409
C    1.70555258    1.31689217    0.00149052   -0.01349864    0.01054455    0.01816357
C    1.67815103   -1.20149418    0.11957761    0.00453450    0.00282844    0.01814569
H   -0.02493099    2.56600509   -0.03415884   -0.00516699   -0.00313076   -0.00132518
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H    2.39018547   -2.02889538    0.20592701    0.00489756   -0.00152653   -0.00243745
C    2.29321879    0.05556305   -0.09341718   -0.01414610   -0.00946355   -0.01942270
H    3.38801708    0.05994229   -0.13293276    0.00431507    0.00321536   -0.00123533
   15
   -420.53656259
H   -2.55304019    0.41725055    0.07300502    0.00421329    0.00297386    0.00033556
O   -1.95942447    1.20721916    0.13957566   -0.02315935   -0.00187125    0.00707294
O   -2.00433099   -1.27963904   -0.11473107   -0.02475838   -0.01170142    0.00405918
C   -0.71264041    0.66318456   -0.02187053    0.03719571   -0.01879717    0.00058199
C   -0.82541273   -0.78214188   -0.10438944    0.02186853    0.00760861   -0.01147271
C    0.35012610    1.54833947   -0.06500802    0.03039139   -0.00802224   -0.01202471
C    0.33061365   -1.55826602    0.09062461   -0.01706015    0.01695171   -0.00664179
C    1.70565290    1.31628444    0.00200698   -0.01100357    0.01336494    0.01879158
C    1.67856480   -1.20004642    0.12255168    0.00517343    0.00526413    0.01987192
H   -0.01592326    2.56917780   -0.03865870   -0.00395409   -0.00503634   -0.00148727
H    0.04577015   -2.58980675    0.30615862   -0.00830987    0.00171531    0.00303431
H    2.32925790    2.20913143    0.02981258   -0.00348062    0.00416911    0.00214930
H    2.38151308   -2.03708728    0.19318601    0.00372622   -0.00271158   -0.00330740
C    2.29273650    0.05618248   -0.09334506   -0.00945294   -0.00920839   -0.01978256
H    3.37867216    0.07718877   -0.13815948   -0.00139561    0.00532301   -0.00117932
   15
   -420.53581210
H   -2.55617749    0.41596746    0.07442793    0.00239697    0.00107601    0.00028333
O   -1.96140773    1.20953676    0.13946043   -0.02404504    0.00169422    0.00723666
O   -2.00516775   -1.28151894   -0.11488467   -0.02529603   -0.01183366    0.00412507
C   -0.71217893    0.66358390   -0.02015106    0.03608950   -0.02045239    0.00113602
C   -0.82476190   -0.78658107   -0.10524192    0.02332448    0.00341053   -0.01192366
C    0.35403820    1.55352948   -0.06487968    0.03518326   -0.00256346   -0.01210552
C    0.33091493   -1.56126108    0.08860854   -0.01628394    0.01752196   -0.00829846
C    1.70591875    1.31547448    0.00223952   -0.00781181    0.01630539    0.01925552
C    1.67890033   -1.19867782    0.12522543    0.00581530    0.00737120    0.02146870
H   -0.00620409    2.57325360   -0.04289117   -0.00271637   -0.00667819   -0.00162078
H    0.04049704   -2.59301219    0.31296726   -0.00969953    0.00000239    0.00403838
H    2.32527242    2.20034165    0.02019489   -0.00744891   -0.00092005    0.00167338
H    2.37217317   -2.04479465    0.18103945    0.00231840   -0.00366903   -0.00413216
C    2.29239712    0.05694048   -0.09297394   -0.00468762   -0.00844377   -0.02005886
H    3.36958089    0.09348033   -0.14317484   -0.00720646    0.00720156   -0.00107268
   15
   -420.53492792
H   -2.55974297    0.41449480    0.07579863    0.00035093   -0.00110827    0.00023872
O   -1.96311899    1.21183507    0.13926314   -0.02409192    0.00532572    0.00735674
O   -2.00571805   -1.28326478   -0.11508507   -0.02529800   -0.01175599    0.00417844
C   -0.71226263    0.66429215   -0.01844875    0.03457963   -0.02183238    0.00167304
C   -0.82446271   -0.79107196   -0.10591412    0.02394844   -0.00067557   -0.01238960
C    0.35741938    1.55875896   -0.06456835    0.03920139    0.00230529   -0.01216337
C    0.33146196   -1.56452033    0.08671769   -0.01522478    0.01744712   -0.00972523
C    1.70630251    1.31441871    0.00218113   -0.00444052    0.01864282    0.01953775
C    1.67914793   -1.19742028    0.12757478    0.00647409    0.00913563    0.02289148
H    0.00400591    2.57852574   -0.04683210   -0.00157237   -0.00780794   -0.00172654
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H    2.32262259    2.19171252    0.01027447   -0.01104310   -0.00566745    0.00130156
H    2.36241891   -2.05184557    0.16963617    0.00071514   -0.00437387   -0.00491765
C    2.29212945    0.05782555   -0.09229970   -0.00060975   -0.00719065   -0.02020856
H    3.36177609    0.10847915   -0.14799737   -0.01226288    0.00884884   -0.00095739
   15
   -420.53405434
H   -2.56337271    0.41322137    0.07712679   -0.00163496   -0.00326001    0.00018308
O   -1.96455750    1.21407325    0.13898247   -0.02356113    0.00867782    0.00740677
O   -2.00598185   -1.28487746   -0.11533284   -0.02479087   -0.01146973    0.00421327
C   -0.71286872    0.66533013   -0.01677170    0.03269724   -0.02290878    0.00218115
C   -0.82452460   -0.79555287   -0.10639895    0.02373904   -0.00457355   -0.01287888
C    0.36020875    1.56395464   -0.06407314    0.04247581    0.00630487   -0.01219423
C    0.33223902   -1.56804236    0.08497350   -0.01401361    0.01654012   -0.01085033
C    1.70675386    1.31308271    0.00182755   -0.00145649    0.01960698    0.01964448
C    1.67929760   -1.19630044    0.12957825    0.00716416    0.01054098    0.02411543
H    0.01450141    2.58519226   -0.05046257   -0.00059667   -0.00815684   -0.00180458
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H    3.35615659    0.12189043   -0.15264724   -0.01577703    0.01024216   -0.00088057
   15
   -420.53339736
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O   -2.00596486   -1.28636020   -0.11562841   -0.02381477   -0.01099633    0.00423674
C   -0.71396880    0.66671412   -0.01512758    0.03046910   -0.02366643    0.00265342
C   -0.82494443   -0.79996492   -0.10668905    0.02271989   -0.00821954   -0.01338519
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C    1.70722828    1.31145271    0.00117711    0.00063209    0.01855839    0.01961973
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H    2.32371519    2.17810928   -0.01022384   -0.01489621   -0.01114607    0.00081237
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   15
   -420.53310778
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O   -2.00567813   -1.28771837   -0.11597202   -0.02240870   -0.01034736    0.00425135
C   -0.71552915    0.66845552   -0.01352354    0.02789086   -0.02408175    0.00308764
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C    1.70769462    1.30954492    0.00023011    0.00150865    0.01520663    0.01952747
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   15
   -420.53317817
H   -2.57141948    0.41410817    0.08091495   -0.00498243   -0.00705265    0.00024122
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O   -2.00513755   -1.28895931   -0.11636385   -0.02061571   -0.00954290    0.00425948
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C    0.36458739    1.57881599   -0.06148324    0.04771191    0.01199365   -0.01196973
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C    1.70813961    1.30740981   -0.00101215    0.00118521    0.00973332    0.01943569
C    1.67905477   -1.19395440    0.13334546    0.00911803    0.01284758    0.02640982
H    0.04614210    2.61335366   -0.05936102    0.00109264   -0.00389826   -0.00198446
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C    2.29094933    0.06216806   -0.08657551   -0.00314439    0.00128307   -0.01846168
H    3.35671337    0.15021028   -0.16558534   -0.01309156    0.01351748   -0.00144303
   15
   -420.53350364
H   -2.57248725    0.41672744    0.08210019   -0.00481982   -0.00696611    0.00033992
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O   -2.00436344   -1.29009211   -0.11680399   -0.01847943   -0.00860939    0.00426004
C   -0.71986958    0.67303013   -0.01046124    0.02171917   -0.02381783    0.00382164
C   -0.82814145   -0.81226075   -0.10631338    0.01536185   -0.01720673   -0.01495726
C    0.36462935    1.58343204   -0.06025566    0.04774883    0.01216027   -0.01174384
C    0.33726507   -1.58428842    0.07972479   -0.00868610    0.00478708   -0.01189399
C    1.70856781    1.30512935   -0.00254832   -0.00004913    0.00275621    0.01938420
C    1.67871058   -1.19354905    0.13381494    0.00952987    0.01312083    0.02668478
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H    2.34431201    2.17151242   -0.04195649   -0.00879430   -0.00499537   -0.00005880
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C    2.29067479    0.06329392   -0.08442062   -0.00821694    0.00385272   -0.01735493
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   15
   -420.53389937
H   -2.57269730    0.42059014    0.08322390   -0.00395262   -0.00614740    0.00046770
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O   -2.00337998   -1.29112735   -0.11729244   -0.01604399   -0.00757239    0.00425388
C   -0.72255637    0.67585929   -0.00901409    0.01815394   -0.02310683    0.00411863
C   -0.82972954   -0.81589499   -0.10574645    0.01174081   -0.01947691   -0.01546408
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C    1.70899727    1.30280802   -0.00437761   -0.00172183   -0.00487447    0.01937730
C    1.67822262   -1.19334187    0.13388125    0.00967875    0.01322530    0.02671481
H    0.06641179    2.63608356   -0.06352217    0.00165077    0.00173652   -0.00214211
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H    2.35506308    2.17187488   -0.05259446   -0.00457803   -0.00059826   -0.00052932
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C    2.29052510    0.06436150   -0.08200353   -0.01377309    0.00647266   -0.01607383
H    3.36915443    0.15726886   -0.17295786   -0.00321145    0.01477666   -0.00254857
   15
   -420.53430220
H   -2.57220461    0.42554981    0.08426307   -0.00247788   -0.00465319    0.00061619
O   -1.96797292    1.22468637    0.13558563   -0.01734736    0.01165087    0.00586543
O   -2.00221475   -1.29207676   -0.11782914   -0.01336188   -0.00646595    0.00423799
C   -0.72551735    0.67903736   -0.00762913    0.01432817   -0.02200147    0.00436145
C   -0.83149465   -0.81923519   -0.10494575    0.00770100   -0.02138179   -0.01593883
C    0.36256454    1.59211739   -0.05727298    0.04495080    0.01154303   -0.01101743
C    0.34064722   -1.59305408    0.07817584   -0.00608272   -0.00365978   -0.01070989
C    1.70945270    1.30056014   -0.00649992   -0.00333733   -0.01228372    0.01939159
C    1.67758870   -1.19333453    0.13354393    0.00948829    0.01320706    0.02650597
H    0.07612166    2.64724190   -0.06503173    0.00204824    0.00452551   -0.00223989
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H    2.36663554    2.17234571   -0.06313654   -0.00016798    0.00376030   -0.00105346
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C    2.29058318    0.06533119   -0.07934356   -0.01896833    0.00910365   -0.01468376
H    3.37671555    0.15685894   -0.17600911    0.00203444    0.01495178   -0.00319114
   15
   -420.53468796
H   -2.57127266    0.43133978    0.08519066   -0.00054382   -0.00263353    0.00078645
O   -1.96778362    1.22593254    0.13476137   -0.01621665    0.00893478    0.00535163
O   -2.00089812   -1.29295286   -0.11841391   -0.01048979   -0.00532269    0.00421140
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C   -0.83337583   -0.82225255   -0.10390412    0.00335300   -0.02292939   -0.01636228
C    0.36050025    1.59619535   -0.05552884    0.04206498    0.01133320   -0.01052196
C    0.34248605   -1.59738619    0.07764920   -0.00474329   -0.00748551   -0.00993783
C    1.70995803    1.29849679   -0.00891538   -0.00450031   -0.01871593    0.01937367
C    1.67681183   -1.19352677    0.13280614    0.00887259    0.01310371    0.02605776
H    0.08546205    2.65759199   -0.06613800    0.00255148    0.00688651   -0.00234217
H    0.08060185   -2.61789388    0.32982580   -0.00692152    0.00730910    0.00552909
H    2.37824289    2.17214904   -0.07348829    0.00391420    0.00748012   -0.00159320
H    2.30647508   -2.07814851    0.11901395   -0.01113274   -0.00385995   -0.00802155
C    2.29092680    0.06616333   -0.07646160   -0.02313113    0.01166299   -0.01327461
H    3.38392049    0.15376274   -0.17848624    0.00659630    0.01475211   -0.00380926
   15
   -420.53511895
H   -2.57024691    0.43760056    0.08597682    0.00163562   -0.00033598    0.00094270
O   -1.96741059    1.22707789    0.13387644   -0.01485414    0.00566751    0.00480164
O   -1.99946262   -1.29376860   -0.11904644   -0.00749374   -0.00418260    0.00416862
C   -0.73202737    0.68636711   -0.00505971    0.00610008   -0.01856484    0.00467863
C   -0.83530749   -0.82492363   -0.10261519   -0.00117888   -0.02413699   -0.01671838
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C    0.34439651   -1.60160601    0.07727281   -0.00333408   -0.01057590   -0.00916332
C    1.71053049    1.29671460   -0.01162365   -0.00492852   -0.02364008    0.01927060
C    1.67590138   -1.19391705    0.13167465    0.00777976    0.01293856    0.02537603
H    0.09434088    2.66671144   -0.06682270    0.00321859    0.00859715   -0.00243816
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H    2.38915482    2.17062230   -0.08355401    0.00732602    0.01011168   -0.00206809
H    2.30638867   -2.07795660    0.11881464   -0.01128832   -0.00390363   -0.00795981
C    2.29161830    0.06681934   -0.07337887   -0.02576406    0.01404638   -0.01191438
H    3.38995443    0.14801651   -0.18027885    0.01002245    0.01415332   -0.00434211
   15
   -420.53571730
H   -2.56951424    0.44392162    0.08659253    0.00371125    0.00200170    0.00110744
O   -1.96686947    1.22815912    0.13293702   -0.01305016    0.00222545    0.00425055
O   -1.99794216   -1.29453685   -0.11972622   -0.00445021   -0.00310873    0.00409896
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C   -0.83722125   -0.82723016   -0.10107358   -0.00577208   -0.02501927   -0.01698630
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C    1.71117643    1.29528758   -0.01462311   -0.00450005   -0.02671077    0.01902998
C    1.67487388   -1.19450284    0.13015976    0.00619817    0.01270273    0.02446053
H    0.10263791    2.67429407   -0.06706855    0.00404167    0.00952899   -0.00252311
H    0.10775692   -2.63016634    0.32179919   -0.00413461    0.00846841    0.00521024
H    2.39876132    2.16729475   -0.09324775    0.00981580    0.01142038   -0.00246668
H    2.30832773   -2.07705986    0.12004678   -0.01097750   -0.00409144   -0.00779202
C    2.29269713    0.06726330   -0.07011589   -0.02656435    0.01615861   -0.01064988
H    3.39420440    0.13972727   -0.18129168    0.01203938    0.01319436   -0.00474674
   15
   -420.53652759
H   -2.56944442    0.44988800    0.08700925    0.00541003    0.00396321    0.00123622
O   -1.96618092    1.22921497    0.13194937   -0.01058184   -0.00105562    0.00371076
O   -1.99637117   -1.29526976   -0.12045249   -0.00145968   -0.00212662    0.00400350
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C   -0.83904785   -0.82915879   -0.09927528   -0.01028451   -0.02559428   -0.01714498
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C    0.34834559   -1.60953811    0.07692518   -0.00024517   -0.01361319   -0.00783572
C    1.71188931    1.29426192   -0.01791005   -0.00317512   -0.02774345    0.01860008
C    1.67375327   -1.19528062    0.12827533    0.00413939    0.01238866    0.02330796
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H    0.12257685   -2.63855531    0.31636708   -0.00281936    0.00764816    0.00526565
H    2.40661645    2.16193208   -0.10249941    0.01123113    0.01130063   -0.00271988
H    2.31223674   -2.07542485    0.12268009   -0.01022450   -0.00439178   -0.00751335
C    2.29417522    0.06746344   -0.06669175   -0.02539344    0.01788057   -0.00950453
H    3.39630918    0.12906804   -0.18145232    0.01251640    0.01188603   -0.00498309
   15
   -420.53748943
H   -2.57033838    0.45515063    0.08720398    0.00641273    0.00524942    0.00132306
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O   -1.99478349   -1.29597841   -0.12122413    0.00137698   -0.00128266    0.00387494
C   -0.74232325    0.69935979   -0.00173541   -0.00637555   -0.01036884    0.00465757
C   -0.84071923   -0.83070081   -0.09721791   -0.01457327   -0.02586804   -0.01717624
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C    0.35033759   -1.61320464    0.07693388    0.00137707   -0.01342546   -0.00730937
C    1.71264917    1.29365320   -0.02147792   -0.00099083   -0.02670304    0.01794543
C    1.67257061   -1.19624558    0.12603879    0.00165946    0.01196068    0.02191241
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C    2.29603485    0.06739382   -0.06312373   -0.02224028    0.01912501   -0.00850102
H    3.39618328    0.11627297   -0.18071816    0.01143818    0.01029448   -0.00504271
   15
   -420.53854180
H   -2.57237365    0.45948096    0.08716123    0.00651268    0.00565772    0.00135889
O   -1.96448379    1.23139175    0.12985338   -0.00299094   -0.00572648    0.00275633
O   -1.99321118   -1.29667235   -0.12203969    0.00394302   -0.00062224    0.00370792
C   -0.74564514    0.70406440   -0.00076918   -0.01016818   -0.00687429    0.00450152
C   -0.84217069   -0.83185208   -0.09490103   -0.01850280   -0.02584594   -0.01706333
C    0.34199054    1.61384243   -0.04461535    0.01580972    0.01713901   -0.00690369
C    0.35230878   -1.61666932    0.07705315    0.00297879   -0.01228155   -0.00683391
C    1.71342310    1.29344574   -0.02531678    0.00196329   -0.02365696    0.01703262
C    1.67136325   -1.19739119    0.12347121   -0.00114765    0.01138203    0.02027370
H    0.12244555    2.68692286   -0.06504164    0.00713668    0.00735543   -0.00262812
H    0.15351562   -2.65911018    0.30262208   -0.00032845    0.00338658    0.00568421
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   15
   -420.53950460
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O   -1.99168324   -1.29735903   -0.12289727    0.00612101   -0.00018959    0.00349686
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   15
   -420.54017758
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   15
   -420.54046698
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O   -1.98885330   -1.29872720   -0.12472836    0.00889014   -0.00011819    0.00292804
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C    1.71534076    1.29464559   -0.03830115    0.01357200   -0.00557000    0.01275424
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C    2.30595134    0.06417251   -0.04769119    0.00495123    0.01822036   -0.00535290
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   15
   -420.54039596
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O   -1.98758256   -1.29940945   -0.12569542    0.00931661   -0.00051351    0.00256387
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C   -0.84471962   -0.83262198   -0.08310969   -0.02791736   -0.02284355   -0.01493549
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C    1.71565106    1.29535039   -0.04304675    0.01720653    0.00153540    0.01095599
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C    2.30853499    0.06264858   -0.04360229    0.01251669    0.01652569   -0.00446948
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   15
   -420.54006290
H   -2.59499255    0.46975323    0.08340133   -0.00311088   -0.00188279    0.00105441
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O   -1.98641687   -1.30008562   -0.12669151    0.00904645   -0.00119751    0.00214048
C   -0.75901903    0.72793145    0.00313215   -0.02236400    0.01424078    0.00251746
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C    1.71570239    1.29603291   -0.04795793    0.01986644    0.00786709    0.00911655
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C    2.31093091    0.06087527   -0.03944605    0.01879936    0.01439672   -0.00338346
H    3.37433545    0.01261154   -0.15898333   -0.01174987   -0.00138632   -0.00280384
   15
   -420.53964646
H   -2.59952893    0.47148597    0.08201805   -0.00505358   -0.00326251    0.00098163
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C   -0.76078781    0.73232567    0.00376850   -0.02302794    0.01865682    0.00187835
C   -0.84358374   -0.83087996   -0.07582173   -0.02764624   -0.01965110   -0.01281145
C    0.31317599    1.62601738   -0.02829434   -0.02095369    0.02442957   -0.00072027
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C    1.71545516    1.29659840   -0.05300703    0.02104681    0.01264108    0.00734388
C    1.66606013   -1.20737636    0.10274943   -0.01717725    0.00429804    0.00590291
H    0.12340012    2.68829672   -0.04854014    0.01024438   -0.00341850   -0.00219500
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C    2.31304502    0.05888462   -0.03523897    0.02310031    0.01197741   -0.00203627
H    3.37393915   -0.00585757   -0.15312863   -0.01313147   -0.00331006   -0.00256717
   15
   -420.53931368
H   -2.60316486    0.47379654    0.08045843   -0.00635009   -0.00399138    0.00091241
O   -1.96088310    1.24117023    0.12171147    0.03341721   -0.00543242    0.00119313
O   -1.98438046   -1.30138580   -0.12875101    0.00645369   -0.00333333    0.00112989
C   -0.76220923    0.73643802    0.00437651   -0.02302508    0.02290098    0.00117054
C   -0.84238593   -0.82955063   -0.07187886   -0.02622251   -0.01770370   -0.01149890
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C    1.71489189    1.29697529   -0.05816736    0.02044277    0.01534660    0.00571934
C    1.66588168   -1.20939129    0.09874879   -0.01849667    0.00279512    0.00302723
H    0.11724557    2.68931583   -0.04430867    0.00965344   -0.00309114   -0.00208511
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H    2.39686686   -2.02193552    0.19431591    0.00431293   -0.00098604   -0.00031878
C    2.31481274    0.05671302   -0.03100143    0.02507588    0.00941823   -0.00040877
H    3.37587682   -0.02373080   -0.14680865   -0.01247768   -0.00525323   -0.00252947
   15
   -420.53909327
H   -2.60566920    0.47681501    0.07873390   -0.00684974   -0.00398675    0.00086928
O   -1.96147493    1.24283449    0.12048150    0.03522365   -0.00594914    0.00115085
O   -1.98348046   -1.30198560   -0.12980294    0.00425154   -0.00471780    0.00053867
C   -0.76328332    0.74020445    0.00496690   -0.02236380    0.02686702    0.00039571
C   -0.84079260   -0.82795386   -0.06776231   -0.02402631   -0.01557042   -0.01003349
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C    0.36501666   -1.63993007    0.08086481    0.00761602   -0.00597924    0.00094488
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C    1.66598224   -1.21144859    0.09470244   -0.01924568    0.00136217    0.00012732
H    0.10935811    2.69087952   -0.03970199    0.00871001   -0.00192692   -0.00196768
H    0.26087735   -2.72687610    0.20686450    0.01017098   -0.00897326    0.00288665
H    2.41564759    2.09534318   -0.17413200   -0.00290768   -0.01706039   -0.00023414
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C    2.31620398    0.05439926   -0.02675809    0.02482283    0.00679631    0.00144398
H    3.38003523   -0.04065406   -0.14003300   -0.00994413   -0.00726225   -0.00264055
   15
   -420.53891916
H   -2.60695269    0.48053991    0.07685240   -0.00650359   -0.00321613    0.00084729
O   -1.96246491    1.24456665    0.11923845    0.03548682   -0.00689864    0.00114459
O   -1.98262825   -1.30253175   -0.13086095    0.00157831   -0.00624735   -0.00010413
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C   -0.83883680   -0.82612182   -0.06349421   -0.02117743   -0.01331365   -0.00843563
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C    1.71287968    1.29703303   -0.06872612    0.01434100    0.01445760    0.00297135
C    1.66637311   -1.21352668    0.09065415   -0.01941962    0.00007176   -0.00274690
H    0.09990763    2.69278090   -0.03474194    0.00743229   -0.00012297   -0.00181723
H    0.26852207   -2.72855104    0.19122769    0.01125237   -0.00713079    0.00186337
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H    2.41455306   -2.00382117    0.21539102    0.00596836    0.00262904    0.00174066
C    2.31722203    0.05198292   -0.02253683    0.02278137    0.00416675    0.00343548
H    3.38596544   -0.05626587   -0.13278258   -0.00600571   -0.00931055   -0.00283956
   15
   -420.53866868
H   -2.60707697    0.48483349    0.07481798   -0.00536736   -0.00171395    0.00085126
O   -1.96385602    1.24637740    0.11798238    0.03422149   -0.00821112    0.00117241
O   -1.98179366   -1.30300694   -0.13191772   -0.00142854   -0.00786610   -0.00079372
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C   -0.83656143   -0.82408856   -0.05909872   -0.01780716   -0.01098822   -0.00672274
C    0.29890269    1.62718829   -0.01697925   -0.03344705    0.01270245    0.00356835
C    0.36705603   -1.64491854    0.08205484    0.00616561   -0.01157480    0.00392068
C    1.71152183    1.29672623   -0.07408291    0.00978848    0.01173352    0.00175981
C    1.66705695   -1.21560610    0.08664730   -0.01905510   -0.00100907   -0.00554749
H    0.08912261    2.69469928   -0.02945515    0.00591016    0.00203752   -0.00164162
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H    2.42185112   -1.99530515    0.22555119    0.00636610    0.00457548    0.00270367
C    2.31789701    0.04950359   -0.01836757    0.01961294    0.00155431    0.00546116
H    3.39296597   -0.07020239   -0.12502065   -0.00131577   -0.01126859   -0.00306717
   15
   -420.53823618
H   -2.60624529    0.48942931    0.07263032   -0.00355269    0.00029772    0.00087312
O   -1.96563406    1.24828147    0.11671298    0.03158092   -0.00971999    0.00123453
O   -1.98094267   -1.30339291   -0.13296545   -0.00462829   -0.00950401   -0.00152394
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C   -0.83401720   -0.82188913   -0.05460171   -0.01409273   -0.00867052   -0.00492067
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C    1.71001615    1.29624278   -0.07946630    0.00509211    0.00836291    0.00055311
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H    0.07727614    2.69625040   -0.02387320    0.00420833    0.00423255   -0.00143216
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H    2.41930644    2.11863033   -0.19278915    0.00702786   -0.00355993   -0.00172686
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C    2.31827593    0.04700080   -0.01428078    0.01603225   -0.00108186    0.00740956
H    3.40020340   -0.08211272   -0.11670748    0.00340954   -0.01304818   -0.00323986
   15
   -420.53765008
H   -2.60477931    0.49396528    0.07028545   -0.00133393    0.00265337    0.00090716
O   -1.96776932    1.25029579    0.11542956    0.02782586   -0.01120508    0.00132759
O   -1.98003915   -1.30367110   -0.13399586   -0.00786967   -0.01111041   -0.00227894
C   -0.76444102    0.75071103    0.00739816   -0.01414512    0.03789761   -0.00316672
C   -0.83126016   -0.81955851   -0.05003037   -0.01017601   -0.00642502   -0.00305056
C    0.29463674    1.62640987   -0.01158097   -0.03496404    0.00582123    0.00532928
C    0.36872419   -1.64920071    0.08300945    0.00435655   -0.01835818    0.00660455
C    1.70843301    1.29563282   -0.08485790    0.00081309    0.00499231   -0.00073012
C    1.66927480   -1.21970808    0.07892539   -0.01701794   -0.00229384   -0.01077881
H    0.06467327    2.69704393   -0.01803400    0.00240013    0.00613526   -0.00118239
H    0.27871782   -2.72768349    0.14304067    0.01324588    0.00048364   -0.00107887
H    2.41885901    2.12888494   -0.19851906    0.01015338    0.00146579   -0.00224603
H    2.43299459   -1.98108608    0.24425043    0.00643624    0.00825225    0.00446714
C    2.31841217    0.04451443   -0.01030583    0.01266018   -0.00376882    0.00920300
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   15
   -420.53703661
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   15
   -420.53652780
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   15
   -420.53629109
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C    1.70379245    1.29350883   -0.10087892   -0.00599240   -0.00111406   -0.00537411
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   15
   -420.53643872
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C    1.70239584    1.29280486   -0.10608996   -0.00579419   -0.00110346   -0.00721221
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   15
   -420.53684762
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O   -1.97352109   -1.30285491   -0.13858377   -0.02022124   -0.01695228   -0.00607297
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C   -0.81632753   -0.80704260   -0.02705322    0.00744333    0.00204874    0.00621890
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   15
   -420.53748077
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O   -1.97162042   -1.30215707   -0.13932810   -0.02130894   -0.01744666   -0.00673485
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   15
   -420.53807021
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C    0.29545696    1.62169304    0.00426811   -0.02164945    0.01023083    0.00909652
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   15
   -420.53847166
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C    1.69737761    1.28989229   -0.12553910    0.00550324    0.00907400   -0.01538815
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   15
   -420.53867936
H   -2.60855442    0.48906309    0.04248799   -0.00245029   -0.00257825   -0.00033794
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C    1.68915939   -1.23741940    0.05571868   -0.00301378    0.00747996   -0.02405640
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   15
   -420.53874629
H   -2.61020179    0.48560684    0.03911983   -0.00381654   -0.00488980   -0.00059962
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C    1.69458147    1.28780891   -0.13399549    0.01306150    0.01599748   -0.01902559
C    1.69189439   -1.23963386    0.05477348   -0.00158589    0.00904382   -0.02413455
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C    2.31089922    0.02941293    0.01897261    0.02227238   -0.02435480    0.01600605
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   15
   -420.53879422
H   -2.61117138    0.48302122    0.03585875   -0.00454220   -0.00653472   -0.00079974
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O   -1.95847338   -1.29570383   -0.14178476   -0.01854783   -0.01558463   -0.00882113
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C    1.69291547    1.28643027   -0.13780560    0.01555916    0.01782509   -0.02041344
C    1.69465327   -1.24198473    0.05419279   -0.00007972    0.01034973   -0.02387727
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   15
   -420.53896159
H   -2.61133389    0.48160056    0.03274153   -0.00453070   -0.00737409   -0.00095514
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O   -1.95515929   -1.29384995   -0.14198986   -0.01650574   -0.01434862   -0.00894680
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C   -0.80031560   -0.79075575    0.00066695    0.01414547    0.00370040    0.01491715
C    0.30629877    1.61403400    0.01164392    0.00099285    0.02457257    0.00994577
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C    1.69101608    1.28478440   -0.14130755    0.01655891    0.01776972   -0.02140244
C    1.69741320   -1.24449166    0.05397271    0.00153754    0.01130626   -0.02328552
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H    2.41770309   -2.04315611    0.25636813    0.00201245    0.00121105    0.00926278
C    2.30644844    0.03014747    0.02205844    0.01914185   -0.02271369    0.01566988
H    3.37790740   -0.00149764    0.02871159   -0.01106330   -0.00408624    0.00129950
   15
   -420.53922866
H   -2.61069205    0.48149539    0.02979527   -0.00375958   -0.00735555   -0.00103537
O   -2.00803234    1.28245193    0.09628314   -0.01382691    0.02482758    0.00465664
O   -1.95165835   -1.29183360   -0.14209359   -0.01404545   -0.01282811   -0.00896151
C   -0.75900825    0.72734960    0.02486735    0.01101602    0.00210462   -0.01116804
C   -0.79886683   -0.78867097    0.00384389    0.01329655    0.00309474    0.01552058
C    0.30872493    1.61151719    0.01267260    0.00649754    0.02487392    0.00985293
C    0.37491066   -1.64687541    0.07503103    0.00451256   -0.01453192    0.01264002
C    1.68886837    1.28287242   -0.14448641    0.01588754    0.01560672   -0.02196365
C    1.70014973   -1.24716899    0.05410432    0.00327657    0.01182553   -0.02236578
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H    2.41206475   -2.05637190    0.24703012    0.00116265   -0.00052059    0.00882742
C    2.30377290    0.03103748    0.02324444    0.01452447   -0.02093503    0.01521954
H    3.37859420    0.01772296    0.04023823   -0.00884189   -0.00226980    0.00164431
   15
   -420.53955429
H   -2.60938368    0.48270218    0.02703425   -0.00227733   -0.00650830   -0.00102581
O   -2.01089511    1.28406804    0.09449958   -0.01740772    0.02551653    0.00442948
O   -1.94799842   -1.28967199   -0.14209577   -0.01120884   -0.01105659   -0.00886872
C   -0.75937788    0.72343138    0.02725024    0.01055678   -0.00321315   -0.01104004
C   -0.79761870   -0.78663277    0.00678636    0.01209562    0.00231736    0.01595804
C    0.31105270    1.60862559    0.01355243    0.01210946    0.02410229    0.00966272
C    0.37500218   -1.64490307    0.07310809    0.00397772   -0.01605706    0.01196633
C    1.68648234    1.28072679   -0.14733368    0.01364920    0.01153806   -0.02212258
C    1.70283657   -1.25002447    0.05457371    0.00512397    0.01182502   -0.02114375
H   -0.04675336    2.63107326    0.05921667   -0.00963923   -0.00613004    0.00318891
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H    2.40621901   -2.06949696    0.23610540    0.00017108   -0.00205499    0.00821488
C    2.30087961    0.03224340    0.02420061    0.00837882   -0.01863096    0.01454372
H    3.38085196    0.03735128    0.05146767   -0.00517896   -0.00039271    0.00206953
   15
   -420.53977383
H   -2.60767302    0.48506966    0.02445649   -0.00025820   -0.00490578   -0.00092893
O   -2.01356027    1.28539555    0.09266589   -0.02116230    0.02524923    0.00406865
O   -1.94421166   -1.28738517   -0.14199744   -0.00803300   -0.00906542   -0.00867868
C   -0.75990690    0.71956161    0.02979988    0.00989834   -0.00841790   -0.01077960
C   -0.79655304   -0.78462943    0.00948776    0.01056392    0.00137772    0.01622990
C    0.31319760    1.60537069    0.01428627    0.01755191    0.02240639    0.00939556
C    0.37503397   -1.64268743    0.07100448    0.00309643   -0.01799355    0.01107933
C    1.68389140    1.27840831   -0.14984686    0.01019527    0.00615721   -0.02194788
C    1.70544587   -1.25305806    0.05536240    0.00703475    0.01126044   -0.01963289
H   -0.04430905    2.63067133    0.06212396   -0.00995583   -0.00429792    0.00344604
H    0.09204602   -2.69713587   -0.01512035   -0.00616630   -0.00375991   -0.00630147
H    2.28469984    2.16863880   -0.24465872   -0.01251021   -0.00041956    0.00037467
H    2.40034418   -2.08225533    0.22370342   -0.00092732   -0.00334736    0.00745646
C    2.29786063    0.03373047    0.02493715    0.00140251   -0.01588405    0.01364743
H    3.38403093    0.05704917    0.06232329   -0.00072850    0.00155429    0.00258397
   15
   -420.53973433
H   -2.60592052    0.48831205    0.02204628    0.00209356   -0.00275289   -0.00081308
O   -2.01598538    1.28643731    0.09078618   -0.02490589    0.02420924    0.00358433
O   -1.94033405   -1.28499569   -0.14180074   -0.00455843   -0.00689254   -0.00840038
C   -0.76058549    0.71581886    0.03251237    0.00914400   -0.01340819   -0.01039328
C   -0.79564675   -0.78264671    0.01194396    0.00875115    0.00028515    0.01634230
C    0.31507757    1.60177788    0.01487814    0.02264165    0.02000081    0.00906445
C    0.37501929   -1.64019961    0.06873357    0.00192518   -0.02003511    0.01001152
C    1.68114716    1.27599736   -0.15202848    0.00603280    0.00024692   -0.02153370
C    1.70794880   -1.25626117    0.05644764    0.00895135    0.01009750   -0.01788667
H   -0.04007568    2.63103807    0.06441057   -0.01008047   -0.00213824    0.00369725
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H    2.39463746   -2.09441480    0.20996088   -0.00208614   -0.00437361    0.00656113
C    2.29482053    0.03545723    0.02546758   -0.00564117   -0.01275591    0.01256478
H    3.38734011    0.07646652    0.07271261    0.00379947    0.00354355    0.00317556
   15
   -420.53942496
H   -2.60454574    0.49204653    0.01978143    0.00450524   -0.00036232   -0.00064173
O   -2.01812819    1.28720494    0.08886588   -0.02840010    0.02263476    0.00302180
O   -1.93640495   -1.28252815   -0.14150883   -0.00084342   -0.00457553   -0.00803832
C   -0.76140232    0.71227843    0.03538184    0.00837672   -0.01806976   -0.00988185
C   -0.79487249   -0.78066818    0.01415326    0.00671183   -0.00092537    0.01630852
C    0.31661595    1.59788319    0.01533299    0.02714124    0.01714589    0.00870721
C    0.37497576   -1.63740912    0.06631148    0.00054484   -0.02184539    0.00879739
C    1.67831198    1.27358233   -0.15388472    0.00165119   -0.00540613   -0.02097188
C    1.71031647   -1.25961629    0.05780308    0.01079643    0.00836406   -0.01594003
H   -0.03403100    2.63179008    0.06603256   -0.00994742    0.00003692    0.00389439
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H    2.29067159    2.17652075   -0.25049572   -0.00562417    0.00893367   -0.00067303
H    2.38930528   -2.10579095    0.19503860   -0.00321689   -0.00513324    0.00556164
C    2.29186496    0.03737644    0.02580818   -0.01206979   -0.00929608    0.01135499
H    3.38997327    0.09524622    0.08252998    0.00778100    0.00550620    0.00380085
   15
   -420.53890338
H   -2.60397763    0.49584725    0.01763226    0.00662127    0.00191458   -0.00047162
O   -2.01994935    1.28771595    0.08691136   -0.03134328    0.02092280    0.00241041
O   -1.93246645   -1.28000879   -0.14112579    0.00304700   -0.00216544   -0.00760717
C   -0.76234588    0.70901069    0.03840059    0.00768110   -0.02230514   -0.00925394
C   -0.79419951   -0.77867555    0.01611614    0.00450751   -0.00222534    0.01613863
C    0.31774493    1.59372952    0.01565621    0.03084950    0.01407367    0.00834333
C    0.37492411   -1.63428907    0.06375650   -0.00092683   -0.02304637    0.00747279
C    1.67545155    1.27124793   -0.15542394   -0.00249624   -0.01016631   -0.02035664
C    1.71252113   -1.26309722    0.05939934    0.01245108    0.00608104   -0.01382567
H   -0.02620025    2.63253863    0.06695431   -0.00947997    0.00199628    0.00403666
H    0.05395016   -2.66520685   -0.01776642   -0.00770691    0.00603069   -0.00472091
H    2.29549775    2.17847493   -0.25328091   -0.00224272    0.01274066   -0.00115946
H    2.38455233   -2.11624565    0.17911571   -0.00431838   -0.00568706    0.00449931
C    2.28909047    0.03943589    0.02597718   -0.01736015   -0.00555062    0.01007902
H    3.39122042    0.11303583    0.09166355    0.01073575    0.00737339    0.00441149
   15
   -420.53830636
H   -2.60459260    0.49931098    0.01556845    0.00811250    0.00366003   -0.00033132
O   -2.02141578    1.28798941    0.08492951   -0.03342073    0.01944865    0.00179740
O   -1.92856260   -1.27746490   -0.14065652    0.00703575    0.00028407   -0.00711862
C   -0.76340578    0.70607957    0.04155912    0.00713670   -0.02602425   -0.00851432
C   -0.79359458   -0.77664921    0.01783515    0.00220678   -0.00357764    0.01585013
C    0.31840865    1.58936308    0.01585324    0.03360149    0.01099013    0.00800567
C    0.37488640   -1.63082173    0.06108861   -0.00234161   -0.02328285    0.00608983
C    1.67262817    1.26906560   -0.15665537   -0.00607200   -0.01358850   -0.01976645
C    1.71453788   -1.26666948    0.06120449    0.01382811    0.00332625   -0.01159874
H   -0.01666859    2.63293398    0.06715014   -0.00862463    0.00352784    0.00411851
H    0.04393072   -2.65596603   -0.01681313   -0.00802603    0.00840491   -0.00415895
H    2.30073480    2.17815265   -0.25585878    0.00066570    0.01535935   -0.00155902
H    2.38057503   -2.12567876    0.16238389   -0.00527713   -0.00605494    0.00338193
C    2.28657669    0.04157899    0.02599376   -0.02118618   -0.00157731    0.00881207
H    3.39055342    0.12950096    0.10000370    0.01237594    0.00906006    0.00496962
   15
   -420.53779320
H   -2.60665475    0.50212761    0.01356554    0.00869223    0.00458875   -0.00026740
O   -2.02250412    1.28804173    0.08292724   -0.03438275    0.01853964    0.00121118
O   -1.92473857   -1.27492422   -0.14010654    0.01103377    0.00271172   -0.00659331
C   -0.76457383    0.70354122    0.04484626    0.00679183   -0.02914124   -0.00767230
C   -0.79302301   -0.77456881    0.01931464   -0.00010293   -0.00492328    0.01545791
C    0.31856563    1.58483028    0.01592919    0.03527828    0.00805264    0.00771054
C    0.37488391   -1.62700389    0.05832863   -0.00357956   -0.02227392    0.00469320
C    1.66989562    1.26708675   -0.15758796   -0.00884312   -0.01539096   -0.01922681
C    1.71634597   -1.27029162    0.06318493    0.01485226    0.00022397   -0.00930693
H   -0.00559002    2.63270257    0.06660549   -0.00737315    0.00448378    0.00413127
H    0.03535781   -2.64822400   -0.01511319   -0.00841678    0.00978981   -0.00357481
H    2.30586242    2.17508537   -0.25815848    0.00287651    0.01655889   -0.00182304
H    2.37754376   -2.13402316    0.14504356   -0.00599578   -0.00629756    0.00223712
C    2.28438117    0.04374570    0.02587702   -0.02333201    0.00257163    0.00761044
H    3.38768040    0.14433805    0.10745024    0.01252260    0.01050629    0.00543563
   15
   -420.53747840
H   -2.61026643    0.50413269    0.01161227    0.00821893    0.00451193   -0.00029615
O   -2.02320360    1.28788310    0.08091119   -0.03409018    0.01834666    0.00067875
O   -1.92103961   -1.27241420   -0.13948178    0.01492892    0.00505612   -0.00604749
C   -0.76584484    0.70144266    0.04824929    0.00667231   -0.03158513   -0.00673616
C   -0.79245001   -0.77241404    0.02056051   -0.00231504   -0.00621080    0.01497891
C    0.31819058    1.58017543    0.01588846    0.03581828    0.00535032    0.00747665
C    0.37493521   -1.62285094    0.05549768   -0.00454555   -0.01990399    0.00329677
C    1.66729563    1.26533856   -0.15822966   -0.01065226   -0.01547023   -0.01881183
C    1.71793007   -1.27391683    0.06530603    0.01542905   -0.00313845   -0.00696753
H    0.00681076    2.63167353    0.06531808   -0.00575179    0.00479413    0.00407108
H    0.02830168   -2.64222786   -0.01276913   -0.00890886    0.01003413   -0.00303906
H    2.31048383    2.16905851   -0.26013176    0.00427331    0.01624127   -0.00195300
H    2.37558876   -2.14123456    0.12730025   -0.00647003   -0.00647638    0.00110008
C    2.28253629    0.04587342    0.02564512   -0.02373166    0.00680122    0.00651692
H    3.38257530    0.15728781    0.11391986    0.01114814    0.01161754    0.00576924
   15
   -420.53735547
H   -2.61534247    0.50533895    0.00971352    0.00670586    0.00348747   -0.00041003
O   -2.02351751    1.28751569    0.07888738   -0.03255396    0.01885466    0.00020733
O   -1.91750979   -1.26996141   -0.13878842    0.01860501    0.00725829   -0.00549781
C   -0.76721701    0.69982078    0.05175406    0.00677705   -0.03330307   -0.00571638
C   -0.79184226   -0.77016552    0.02158000   -0.00432342   -0.00737463    0.01443059
C    0.31727538    1.57543934    0.01573458    0.03519383    0.00290896    0.00730516
C    0.37505487   -1.61839863    0.05261687   -0.00521405   -0.01623604    0.00191317
C    1.66485543    1.26382216   -0.15858677   -0.01141092   -0.01381017   -0.01853652
C    1.71928146   -1.27749445    0.06753247    0.01552758   -0.00662717   -0.00461442
H    0.02024268    2.62979128    0.06329867   -0.00381747    0.00444637    0.00394384
H    0.02285094   -2.63802177   -0.00987767   -0.00950632    0.00915899   -0.00252520
H    2.31434862    2.16012964   -0.26175554    0.00478874    0.01440065   -0.00193093
H    2.37479402   -2.14728026    0.10935894   -0.00663601   -0.00663662   -0.00003846
C    2.28104815    0.04789820    0.02531456   -0.02242998    0.01105203    0.00556124
H    3.37548512    0.16814894    0.11935406    0.00830683    0.01239551    0.00594533
   15
   -420.53732037
H   -2.62161398    0.50592822    0.00788963    0.00436845    0.00172772   -0.00060053
O   -2.02346312    1.28693401    0.07686117   -0.02994980    0.01981676   -0.00021516
O   -1.91419071   -1.26759076   -0.13803268    0.02194024    0.00926152   -0.00496917
C   -0.76869189    0.69870151    0.05534517    0.00708029   -0.03425382   -0.00462350
C   -0.79116952   -0.76780572    0.02238136   -0.00601531   -0.00835524    0.01383233
C    0.31582942    1.57065900    0.01547017    0.03345030    0.00068472    0.00719762
C    0.37525305   -1.61370212    0.04970710   -0.00562250   -0.01151374    0.00054140
C    1.66258652    1.26251258   -0.15866342   -0.01111779   -0.01050588   -0.01842044
C    1.72039864   -1.28097187    0.06982868    0.01513505   -0.01012953   -0.00226895
H    0.03435821    2.62711705    0.06057008   -0.00163362    0.00351428    0.00375949
H    0.01911224   -2.63545106   -0.00653168   -0.01014393    0.00735277   -0.00201054
H    2.31736384    2.14862876   -0.26303382    0.00441882    0.01113158   -0.00175214
H    2.37518926   -2.15213091    0.09142423   -0.00648549   -0.00681185   -0.00116275
C    2.27989727    0.04975582    0.02489971   -0.01960521    0.01525184    0.00476651
H    3.36691890    0.17678054    0.12372138    0.00418991    0.01285018    0.00595020
   15
   -420.53723955
H   -2.62866472    0.50621168    0.00617395    0.00152854   -0.00039155   -0.00082263
O   -2.02306972    1.28612746    0.07483740   -0.02655865    0.02087555   -0.00062094
O   -1.91112008   -1.26532494   -0.13722055    0.02481181    0.01101711   -0.00447028
C   -0.77027401    0.69809918    0.05900611    0.00754071   -0.03441701   -0.00347015
C   -0.79040634   -0.76531990    0.02297362   -0.00728683   -0.00908812    0.01320054
C    0.31387896    1.56586817    0.01509686    0.03067787   -0.00143546    0.00714639
C    0.37553601   -1.60883240    0.04678915   -0.00584700   -0.00608750   -0.00082678
C    1.66048452    1.26136011   -0.15846142   -0.00984383   -0.00578211   -0.01844492
C    1.72128757   -1.28429624    0.07215923    0.01426396   -0.01355676    0.00005304
H    0.04876569    2.62381708    0.05716552    0.00070178    0.00211509    0.00353375
H    0.01719921   -2.63419480   -0.00282378   -0.01072875    0.00491402   -0.00148399
H    2.31959619    2.13514079   -0.26399782    0.00320545    0.00666239   -0.00144090
H    2.37674760   -2.15575502    0.07369870   -0.00603239   -0.00700168   -0.00227454
C    2.27904133    0.05138305    0.02441260   -0.01557935    0.01926816    0.00412197
H    3.35761207    0.18310406    0.12701948   -0.00084198    0.01291802    0.00582304
   15
   -420.53700785
H   -2.63598885    0.50656474    0.00460600   -0.00143757   -0.00245490   -0.00104489
O   -2.02237545    1.28508440    0.07282068   -0.02271732    0.02163554   -0.00103700
O   -1.90833036   -1.26318385   -0.13635767    0.02711458    0.01248007   -0.00402024
C   -0.77197024    0.69801625    0.06271947    0.00808827   -0.03378238   -0.00226885
C   -0.78953362   -0.76269704    0.02336632   -0.00804603   -0.00951975    0.01254730
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   15
   -420.53652295
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O   -1.90584763   -1.26118405   -0.13544913    0.02877125    0.01360753   -0.00363089
C   -0.77378878    0.69844312    0.06646709    0.00864932   -0.03235513   -0.00103592
C   -0.78853994   -0.75993066    0.02356931   -0.00823462   -0.00960793    0.01188555
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C    1.65669361    1.25922723   -0.15721765   -0.00528978    0.00621682   -0.01886951
C    1.72243938   -1.29028111    0.07678352    0.01135035   -0.01992732    0.00456930
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   15
   -420.53594415
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O   -1.90369060   -1.25933827   -0.13449935    0.02972033    0.01437997   -0.00330642
C   -0.77573800    0.69935829    0.07023035    0.00914781   -0.03018018    0.00021378
C   -0.78742245   -0.75701944    0.02359261   -0.00782846   -0.00932262    0.01122317
C    0.30548249    1.55176014    0.01332853    0.01773034   -0.00872705    0.00717078
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C    1.65493676    1.25806677   -0.15616993   -0.00282180    0.01225835   -0.01908985
C    1.72274608   -1.29284539    0.07900903    0.00948901   -0.02280178    0.00672250
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C    2.27760223    0.05429972    0.02260848   -0.00238662    0.02912335    0.00257303
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   15
   -420.53535521
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O   -1.90187006   -1.25765526   -0.13351200    0.02995475    0.01478872   -0.00305045
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C   -0.78618734   -0.75396775    0.02344621   -0.00682113   -0.00863177    0.01056174
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C    1.65322325    1.25672221   -0.15483371   -0.00095701    0.01728289   -0.01922881
C    1.72290945   -1.29506519    0.08113301    0.00750030   -0.02545316    0.00877389
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C    2.27727885    0.05445172    0.02191900   -0.00010480    0.03126960    0.00194390
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   15
   -420.53497013
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O   -1.90038866   -1.25613968   -0.13248999    0.02949882    0.01482809   -0.00286638
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C   -0.78484976   -0.75078606    0.02314013   -0.00527170   -0.00753440    0.00989807
C    0.29843325    1.54295962    0.01160842    0.00711928   -0.01592282    0.00714445
C    0.37833141   -1.58476676    0.03279410   -0.00727705    0.01797482   -0.00735913
C    1.65152551    1.25511844   -0.15320704   -0.00020158    0.02062067   -0.01915978
C    1.72295942   -1.29690039    0.08312451    0.00549291   -0.02789096    0.01068837
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H    2.32929705    2.06920891   -0.26660285   -0.00497875   -0.01690971    0.00065040
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C    2.27695958    0.05413180    0.02120031    0.00012402    0.03270739    0.00116936
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   15
   -420.53486012
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C   -0.78343306   -0.74749096    0.02268441   -0.00325276   -0.00602690    0.00923120
C    0.29470653    1.53889207    0.01058620    0.00175921   -0.02031311    0.00709563
C    0.37919661   -1.58052331    0.03025257   -0.00784472    0.02021321   -0.00848472
C    1.64983251    1.25320545   -0.15129100   -0.00085585    0.02186028   -0.01883434
C    1.72292625   -1.29831420    0.08495458    0.00354442   -0.03008937    0.01244131
H    0.11848457    2.60573788    0.02495771    0.01199257   -0.00399748    0.00215451
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H    2.33308453    2.06237478   -0.26722241   -0.00405851   -0.01766373    0.00064759
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C    2.27664105    0.05331823    0.02046411   -0.00178006    0.03342316    0.00025415
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   15
   -420.53497299
H   -2.66166916    0.52345727   -0.00008109   -0.00657357   -0.00041877   -0.00114280
O   -2.01428682    1.27402618    0.06116448   -0.00339237    0.00749804   -0.00438806
O   -1.89841539   -1.25360900   -0.13034975    0.02672755    0.01393867   -0.00266109
C   -0.78495105    0.70709288    0.08506373    0.00894475   -0.01530461    0.00507479
C   -0.78196764   -0.74410521    0.02208912   -0.00087062   -0.00413378    0.00855728
C    0.29095300    1.53513212    0.00945677   -0.00345625   -0.02505187    0.00700221
C    0.38018044   -1.57658409    0.02783917   -0.00843285    0.02131850   -0.00948917
C    1.64815416    1.25096456   -0.14909057   -0.00291525    0.02096742   -0.01821760
C    1.72283933   -1.29927338    0.08659677    0.00172328   -0.03202923    0.01400264
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C    2.27635163    0.05200016    0.01972415   -0.00548905    0.03344040   -0.00072797
H    3.34045618    0.16667742    0.12264454   -0.01190487    0.00919026    0.00580693
   15
   -420.53514827
H   -2.66143232    0.52817206   -0.00004695   -0.00463466    0.00249253   -0.00093420
O   -2.01262782    1.27163295    0.05935516   -0.00145369    0.00210298   -0.00501635
O   -1.89789231   -1.25258385   -0.12923387    0.02461886    0.01307615   -0.00261761
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C   -0.78048934   -0.74065741    0.02136447    0.00174307   -0.00188192    0.00786606
C    0.28725136    1.53175103    0.00822151   -0.00838174   -0.02984788    0.00687996
C    0.38129169   -1.57296592    0.02556909   -0.00895948    0.02136428   -0.01035586
C    1.64652121    1.24840881   -0.14661500   -0.00606210    0.01829484   -0.01734754
C    1.72272616   -1.29974861    0.08802747    0.00006461   -0.03369495    0.01533797
H    0.12746487    2.60442922    0.01071785    0.01314349   -0.00205190    0.00181861
H    0.06980795   -2.62284374    0.02741790   -0.00389855   -0.00259112    0.00326740
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H    2.41446923   -2.13884872   -0.03767336    0.00133506   -0.00442054   -0.00951980
C    2.27614656    0.05017728    0.01899514   -0.01034282    0.03281443   -0.00168436
H    3.34861166    0.15685411    0.11813319   -0.00666858    0.00848233    0.00621641
   15
   -420.53526638
H   -2.66036586    0.53243512    0.00015518   -0.00236061    0.00559037   -0.00071039
O   -2.01095231    1.26921606    0.05760270    0.00047639   -0.00349647   -0.00559724
O   -1.89764819   -1.25170683   -0.12808826    0.02219113    0.01199852   -0.00259938
C   -0.79037820    0.71259453    0.09209309    0.00650729   -0.00576462    0.00727187
C   -0.77903751   -0.73718153    0.02052094    0.00445478    0.00068324    0.00714858
C    0.28367598    1.52882090    0.00688229   -0.01292324   -0.03439003    0.00671550
C    0.38253814   -1.56966964    0.02345539   -0.00929969    0.02049878   -0.01107112
C    1.64498060    1.24557790   -0.14387738   -0.00976542    0.01442347   -0.01629551
C    1.72261175   -1.29971483    0.08922651   -0.00138662   -0.03501875    0.01643004
H    0.12844871    2.60442976    0.00309239    0.01316107   -0.00064930    0.00166394
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H    2.34691256    2.05962574   -0.26953076    0.00533449   -0.00965468   -0.00072753
H    2.41973688   -2.13180437   -0.04531466    0.00179901   -0.00309084   -0.00997201
C    2.27609834    0.04785898    0.01829137   -0.01557470    0.03161461   -0.00250415
H    3.35796101    0.14550657    0.11250319   -0.00099176    0.00762331    0.00655451
   15
   -420.53525379
H   -2.65887350    0.53569511    0.00048545   -0.00015229    0.00844660   -0.00050343
O   -2.00928249    1.26683860    0.05591365    0.00272593   -0.00884146   -0.00609522
O   -1.89765563   -1.25096578   -0.12691316    0.01957507    0.01076194   -0.00258999
C   -0.79324949    0.71551257    0.09545106    0.00451298   -0.00097085    0.00829587
C   -0.77765300   -0.73371629    0.01956935    0.00712621    0.00351084    0.00640531
C    0.28029540    1.52641000    0.00544158   -0.01698422   -0.03834696    0.00651147
C    0.38392485   -1.56668254    0.02150889   -0.00936618    0.01900276   -0.01162331
C    1.64358756    1.24252956   -0.14089348   -0.01342617    0.01000293   -0.01515701
C    1.72251808   -1.29915210    0.09017744   -0.00263607   -0.03592313    0.01726075
H    0.12706796    2.60454704   -0.00483275    0.01284111    0.00076534    0.00151468
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H    2.35047779    2.06303839   -0.27017699    0.00908425   -0.00531391   -0.00140985
H    2.42468332   -2.12420616   -0.05116280    0.00207324   -0.00157938   -0.01028111
C    2.27628515    0.04506338    0.01762517   -0.02045792    0.02985442   -0.00311644
H    3.36749319    0.13279026    0.10569503    0.00438286    0.00656935    0.00676661
   15
   -420.53514972
H   -2.65734641    0.53744450    0.00090691    0.00155141    0.01061990   -0.00034152
O   -2.00764420    1.26456076    0.05429364    0.00564626   -0.01344712   -0.00647824
O   -1.89788505   -1.25034670   -0.12570869    0.01689859    0.00942236   -0.00257375
C   -0.79618836    0.71844553    0.09868367    0.00197563    0.00363025    0.00926657
C   -0.77637603   -0.73030438    0.01852095    0.00962431    0.00652954    0.00562894
C    0.27717091    1.52457780    0.00390250   -0.02048624   -0.04142679    0.00625069
C    0.38545266   -1.56398231    0.01973794   -0.00902101    0.01717344   -0.01201556
C    1.64239685    1.23932995   -0.13768042   -0.01653597    0.00560418   -0.01401557
C    1.72246402   -1.29804688    0.09086772   -0.00368769   -0.03629642    0.01782842
H    0.12337988    2.60453000   -0.01303058    0.01220928    0.00197000    0.00136952
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H    2.35241584    2.06741028   -0.27056992    0.01227124   -0.00114446   -0.00205882
H    2.42925832   -2.11632511   -0.05516193    0.00221979    0.00004256   -0.01045435
C    2.27678017    0.04181703    0.01700578   -0.02443480    0.02754563   -0.00346251
H    3.37624843    0.11889610    0.09767413    0.00889978    0.00528322    0.00675219
   15
   -420.53506651
H   -2.65608601    0.53729723    0.00139073    0.00239000    0.01174345   -0.00024103
O   -2.00607079    1.26243440    0.05274699    0.00948489   -0.01690217   -0.00672699
O   -1.89830622   -1.24983446   -0.12447505    0.01427813    0.00803783   -0.00254205
C   -0.79915648    0.72132401    0.10177623   -0.00107837    0.00789244    0.01019124
C   -0.77524423   -0.72699132    0.01738749    0.01184431    0.00967015    0.00482170
C    0.27435538    1.52337056    0.00226900   -0.02336276   -0.04339496    0.00591873
C    0.38711630   -1.56154177    0.01814846   -0.00819261    0.01538994   -0.01224634
C    1.64145503    1.23604505   -0.13425537   -0.01872796    0.00166229   -0.01293330
C    1.72246551   -1.29639361    0.09128874   -0.00455733   -0.03603711    0.01813861
H    0.11749774    2.60416447   -0.02147505    0.01129506    0.00279669    0.00123270
H    0.12096606   -2.60695749    0.03207449    0.00477104    0.00645294    0.00446314
H    2.35215820    2.07199697   -0.27059371    0.01452807    0.00242396   -0.00260189
H    2.43343566   -2.10845165   -0.05728114    0.00226269    0.00167294   -0.01049476
C    2.27764306    0.03815488    0.01643841   -0.02711860    0.02467875   -0.00352537
H    3.38341992    0.10405291    0.08844054    0.01213569    0.00384749    0.00655470
   15
   -420.53516719
H   -2.65524039    0.53505289    0.00191923    0.00217705    0.01166144   -0.00021761
O   -2.00460588    1.26049849    0.05127654    0.01431030   -0.01897553   -0.00684896
O   -1.89888950   -1.24941339   -0.12321258    0.01181689    0.00665450   -0.00248854
C   -0.80210773    0.72408371    0.10471475   -0.00459302    0.01169227    0.01107767
C   -0.77429107   -0.72382452    0.01618118    0.01369574    0.01285124    0.00397998
C    0.27189225    1.52281786    0.00054611   -0.02555362   -0.04407845    0.00549747
C    0.38890313   -1.55933444    0.01674396   -0.00680888    0.01401490   -0.01232936
C    1.64079497    1.23273407   -0.13063465   -0.01978777   -0.00152167   -0.01195935
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   15
   -420.53550917
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C   -0.77354448   -0.72085199    0.01491473    0.01511517    0.01599443    0.00310802
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   15
   -420.53608991
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C   -0.77302582   -0.71812113    0.01360132    0.01605281    0.01901476    0.00221496
C    0.26814449    1.52369753   -0.00314079   -0.02777243   -0.04149660    0.00432981
C    0.39275449   -1.55554718    0.01449290   -0.00244771    0.01330309   -0.01208339
C    1.64036534    1.22621177   -0.12286311   -0.01824526   -0.00504019   -0.01039859
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   15
   -420.53677902
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O   -1.90134763   -1.24854381   -0.11926021    0.00607598    0.00293615   -0.00213845
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C   -0.77274929   -0.71567753    0.01225443    0.01650211    0.02183753    0.00130414
C    0.26689354    1.52509100   -0.00508714   -0.02780816   -0.03837477    0.00356670
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C    1.64057265    1.22305353   -0.11873586   -0.01577327   -0.00530440   -0.00981854
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   15
   -420.53743846
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O   -1.90233082   -1.24833836   -0.11789216    0.00483337    0.00195175   -0.00195697
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C   -0.77272168   -0.71356377    0.01088784    0.01646179    0.02438609    0.00038650
C    0.26606218    1.52706346   -0.00708733   -0.02712028   -0.03426829    0.00269234
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C    1.64101735    1.21997442   -0.11446003   -0.01237851   -0.00467692   -0.00934671
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H    2.44801610   -2.07850678   -0.04009682    0.00312800    0.00668997   -0.00920034
C    2.28808104    0.01542764    0.01428367   -0.01804622    0.00184030   -0.00060532
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   15
   -420.53791420
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O   -1.90336915   -1.24815515   -0.11650195    0.00394301    0.00111766   -0.00174215
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C    0.26564005    1.52955312   -0.00912806   -0.02576908   -0.02943878    0.00169734
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C    1.64164840    1.21696517   -0.11004280   -0.00832140   -0.00336086   -0.00893044
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H    2.44945875   -2.07567721   -0.03143144    0.00369300    0.00663039   -0.00868104
C    2.29119952    0.01048257    0.01392660   -0.01285743   -0.00422836    0.00024324
H    3.38025362    0.01065704    0.01160506    0.00001238   -0.00558768    0.00273476
   15
   -420.53811391
H   -2.64760077    0.48972421    0.00616260   -0.00796312   -0.00166421   -0.00027479
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C   -0.77340391   -0.71047453    0.00815091    0.01501474    0.02841097   -0.00143455
C    0.26560671    1.53248741   -0.01119436   -0.02380110   -0.02421166    0.00062862
C    0.40052492   -1.55052290    0.01212878    0.00978545    0.01735359   -0.01004464
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C    1.72485410   -1.27144634    0.08676941   -0.00620030   -0.00884682    0.01374769
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C    2.29451230    0.00560182    0.01356591   -0.00760502   -0.01060887    0.00105283
H    3.37550141   -0.00296453   -0.00368042   -0.00531043   -0.00678357    0.00209386
   15
   -420.53803896
H   -2.64289503    0.48074881    0.00707207   -0.00799853   -0.00304033   -0.00012961
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O   -1.90557455   -1.24781987   -0.11366505    0.00309468    0.00008191   -0.00118179
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C   -0.77409197   -0.70955976    0.00680809    0.01369546    0.02977502   -0.00231939
C    0.26593251    1.53578766   -0.01327013   -0.02128657   -0.01888920   -0.00047994
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C    1.64322182    1.21107347   -0.10080965    0.00019274   -0.00022443   -0.00800220
C    1.72557981   -1.26667656    0.08517145   -0.00547115   -0.00144118    0.01227662
H    0.01881328    2.58859409   -0.09555770   -0.00204211   -0.00411879    0.00058749
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C    2.29794085    0.00088164    0.01318936   -0.00302074   -0.01713268    0.00180711
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   15
   -420.53777309
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O   -1.90673228   -1.24765542   -0.11222418    0.00315815   -0.00026450   -0.00096245
C   -0.81820034    0.73709235    0.12115119   -0.03202926    0.01716562    0.01737429
C   -0.77498670   -0.70909459    0.00550032    0.01203992    0.03064996   -0.00317976
C    0.26657965    1.53937377   -0.01533866   -0.01831728   -0.01373790   -0.00158486
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C    1.64403662    1.20814493   -0.09600802    0.00369804    0.00049768   -0.00728735
C    1.72638779   -1.26188551    0.08338812   -0.00436672    0.00639875    0.01061149
H    0.00457699    2.58764737   -0.10543101   -0.00405130   -0.00474787    0.00044812
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C    2.30141679   -0.00357957    0.01278555    0.00014805   -0.02359272    0.00252022
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   15
   -420.53750209
H   -2.62935681    0.46453342    0.00892533   -0.00546498   -0.00372739    0.00028061
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O   -1.90792605   -1.24748816   -0.11077240    0.00341896   -0.00034452   -0.00067820
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C   -0.77606316   -0.70909223    0.00424058    0.01012694    0.03100765   -0.00400228
C    0.26750334    1.54316801   -0.01738326   -0.01500509   -0.00893814   -0.00266572
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C    1.64479686    1.20521051   -0.09109657    0.00609531   -0.00012073   -0.00626562
C    1.72726134   -1.25719141    0.08144454   -0.00288203    0.01438145    0.00877574
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C    2.30489287   -0.00768442    0.01234362    0.00134871   -0.02975881    0.00324701
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   15
   -420.53722845
H   -2.62097676    0.45741886    0.00979580   -0.00314088   -0.00315988    0.00051759
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O   -1.90915879   -1.24731717   -0.10931294    0.00388759   -0.00023800   -0.00039005
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C   -0.77729246   -0.70955801    0.00304127    0.00800152    0.03081378   -0.00477744
C    0.26865365    1.54709798   -0.01938769   -0.01148828   -0.00462889   -0.00366046
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C    1.64546663    1.20228003   -0.08609083    0.00710433   -0.00246902   -0.00487832
C    1.72817801   -1.25271455    0.07936843   -0.00103123    0.02219311    0.00680198
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C    2.30835119   -0.01133998    0.01185251    0.00038914   -0.03538255    0.00404827
H    3.37323614   -0.04362378   -0.06758151   -0.01455967   -0.00977510   -0.00031802
   15
   -420.53706400
H   -2.61203723    0.45086702    0.01057303   -0.00040113   -0.00216797    0.00075375
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O   -1.91043577   -1.24714363   -0.10784904    0.00451899    0.00002935   -0.00010543
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C   -0.77864260   -0.71048900    0.00191414    0.00574635    0.03006210   -0.00550293
C    0.26997760    1.55109857   -0.02133690   -0.00794621   -0.00082941   -0.00455458
C    0.40671118   -1.54992353    0.01244700    0.02019979    0.01226301   -0.00535359
C    1.64603074    1.19938907   -0.08101180    0.00664830   -0.00659985   -0.00311569
C    1.72910996   -1.24857257    0.07718959    0.00109166    0.02947194    0.00473352
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H    2.22459494    2.08500683   -0.23902757   -0.01596084   -0.00709966    0.00082101
H    2.44053874   -2.07948622    0.04873161    0.00604252    0.00154381   -0.00321020
C    2.31180596   -0.01446149    0.01130004   -0.00248857   -0.04023798    0.00496906
H    3.37894827   -0.04965889   -0.08370583   -0.01189532   -0.01015948   -0.00122391
   15
   -420.53687770
H   -2.60302741    0.44470253    0.01121452    0.00248199   -0.00098116    0.00097947
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O   -1.91176412   -1.24697055   -0.10638394    0.00527810    0.00044898    0.00016911
C   -0.81631199    0.73727259    0.12344132   -0.03011535    0.00589657    0.01990417
C   -0.78007956   -0.71187385    0.00087014    0.00342191    0.02875252   -0.00617026
C    0.27142184    1.55511240   -0.02321742   -0.00454607    0.00247152   -0.00532171
C    0.40712526   -1.55048073    0.01281424    0.02080581    0.00893287   -0.00432042
C    1.64649570    1.19659973   -0.07588615    0.00495200   -0.01220689   -0.00101572
C    1.73002524   -1.24487513    0.07493924    0.00336880    0.03587658    0.00262215
H   -0.04155565    2.59217405   -0.14524996   -0.01149967   -0.00273268   -0.00090618
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H    3.38677951   -0.05386676   -0.09960667   -0.00769463   -0.01041607   -0.00233935
   15
   -420.53666933
H   -2.59446061    0.43871396    0.01168025    0.00517822    0.00017211    0.00116938
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O   -1.91315241   -1.24680263   -0.10492074    0.00612122    0.00097616    0.00042620
C   -0.81465137    0.73697880    0.12328363   -0.02740666    0.00274342    0.02037845
C   -0.78156829   -0.71369276   -0.00008064    0.00111005    0.02689529   -0.00677608
C    0.27293521    1.55908933   -0.02501765   -0.00146288    0.00538478   -0.00595306
C    0.40722539   -1.55117246    0.01324685    0.02092209    0.00517487   -0.00330763
C    1.64688692    1.19399605   -0.07074541    0.00231271   -0.01869029    0.00128256
C    1.73088957   -1.24171870    0.07264922    0.00567227    0.04109247    0.00052018
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H    2.42930384   -2.08489520    0.08212259    0.00494135    0.00023592   -0.00062212
C    2.31889365   -0.01882414    0.00995385   -0.01109868   -0.04689034    0.00706913
H    3.39598487   -0.05620172   -0.11508422   -0.00268993   -0.01050910   -0.00362089
   15
   -420.53636575
H   -2.58681957    0.43269916    0.01193621    0.00743300    0.00099343    0.00131556
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O   -1.91461019   -1.24664585   -0.10346235    0.00700948    0.00159406    0.00065891
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C   -0.78307389   -0.71591770   -0.00092908   -0.00112892    0.02451461   -0.00730317
C    0.27447133    1.56298521   -0.02672796    0.00113064    0.00799745   -0.00647660
C    0.40700973   -1.55194227    0.01372948    0.02061711    0.00130334   -0.00231038
C    1.64724386    1.19167512   -0.06562411   -0.00086567   -0.02530983    0.00364188
C    1.73166833   -1.23918185    0.07035122    0.00783371    0.04485174   -0.00150870
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H    2.42229328   -2.08771738    0.09910402    0.00394649   -0.00003657    0.00069765
C    2.32265467   -0.01996498    0.00912852   -0.01511122   -0.04841881    0.00810250
H    3.40567638   -0.05664580   -0.12991038    0.00232740   -0.01044760   -0.00495823
   15
   -420.53600458
H   -2.58050674    0.42651316    0.01195624    0.00900230    0.00128660    0.00140802
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O   -1.91614747   -1.24650720   -0.10201140    0.00789703    0.00226496    0.00086415
C   -0.81014250    0.73631174    0.12203842   -0.01975041   -0.00302497    0.02104657
C   -0.78456261   -0.71851271   -0.00166720   -0.00321172    0.02165148   -0.00775143
C    0.27599105    1.56676039   -0.02834051    0.00313443    0.01040479   -0.00688539
C    0.40648278   -1.55273208    0.01424709    0.01997391   -0.00230434   -0.00134415
C    1.64761407    1.18973621   -0.06055781   -0.00419373   -0.03137349    0.00593388
C    1.73232901   -1.23732117    0.06807587    0.00969751    0.04698555   -0.00341584
H   -0.05586647    2.60109379   -0.17357776   -0.01469624    0.00039052   -0.00246455
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H    2.22377896    2.10728110   -0.22650737   -0.00922955    0.00881810   -0.00190221
H    2.41457560   -2.09053738    0.11596018    0.00270415   -0.00003989    0.00198842
C    2.32664266   -0.02037534    0.00818084   -0.01790101   -0.04863254    0.00898304
H    3.41495835   -0.05521144   -0.14384400    0.00674300   -0.01021108   -0.00628046
   15
   -420.53569871
H   -2.57580295    0.42010585    0.01172367    0.00978674    0.00090506    0.00143868
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O   -1.91777426   -1.24639425   -0.10057021    0.00872646    0.00295164    0.00103126
C   -0.80740975    0.73602543    0.12094083   -0.01502316   -0.00542091    0.02121900
C   -0.78600307   -0.72143456   -0.00228824   -0.00505549    0.01835632   -0.00811191
C    0.27746420    1.57037842   -0.02984904    0.00447385    0.01267757   -0.00721018
C    0.40565411   -1.55348783    0.01478502    0.01908434   -0.00526751   -0.00039565
C    1.64804755    1.18827033   -0.05558100   -0.00738495   -0.03633240    0.00804448
C    1.73284359   -1.23616882    0.06585195    0.01113037    0.04741826   -0.00515846
H   -0.05555101    2.60415748   -0.18225544   -0.01494489    0.00095108   -0.00297309
H    0.14845913   -2.59985165   -0.06074227    0.00164219    0.00521996   -0.00232139
H    2.22870763    2.11079022   -0.22286971   -0.00700415    0.01211564   -0.00257879
H    2.40637364   -2.09335358    0.13245922    0.00128225    0.00018101    0.00321895
C    2.33089924   -0.02005198    0.00709765   -0.01898470   -0.04754305    0.00961962
H    3.42304184   -0.05194198   -0.15664877    0.01009263   -0.00977242   -0.00747356
   15
   -420.53557497
H   -2.57284882    0.41354554    0.01123276    0.00975671   -0.00013438    0.00141191
O   -2.03338928    1.25013901    0.03837013   -0.00274784    0.00649519   -0.00828279
O   -1.91949994   -1.24631478   -0.09914069    0.00943608    0.00363168    0.00116119
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C   -0.78736747   -0.72463353   -0.00278673   -0.00658025    0.01470065   -0.00837956
C    0.27887062    1.57380493   -0.03124862    0.00510237    0.01484795   -0.00746075
C    0.40453712   -1.55416515    0.01532895    0.01802061   -0.00723187    0.00053384
C    1.64859227    1.18735195   -0.05072551   -0.01021449   -0.03979249    0.00989887
C    1.73319054   -1.23573143    0.06370581    0.01201786    0.04620451   -0.00670734
H   -0.05255022    2.60705596   -0.19039892   -0.01477185    0.00112990   -0.00341739
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H    2.23490177    2.11213510   -0.21877017   -0.00508144    0.01424860   -0.00308970
H    2.39794201   -2.09620474    0.14838054   -0.00022870    0.00057211    0.00435551
C    2.33544034   -0.01901130    0.00586942   -0.01801652   -0.04520533    0.00992721
H    3.42932888   -0.04691534   -0.16811267    0.01204056   -0.00917872   -0.00840752
   15
   -420.53569804
H   -2.57164122    0.40701735    0.01048850    0.00902532   -0.00170811    0.00132641
O   -2.03735180    1.24987649    0.03839632   -0.00700837    0.00971661   -0.00810367
O   -1.92133249   -1.24627645   -0.09772430    0.00997394    0.00426649    0.00124792
C   -0.80134191    0.73572668    0.11778278   -0.00446355   -0.00885728    0.02120391
C   -0.78863289   -0.72805442   -0.00315868   -0.00770131    0.01076777   -0.00853604
C    0.28020072    1.57700707   -0.03253547    0.00505223    0.01691295   -0.00765177
C    0.40314778   -1.55473466    0.01586481    0.01685272   -0.00794674    0.00145806
C    1.64929080    1.18703311   -0.04601931   -0.01253725   -0.04152747    0.01143836
C    1.73335647   -1.23599084    0.06166083    0.01230816    0.04351023   -0.00804106
H   -0.04689657    2.60975669   -0.19792834   -0.01415599    0.00091920   -0.00378756
H    0.13710874   -2.59474151   -0.07306033    0.00035847    0.00806887   -0.00332382
H    2.24201724    2.11093450   -0.21411738   -0.00360042    0.01503041   -0.00339479
H    2.38955049   -2.09916075    0.16351937   -0.00170250    0.00105886    0.00539659
C    2.34025131   -0.01728851    0.00449155   -0.01493522   -0.04173115    0.00984847
H    3.43346913   -0.04023851   -0.17806654    0.01248664   -0.00843163   -0.00907217
   15
   -420.53604556
H   -2.57205066    0.40080122    0.00950616    0.00775815   -0.00359227    0.00118938
O   -2.04123533    1.24950373    0.03851434   -0.01070368    0.01295330   -0.00783287
O   -1.92327798   -1.24628645   -0.09632202    0.01028331    0.00482463    0.00128816
C   -0.79816608    0.73576612    0.11572256    0.00105105   -0.00983474    0.02100429
C   -0.78978245   -0.73163784   -0.00340170   -0.00834428    0.00663032   -0.00858027
C    0.28145517    1.57995369   -0.03370668    0.00438390    0.01882506   -0.00778608
C    0.40150374   -1.55518565    0.01637861    0.01560727   -0.00731348    0.00239443
C    1.65017816    1.18733997   -0.04148564   -0.01426029   -0.04146258    0.01264035
C    1.73333712   -1.23690660    0.05973718    0.01194853    0.03957729   -0.00915335
H   -0.03870020    2.61229677   -0.20477699   -0.01313809    0.00037463   -0.00408618
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H    2.24978839    2.10704848   -0.20885663   -0.00264434    0.01439955   -0.00347686
H    2.38146429   -2.10230730    0.17768849   -0.00307993    0.00152251    0.00633052
C    2.34528560   -0.01493590    0.00296528   -0.00980436   -0.03729891    0.00935913
H    3.43538384   -0.03204496   -0.18639191    0.01137636   -0.00757303   -0.00940336
   15
   -420.53657262
H   -2.57385190    0.39523212    0.00831028    0.00615389   -0.00550802    0.00101446
O   -2.04499788    1.24898431    0.03872113   -0.01394343    0.01594455   -0.00746964
O   -1.92533986   -1.24635111   -0.09493431    0.01030843    0.00529693    0.00128105
C   -0.79500611    0.73595366    0.11334492    0.00651382   -0.01032107    0.02067348
C   -0.79080649   -0.73532143   -0.00351513   -0.00844866    0.00240343   -0.00850543
C    0.28264400    1.58261599   -0.03476023    0.00316832    0.02048321   -0.00786908
C    0.39962383   -1.55552760    0.01685623    0.01426237   -0.00542037    0.00331382
C    1.65128035    1.18827158   -0.03714267   -0.01532607   -0.03962467    0.01350242
C    1.73313782   -1.23841962    0.05795166    0.01098915    0.03473065   -0.01005054
H   -0.02814381    2.61477353   -0.21089116   -0.01175945   -0.00043859   -0.00430837
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H    2.25804324    2.10059029   -0.20297290   -0.00223170    0.01237643   -0.00333411
H    2.37392942   -2.10572628    0.19071945   -0.00424252    0.00187961    0.00716446
C    2.35046587   -0.01202028    0.00129800   -0.00283822   -0.03210577    0.00846537
H    3.43527145   -0.02248937   -0.19302938    0.00882435   -0.00661945   -0.00939081
   15
   -420.53712040
H   -2.57676120    0.39065201    0.00693240    0.00446219   -0.00720817    0.00081106
O   -2.04860260    1.24828475    0.03901259   -0.01683461    0.01834430   -0.00703063
O   -1.92751838   -1.24647576   -0.09356110    0.01000772    0.00566643    0.00122896
C   -0.79194438    0.73629667    0.11065485    0.01176017   -0.01033931    0.02021515
C   -0.79170347   -0.73904136   -0.00350012   -0.00797370   -0.00182248   -0.00830392
C    0.28378541    1.58496906   -0.03569490    0.00153849    0.02176435   -0.00787832
C    0.39752847   -1.55578883    0.01728380    0.01274779   -0.00252155    0.00418578
C    1.65261347    1.18980032   -0.03300344   -0.01572518   -0.03615951    0.01403537
C    1.73277306   -1.24045699    0.05631784    0.00947991    0.02928796   -0.01073879
H   -0.01547375    2.61733034   -0.21623019   -0.01012081   -0.00135138   -0.00448308
H    0.12006400   -2.59739126   -0.08678129   -0.00253905    0.00524781   -0.00507750
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H    2.36715512   -2.10948019    0.20246177   -0.00513386    0.00204074    0.00790339
C    2.35568728   -0.00861987   -0.00049683    0.00557889   -0.02637649    0.00720235
H    3.43358827   -0.01174299   -0.19798102    0.00504734   -0.00560300   -0.00905249
   15
   -420.53755622
H   -2.58047522    0.38736331    0.00540869    0.00285425   -0.00846663    0.00059404
O   -2.05201658    1.24737783    0.03938374   -0.01949216    0.01996308   -0.00652556
O   -1.92981011   -1.24666459   -0.09220178    0.00935860    0.00592545    0.00113119
C   -0.78906004    0.73679549    0.10765929    0.01665284   -0.00993112    0.01962879
C   -0.79248062   -0.74273386   -0.00335971   -0.00691209   -0.00595087   -0.00797362
C    0.28490392    1.58699368   -0.03651057   -0.00038115    0.02253269   -0.00780558
C    0.39524066   -1.55601274    0.01764817    0.01099531    0.00103787    0.00497377
C    1.65418359    1.19187414   -0.02907607   -0.01549899   -0.03133978    0.01427416
C    1.73226551   -1.24293683    0.05484616    0.00752997    0.02356599   -0.01122767
H   -0.00098464    2.62012982   -0.22076245   -0.00827646   -0.00221559   -0.00463593
H    0.11504879   -2.60052184   -0.08967241   -0.00356559    0.00303213   -0.00567175
H    2.27580398    2.08162883   -0.18947385   -0.00296680    0.00483176   -0.00249650
H    2.36130250   -2.11359656    0.21278200   -0.00571209    0.00195177    0.00855741
C    2.36082325   -0.00482105   -0.00240020    0.01489378   -0.02031792    0.00565071
H    3.43100853    0.00001152   -0.20130659    0.00044001   -0.00454858   -0.00845762
   15
   -420.53778382
H   -2.58470658    0.38559002    0.00377796    0.00148711   -0.00911834    0.00038020
O   -2.05520958    1.24624532    0.03982886   -0.02200115    0.02064192   -0.00597077
O   -1.93220767   -1.24692053   -0.09085525    0.00835926    0.00607047    0.00098938
C   -0.78642690    0.73744402    0.10436709    0.02106316   -0.00915230    0.01892511
C   -0.79315393   -0.74633660   -0.00309890   -0.00528847   -0.00989320   -0.00751625
C    0.28602840    1.58867838   -0.03720833   -0.00244887    0.02264670   -0.00762925
C    0.39278700   -1.55625265    0.01793751    0.00892414    0.00486299    0.00562831
C    1.65598745    1.19442066   -0.02536424   -0.01476497   -0.02557207    0.01428641
C    1.73164449   -1.24577297    0.05354402    0.00527759    0.01783796   -0.01153353
H    0.01499396    2.62332507   -0.22446042   -0.00632483   -0.00286286   -0.00477229
H    0.11067389   -2.60419641   -0.09154318   -0.00447912    0.00068728   -0.00621218
H    2.28543885    2.07047525   -0.18200799   -0.00386911   -0.00008878   -0.00190656
H    2.35647378   -2.11806018    0.22156276   -0.00596713    0.00158699    0.00913456
C    2.36573383   -0.00071519   -0.00438880    0.02437027   -0.01413123    0.00393624
H    3.42835350    0.01258459   -0.20311170   -0.00443100   -0.00347694   -0.00771090
   15
   -420.53775447
H   -2.58921059    0.38544763    0.00207887    0.00048208   -0.00905700    0.00017030
O   -2.05815310    1.24487962    0.04034169   -0.02441779    0.02027023   -0.00538780
O   -1.93469976   -1.24724522   -0.08951991    0.00703120    0.00610084    0.00080784
C   -0.78411151    0.73823054    0.10078889    0.02488948   -0.00805840    0.01811082
C   -0.79374788   -0.74979005   -0.00272460   -0.00316527   -0.01357350   -0.00693817
C    0.28718992    1.59002159   -0.03779089   -0.00452785    0.02200085   -0.00733467
C    0.39019885   -1.55656588    0.01814196    0.00648620    0.00856088    0.00610576
C    1.65801424    1.19735330   -0.02186823   -0.01375537   -0.01939391    0.01415492
C    1.73094384   -1.24887904    0.05241605    0.00288326    0.01229611   -0.01165961
H    0.03211111    2.62702975   -0.22729846   -0.00434137   -0.00312046   -0.00494375
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H    2.29577168    2.05933930   -0.17419930   -0.00483805   -0.00514731   -0.00130173
H    2.35271480   -2.12280622    0.22870022   -0.00591772    0.00097843    0.00963333
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   15
   -420.53757546
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O   -1.93727134   -1.24763901   -0.08819370    0.00541521    0.00602469    0.00058555
C   -0.78217162    0.73913862    0.09693698    0.02804548   -0.00672308    0.01719469
C   -0.79429446   -0.75303869   -0.00224553   -0.00063994   -0.01691546   -0.00624753
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C    2.37432104    0.00804496   -0.00851864    0.04022691   -0.00206217    0.00066071
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   15
   -420.53731054
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O   -1.93990413   -1.24810105   -0.08687412    0.00357292    0.00585190    0.00032854
C   -0.78065487    0.74014811    0.09282520    0.03047400   -0.00520953    0.01619221
C   -0.79483170   -0.75603206   -0.00167213    0.00216147   -0.01986121   -0.00545275
C    0.28974751    1.59173457   -0.03863006   -0.00825492    0.01838783   -0.00638731
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C    2.37775989    0.01251716   -0.01061069    0.04499045    0.00352535   -0.00061747
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   15
   -420.53708125
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O   -1.94257731   -1.24862938   -0.08555824    0.00158182    0.00559049    0.00004254
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C   -0.79540177   -0.75872567   -0.00101641    0.00508144   -0.02235745   -0.00456550
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C    0.38202425   -1.55846359    0.01819067   -0.00293783    0.01600668    0.00618700
C    1.66528956    1.20756839   -0.01265485   -0.01215195   -0.00458802    0.01385745
C    1.72872069   -1.25900421    0.05008229   -0.00361386   -0.00231592   -0.01091274
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C    2.38052202    0.01693668   -0.01269386    0.04694882    0.00862736   -0.00153051
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   15
   -420.53694132
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O   -1.94526837   -1.24922105   -0.08424283   -0.00047055    0.00524818   -0.00026734
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C    0.29279883    1.59234715   -0.03908447   -0.01088818    0.01248418   -0.00513548
C    0.37932080   -1.55954017    0.01801734   -0.00654354    0.01668722    0.00573700
C    1.66808656    1.21119810   -0.01000376   -0.01294166   -0.00238501    0.01398272
C    1.72804809   -1.26240279    0.04964185   -0.00513691   -0.00649388   -0.01026150
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H    2.34633266    2.03129343   -0.14136158   -0.00274354   -0.01620908   -0.00044524
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C    2.38257764    0.02122644   -0.01475430    0.04615482    0.01315813   -0.00211579
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   15
   -420.53680193
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C   -0.77895195    0.74354998    0.07908768    0.03306418   -0.00027376    0.01278296
C   -0.79681554   -0.76307034    0.00048729    0.01062946   -0.02583542   -0.00257613
C    0.29456206    1.59234690   -0.03919033   -0.01167308    0.00926111   -0.00450392
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C    1.67108007    1.21486572   -0.00756422   -0.01441295   -0.00168176    0.01420368
C    1.72745259   -1.26570352    0.04935631   -0.00620107   -0.01038998   -0.00940291
H    0.12241518    2.65181685   -0.22728826    0.00501753    0.00206452   -0.00621210
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H    2.34839444   -2.14604219    0.23721812   -0.00340712   -0.00333747    0.01048294
C    2.38393804    0.02531792   -0.01678298    0.04312104    0.01709449   -0.00250430
H    3.44693657    0.09400325   -0.18820173   -0.00535738    0.00403573   -0.00660011
   15
   -420.53665717
H   -2.61685153    0.40943544   -0.00790424    0.00162377    0.00348006   -0.00031589
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C    0.29650136    1.59220640   -0.03922803   -0.01208561    0.00622970   -0.00394191
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C    1.67429199    1.21856020   -0.00533946   -0.01626452   -0.00216521    0.01444904
C    1.72695030   -1.26884745    0.04921269   -0.00679788   -0.01404888   -0.00833715
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H    0.10610407   -2.61898451   -0.07076489   -0.00341313   -0.00127741   -0.00615730
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C    2.38464832    0.02915166   -0.01877388    0.03853600    0.02042824   -0.00281451
H    3.45608930    0.10647410   -0.18173968   -0.00010490    0.00558756   -0.00697929
   15
   -420.53647428
H   -2.62193958    0.41396802   -0.00939900    0.00183258    0.00559348   -0.00031617
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O   -1.95321931   -1.25133401   -0.08026322   -0.00614852    0.00389734   -0.00128744
C   -0.78028946    0.74588168    0.06893436    0.03076544    0.00276822    0.01030289
C   -0.79886493   -0.76586360    0.00214584    0.01474873   -0.02710049   -0.00039551
C    0.29862292    1.59197117   -0.03920602   -0.01211568    0.00364869   -0.00347903
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C    1.67774980    1.22228823   -0.00333309   -0.01808778   -0.00335916    0.01464458
C    1.72655023   -1.27177924    0.04919489   -0.00693453   -0.01749957   -0.00707424
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H    2.38900780    2.03793909   -0.11563140    0.00758061   -0.01022168   -0.00155031
H    2.35169594   -2.15223833    0.22748411   -0.00258927   -0.00421494    0.00979978
C    2.38477682    0.03267721   -0.02072215    0.03322332    0.02319175   -0.00317984
H    3.46525953    0.11793903   -0.17402319    0.00523486    0.00712099   -0.00723436
   15
   -420.53627113
H   -2.62735088    0.41750427   -0.01083569    0.00154320    0.00693770   -0.00036082
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O   -1.95575744   -1.25213395   -0.07891271   -0.00764538    0.00337859   -0.00163633
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C   -0.80020939   -0.76664926    0.00299241    0.01596289   -0.02686675    0.00073047
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C    0.37003128   -1.56624761    0.01657044   -0.01962486    0.01082687    0.00221312
C    1.68148046    1.22606739   -0.00154801   -0.01943743   -0.00481050    0.01472273
C    1.72625454   -1.27444668    0.04928386   -0.00666602   -0.02074251   -0.00564017
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H    2.40140199    2.04446891   -0.10659341    0.01118974   -0.00706148   -0.00187379
H    2.35407920   -2.15423231    0.21993545   -0.00237191   -0.00430805    0.00923653
C    2.38440300    0.03585276   -0.02262215    0.02790267    0.02542445   -0.00369783
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   15
   -420.53612930
H   -2.63303076    0.41980516   -0.01220667    0.00061146    0.00734041   -0.00044621
O   -2.06933823    1.22593096    0.04690996   -0.03438304   -0.00795018   -0.00019086
O   -1.95820910   -1.25297223   -0.07754364   -0.00886238    0.00285250   -0.00198138
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C   -0.80179440   -0.76702942    0.00382793    0.01651298   -0.02605835    0.00186053
C    0.30340890    1.59136190   -0.03900873   -0.01104935    0.00056784   -0.00296811
C    0.36833752   -1.56841356    0.01608708   -0.02181148    0.00821085    0.00108433
C    1.68550399    1.22991908    0.00001468   -0.01996433   -0.00610119    0.01463939
C    1.72605921   -1.27680078    0.04945791   -0.00604485   -0.02376236   -0.00405890
H    0.18070793    2.66669317   -0.20769273    0.01093635    0.00596850   -0.00625393
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C    2.38360662    0.03864448   -0.02446599    0.02313061    0.02717953   -0.00441299
H    3.47994901    0.13677193   -0.15468745    0.01367032    0.00980563   -0.00703261
   15
   -420.53621967
H   -2.63881186    0.42079783   -0.01349654   -0.00092753    0.00682957   -0.00058522
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O   -1.96056048   -1.25384287   -0.07615210   -0.00978418    0.00232186   -0.00231747
C   -0.78565955    0.74902261    0.05258490    0.02149186    0.00622835    0.00645785
C   -0.80362825   -0.76701623    0.00463533    0.01637160   -0.02470203    0.00298285
C    0.30605724    1.59103421   -0.03884116   -0.00998584    0.00024390   -0.00291202
C    0.36697240   -1.57070396    0.01558727   -0.02321077    0.00578697   -0.00003913
C    1.68982805    1.23386243    0.00135625   -0.01940291   -0.00690729    0.01437961
C    1.72595500   -1.27879597    0.04969322   -0.00517226   -0.02648064   -0.00236823
H    0.19097314    2.66799606   -0.19993563    0.01204123    0.00571951   -0.00595590
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H    2.36011107   -2.15592266    0.19998174   -0.00223112   -0.00391769    0.00773145
C    2.38245938    0.04102582   -0.02624285    0.01929307    0.02847482   -0.00533174
H    3.48396105    0.14365834   -0.14310501    0.01597116    0.01080679   -0.00654482
   15
   -420.53657082
H   -2.64441938    0.42057159   -0.01468013   -0.00291934    0.00558611   -0.00077535
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O   -1.96280115   -1.25473985   -0.07473428   -0.01040546    0.00179324   -0.00264411
C   -0.78817134    0.74990238    0.04691384    0.01698324    0.00705379    0.00517356
C   -0.80570879   -0.76663018    0.00539766    0.01555109   -0.02282290    0.00408182
C    0.30885618    1.59070189   -0.03862940   -0.00859058    0.00070434   -0.00296753
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C    1.69444401    1.23790936    0.00248061   -0.01763178   -0.00702513    0.01395577
C    1.72592885   -1.28039119    0.04996429   -0.00411794   -0.02882516   -0.00061299
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H    2.36373461   -2.15568660    0.18784947   -0.00223733   -0.00355160    0.00684992
C    2.38101895    0.04297710   -0.02793892    0.01664309    0.02935367   -0.00641093
H    3.48512125    0.14860125   -0.13034849    0.01669188    0.01157722   -0.00580299
   15
   -420.53713976
H   -2.64949880    0.41934621   -0.01572352   -0.00510487    0.00389836   -0.00100168
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O   -1.96492408   -1.25565716   -0.07328650   -0.01073113    0.00126975   -0.00295156
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C   -0.80802363   -0.76589958    0.00609830    0.01407422   -0.02048388    0.00514753
C    0.31178466    1.59035812   -0.03837262   -0.00690651    0.00183092   -0.00311228
C    0.36530189   -1.57551830    0.01460669   -0.02369633    0.00233732   -0.00230830
C    1.69932501    1.24206141    0.00339415   -0.01461053   -0.00629600    0.01338606
C    1.72596491   -1.28155111    0.05024452   -0.00300590   -0.03072804    0.00119938
H    0.20484813    2.66767314   -0.18128024    0.01359467    0.00373565   -0.00509055
H    0.12484287   -2.62744981   -0.01098200    0.00214101    0.00642926   -0.00264827
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   15
   -420.53793472
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   15
   -420.53883663
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   15
   -420.53972365
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   15
   -420.54040069
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   15
   -420.54088534
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   15
   -420.54114016
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   15
   -420.54125228
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   15
   -420.54122908
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   15
   -420.54110405
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   15
   -420.54085288
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   15
   -420.54041034
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   15
   -420.53980411
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   15
   -420.53897412
H   -2.59693292    0.38889023   -0.00596920    0.00484115    0.00391792   -0.00124752
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O   -1.98282083   -1.26682123   -0.05045747   -0.00504699   -0.00517178   -0.00502902
C   -0.81075269    0.74777303   -0.03234212   -0.04636092    0.01166135   -0.01007784
C   -0.84148752   -0.74638043    0.00351859   -0.02539161    0.02183386    0.01265632
C    0.34554954    1.57752388   -0.03041521    0.02632891   -0.00072506   -0.00273786
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C    1.75383496    1.29043115    0.00079641    0.03264025    0.00856679    0.00299897
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   15
   -420.53807546
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O   -2.03729223    1.20924749    0.05620712    0.00441607   -0.02045692    0.00604179
O   -1.98365132   -1.26742619   -0.04832911   -0.00494167   -0.00568748   -0.00501443
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C   -0.84262551   -0.74590386    0.00211115   -0.02727066    0.02378984    0.01260700
C    0.34637587    1.57603474   -0.02947761    0.02705712   -0.00170534   -0.00273434
C    0.37880225   -1.60831921    0.01862000    0.01060723   -0.02542537   -0.01083072
C    1.75517929    1.29290034   -0.00011364    0.03134440    0.00631816    0.00171778
C    1.72385713   -1.25314246    0.04102207    0.01618675   -0.00017689    0.01872839
H    0.06921725    2.64313148    0.01487935   -0.00449883    0.00747858    0.00145039
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H    2.43236602   -2.08217201   -0.04121268    0.00300219   -0.00090761   -0.00743045
C    2.32933805    0.02874674   -0.03311113   -0.02234400   -0.01132724   -0.01743464
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   15
   -420.53721217
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O   -1.98442562   -1.26796663   -0.04614390   -0.00499380   -0.00620977   -0.00497256
C   -0.80550427    0.74483247   -0.04215488   -0.04167453    0.01163255   -0.01163694
C   -0.84335175   -0.74578646    0.00051322   -0.02868618    0.02532338    0.01245671
C    0.34679411    1.57457074   -0.02849867    0.02700890   -0.00216808   -0.00272498
C    0.37978982   -1.60941093    0.02008182    0.01260957   -0.02833132   -0.01020768
C    1.75604973    1.29527297   -0.00104966    0.03004220    0.00490526    0.00042956
C    1.72273032   -1.24936968    0.03864013    0.01820703    0.00327610    0.01874826
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H    2.43414932   -2.07284374   -0.05157324    0.00261500    0.00050301   -0.00790135
C    2.32541122    0.02685462   -0.03162243   -0.02718362   -0.01568674   -0.01748272
H    3.42670457   -0.01486072    0.10607052    0.01178840   -0.00350881    0.00798620
   15
   -420.53649238
H   -2.57993024    0.37261206    0.00232176    0.00422560   -0.00173591   -0.00149681
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O   -1.98514309   -1.26843664   -0.04390231   -0.00523076   -0.00672303   -0.00490077
C   -0.80191465    0.74309821   -0.04680316   -0.03758578    0.01161515   -0.01235881
C   -0.84364489   -0.74605142   -0.00127294   -0.02957785    0.02641590    0.01220896
C    0.34680499    1.57313895   -0.02747857    0.02615215   -0.00214886   -0.00268987
C    0.38058677   -1.61007567    0.02169788    0.01457126   -0.03011020   -0.00950191
C    1.75646581    1.29757013   -0.00199223    0.02886675    0.00456636   -0.00081682
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H    2.34071613    2.23208979    0.09993337   -0.00260326    0.01740065    0.00393009
H    2.43546260   -2.06360743   -0.06051314    0.00217155    0.00200931   -0.00824482
C    2.32189313    0.02519947   -0.02986975   -0.03017728   -0.01983826   -0.01724615
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   15
   -420.53599334
H   -2.57591299    0.36728104    0.00560302    0.00329682   -0.00417425   -0.00154871
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C   -0.79775791    0.74118832   -0.05126463   -0.03253911    0.01162380   -0.01303258
C   -0.84349154   -0.74671523   -0.00324358   -0.02988387    0.02704961    0.01186209
C    0.34642141    1.57173914   -0.02641785    0.02451236   -0.00171268   -0.00261143
C    0.38116343   -1.61028679    0.02345755    0.01651357   -0.03053376   -0.00875487
C    1.75644514    1.29979683   -0.00292257    0.02791532    0.00541100   -0.00197046
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H    2.43638353   -2.05473264   -0.06797046    0.00177506    0.00349297   -0.00846673
C    2.31882880    0.02384400   -0.02785674   -0.03118459   -0.02370401   -0.01665456
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   15
   -420.53577893
H   -2.57248897    0.36269895    0.00916259    0.00233047   -0.00644987   -0.00155435
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O   -1.98639450   -1.26914230   -0.03925361   -0.00632171   -0.00767569   -0.00465684
C   -0.79311011    0.73910263   -0.05552913   -0.02672643    0.01167061   -0.01364946
C   -0.84288708   -0.74778745   -0.00539344   -0.02956448    0.02721086    0.01141514
C    0.34566807    1.57036489   -0.02531771    0.02216292   -0.00100222   -0.00248461
C    0.38149050   -1.61003802    0.02534958    0.01839770   -0.02952186   -0.00799225
C    1.75600209    1.30194030   -0.00382328    0.02721686    0.00743828   -0.00299105
C    1.71759742   -1.23853194    0.02981078    0.02234746    0.01170075    0.01751521
H    0.01632201    2.61115940    0.07240883   -0.00865477    0.00046326    0.00312236
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H    2.34273816    2.23243698    0.11395409   -0.00235275    0.01693583    0.00437243
H    2.43698375   -2.04648478   -0.07390543    0.00146727    0.00483500   -0.00856837
C    2.31623345    0.02284649   -0.02559229   -0.03019561   -0.02717785   -0.01571398
H    3.41107217   -0.06122452    0.12899130    0.00979718   -0.00897154    0.00873902
   15
   -420.53578895
H   -2.56948625    0.35927245    0.01300119    0.00149557   -0.00833722   -0.00149278
O   -2.02843158    1.21543994    0.05568602   -0.00211019   -0.00200091    0.00789953
O   -1.98691605   -1.26936719   -0.03684927   -0.00719392   -0.00807035   -0.00448024
C   -0.78805889    0.73684045   -0.05958734   -0.02036351    0.01175820   -0.01420003
C   -0.84183642   -0.74927053   -0.00771576   -0.02858060    0.02689862    0.01086803
C    0.34458033    1.56900565   -0.02418007    0.01922045   -0.00020502   -0.00231564
C    0.38153957   -1.60934454    0.02736242    0.02015542   -0.02716917   -0.00721119
C    1.75514726    1.30397000   -0.00467895    0.02675772    0.01053800   -0.00385662
C    1.71523303   -1.23522106    0.02632716    0.02263189    0.01377015    0.01671879
H    0.00667905    2.60191885    0.08553830   -0.00879575   -0.00237112    0.00330791
H    0.13076240   -2.65154839    0.17148604   -0.00047227    0.00486179    0.00502274
H    2.34438493    2.22798570    0.11980074   -0.00289271    0.01486860    0.00436366
H    2.43731701   -2.03910386   -0.07829926    0.00134452    0.00593560   -0.00857444
C    2.31409236    0.02225926   -0.02309069   -0.02733287   -0.03013131   -0.01441585
H    3.40193602   -0.07386433    0.13350163    0.00616045   -0.01035732    0.00839105
   15
   -420.53596931
H   -2.56675525    0.35733976    0.01710904    0.00088977   -0.00968627   -0.00139029
O   -2.02666638    1.21692017    0.05532883   -0.00454097    0.00118001    0.00815241
O   -1.98735580   -1.26950064   -0.03439416   -0.00827353   -0.00837884   -0.00426023
C   -0.78270017    0.73440045   -0.06343094   -0.01365922    0.01187932   -0.01467655
C   -0.84035449   -0.75115973   -0.01020229   -0.02690525    0.02611193    0.01022360
C    0.34320254    1.56764971   -0.02300743    0.01582413    0.00042341   -0.00212771
C    0.38128418   -1.60824161    0.02948424    0.02168449   -0.02371757   -0.00639302
C    1.75388763    1.30583935   -0.00547651    0.02647614    0.01448114   -0.00455745
C    1.71252734   -1.23211789    0.02259098    0.02218658    0.01543507    0.01574544
H   -0.00138421    2.59310454    0.09807339   -0.00867366   -0.00515837    0.00341737
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H    2.34655768    2.22087243    0.12486404   -0.00379480    0.01177366    0.00420067
H    2.43740486   -2.03278681   -0.08115071    0.00144978    0.00670971   -0.00849101
C    2.31236252    0.02212685   -0.02037155   -0.02283295   -0.03245699   -0.01278500
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   15
   -420.53624705
H   -2.56418858    0.35714142    0.02146622    0.00062094   -0.01037233   -0.00122391
O   -2.02484934    1.21838747    0.05487921   -0.00732507    0.00368607    0.00834054
O   -1.98770153   -1.26953914   -0.03189077   -0.00953361   -0.00859355   -0.00399275
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C   -0.83846662   -0.75344316   -0.01284328   -0.02453558    0.02485911    0.00948298
C    0.34158580    1.56628787   -0.02180262    0.01216691    0.00064968   -0.00194598
C    0.38070137   -1.60678103    0.03170265    0.02285238   -0.01949053   -0.00550735
C    1.75222766    1.30748915   -0.00620534    0.02622616    0.01892238   -0.00510642
C    1.70948714   -1.22924761    0.01861693    0.02096128    0.01668701    0.01459839
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H    2.34941727    2.21164999    0.12917319   -0.00495561    0.00795415    0.00390207
H    2.43722803   -2.02767211   -0.08247477    0.00180811    0.00710386   -0.00832211
C    2.31097644    0.02248425   -0.01745940   -0.01713689   -0.03401741   -0.01089184
H    3.38123944   -0.09336706    0.13811162   -0.00407700   -0.01221352    0.00695923
   15
   -420.53657946
H   -2.56173698    0.35879929    0.02604287    0.00071574   -0.01034564   -0.00100995
O   -2.02294893    1.21981338    0.05433503   -0.01039476    0.00546082    0.00846313
O   -1.98793899   -1.26948028   -0.02934213   -0.01093409   -0.00868057   -0.00368013
C   -0.77146699    0.72897968   -0.07044671   -0.00000853    0.01211099   -0.01538891
C   -0.83620859   -0.75610187   -0.01562753   -0.02149715    0.02314589    0.00864945
C    0.33978513    1.56491708   -0.02056826    0.00845818    0.00021953   -0.00183075
C    0.37977364   -1.60502626    0.03400420    0.02352479   -0.01484586   -0.00451652
C    1.75017119    1.30885283   -0.00685706    0.02587023    0.02339301   -0.00555354
C    1.70613097   -1.22662910    0.01442239    0.01895332    0.01750327    0.01326542
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H    2.35316665    2.20100206    0.13278170   -0.00608810    0.00376098    0.00351050
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C    2.30984874    0.02335496   -0.01438280   -0.01087703   -0.03470567   -0.00882074
H    3.37150673   -0.09989598    0.13846655   -0.00960431   -0.01268146    0.00604923
   15
   -420.53695377
H   -2.55942014    0.36230933    0.03080095    0.00122513   -0.00960141   -0.00076704
O   -2.02093042    1.22117817    0.05369490   -0.01367489    0.00635519    0.00852377
O   -1.98805234   -1.26932306   -0.02675178   -0.01241145   -0.00863900   -0.00331941
C   -0.76579852    0.72599553   -0.07360810    0.00660725    0.01213334   -0.01562599
C   -0.83362634   -0.75911000   -0.01854245   -0.01781573    0.02097965    0.00772873
C    0.33785639    1.56354396   -0.01930612    0.00488832   -0.00100028   -0.00180301
C    0.37849098   -1.60304708    0.03637385    0.02358436   -0.01014202   -0.00338848
C    1.74772404    1.30986345   -0.00742488    0.02511369    0.02734477   -0.00595304
C    1.70248908   -1.22427467    0.01002748    0.01623472    0.01785801    0.01174708
H   -0.01645221    2.57384588    0.13193657   -0.00756839   -0.01045512    0.00367477
H    0.12898228   -2.66070094    0.17454781   -0.00306955   -0.00401926    0.00534583
H    2.35800872    2.18967503    0.13575879   -0.00699572   -0.00028074    0.00310578
H    2.43578167   -2.02126369   -0.08067750    0.00318166    0.00675347   -0.00772982
C    2.30888576    0.02474916   -0.01117290   -0.00486399   -0.03435556   -0.00670112
H    3.36349323   -0.10414559    0.13773208   -0.01442872   -0.01290523    0.00516103
   15
   -420.53748463
H   -2.55732791    0.36753728    0.03569675    0.00205776   -0.00815083   -0.00050517
O   -2.01875667    1.22247144    0.05295812   -0.01708230    0.00652300    0.00853716
O   -1.98802491   -1.26906795   -0.02412383   -0.01389015   -0.00846308   -0.00290937
C   -0.76022951    0.72282806   -0.07653332    0.01287674    0.01203156   -0.01578597
C   -0.83077542   -0.76243482   -0.02157414   -0.01356907    0.01838157    0.00672748
C    0.33585345    1.56218702   -0.01801659    0.00159831   -0.00305596   -0.00189262
C    0.37685256   -1.60091430    0.03879454    0.02295392   -0.00564663   -0.00211576
C    1.74489799    1.31046193   -0.00790266    0.02370201    0.03022095   -0.00637914
C    1.69860249   -1.22218966    0.00545524    0.01289934    0.01773549    0.01001336
H   -0.01865238    2.57087381    0.14192435   -0.00724132   -0.01051658    0.00387967
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H    2.36410258    2.17838932    0.13817560   -0.00735222   -0.00369001    0.00278268
H    2.43426728   -2.01990790   -0.07766343    0.00405449    0.00609233   -0.00727932
C    2.30799765    0.02666143   -0.00786161    0.00006279   -0.03286541   -0.00464776
H    3.35805590   -0.10607408    0.13606636   -0.01776431   -0.01297817    0.00441128
   15
   -420.53815067
H   -2.55561052    0.37422420    0.04068351    0.00319344   -0.00613424   -0.00024648
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O   -1.98783999   -1.26871697   -0.02146291   -0.01528906   -0.00813498   -0.00245601
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   15
   -420.53898943
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O   -1.98748182   -1.26827383   -0.01877419   -0.01650990   -0.00766839   -0.00195928
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   15
   -420.53986103
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O   -1.98693661   -1.26774387   -0.01606327   -0.01746311   -0.00704353   -0.00142804
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C   -0.82128528   -0.77388623   -0.03121313    0.00152000    0.00825174    0.00333596
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   15
   -420.54065785
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O   -1.98619363   -1.26713413   -0.01333619   -0.01806555   -0.00627320   -0.00087175
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C    0.32799486    1.55768550   -0.01253120   -0.00707763   -0.01605985   -0.00318148
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C    1.73044151    1.30823714   -0.00875796    0.00903992    0.02525322   -0.00924414
C    1.68170055   -1.21639561   -0.01403360   -0.00319835    0.01238546    0.00094586
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C    2.30414793    0.03877302    0.00581442    0.00031906   -0.01571201    0.00204063
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   15
   -420.54119335
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O   -1.98524613   -1.26645334   -0.01059923   -0.01823407   -0.00536664   -0.00029987
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C   -0.81494425   -0.78222870   -0.03791990    0.01221235    0.00000559    0.00088593
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C    1.72631668    1.30662052   -0.00865367    0.00385929    0.02049855   -0.01012651
C    1.67744072   -1.21548248   -0.01903440   -0.00704965    0.00995403   -0.00176915
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C    2.30310696    0.04259200    0.00921482   -0.00335358   -0.00948158    0.00355156
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   15
   -420.54141960
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O   -1.98409224   -1.26571181   -0.00785888   -0.01791581   -0.00431718    0.00027642
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C   -0.81201023   -0.78643172   -0.04130271    0.01729899   -0.00435357   -0.00035857
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C    0.36086808   -1.58814441    0.05316910    0.00451502    0.00994329    0.00791628
C    1.72213333    1.30469465   -0.00839638   -0.00118602    0.01518422   -0.01092302
C    1.67328706   -1.21471947   -0.02400833   -0.01054641    0.00720884   -0.00458993
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C    2.30211693    0.04655407    0.01256143   -0.00722237   -0.00300096    0.00515087
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   15
   -420.54134239
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O   -1.99620740    1.23002318    0.04511480   -0.03033761    0.00243519    0.00803728
O   -1.98273559   -1.26492145   -0.00512166   -0.01706665   -0.00312696    0.00084992
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C   -0.80933727   -0.79056889   -0.04468011    0.02198907   -0.00874400   -0.00159238
C    0.32308607    1.55662651   -0.00793838   -0.00923462   -0.02176202   -0.00362630
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C    1.71796723    1.30253930   -0.00797414   -0.00568147    0.00978251   -0.01155563
C    1.66929243   -1.21406524   -0.02891278   -0.01364306    0.00426963   -0.00746753
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H    2.39667636   -2.03193789   -0.02685499    0.00521605    0.00068184   -0.00143663
C    2.30123559    0.05056166    0.01583011   -0.01067316    0.00342948    0.00683910
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   15
   -420.54101532
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O   -1.99166804    1.23098336    0.04361993   -0.02848141    0.00395418    0.00780252
O   -1.98118586   -1.26409573   -0.00239406   -0.01565504   -0.00181181    0.00140784
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C   -0.80699614   -0.79457397   -0.04803343    0.02614622   -0.01305207   -0.00282213
C    0.32171887    1.55690534   -0.00629875   -0.00936171   -0.02142589   -0.00338928
C    0.35436532   -1.58479402    0.05729079   -0.00491542    0.01222447    0.01131933
C    1.71388598    1.30023568   -0.00737746   -0.00929891    0.00467543   -0.01196192
C    1.66550350   -1.21347550   -0.03370432   -0.01627652    0.00125960   -0.01034555
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H    2.38704258   -2.03500125   -0.01717093    0.00407260    0.00052467   -0.00041416
C    2.30051454    0.05451769    0.01899528   -0.01323059    0.00960738    0.00862387
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   15
   -420.54050181
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O   -1.97945907   -1.26324957    0.00031758   -0.01367616   -0.00037192    0.00194080
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C   -0.80504950   -0.79838193   -0.05134411    0.02961193   -0.01716960   -0.00403662
C    0.32049293    1.55750657   -0.00460815   -0.00925416   -0.01981584   -0.00293017
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C    1.66196011   -1.21290492   -0.03833951   -0.01847703   -0.00166529   -0.01317394
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H    2.37667888   -2.03816149   -0.00741196    0.00267050    0.00051911    0.00058310
C    2.29999210    0.05832900    0.02202999   -0.01459953    0.01533064    0.01047785
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   15
   -420.53994885
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O   -1.98165541    1.23274519    0.04036856   -0.02191589    0.00815756    0.00708044
O   -1.97757766   -1.26239927    0.00300723   -0.01113996    0.00117292    0.00244484
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C    0.31940664    1.55840594   -0.00287354   -0.00893296   -0.01699819   -0.00225046
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C    1.65869554   -1.21230949   -0.04277564   -0.02026782   -0.00433866   -0.01590168
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C    2.29968873    0.06190922    0.02490630   -0.01460651    0.02044488    0.01234019
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   15
   -420.53936210
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C   -0.72598700    0.67937825   -0.09295965    0.03479304   -0.01047588   -0.01503986
C   -0.80253604   -0.80516284   -0.05776437    0.03392210   -0.02435012   -0.00640851
C    0.31845516    1.55956104   -0.00110511   -0.00841498   -0.01312828   -0.00139115
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C    1.70261091    1.29315599   -0.00449890   -0.01315264   -0.00633086   -0.01164719
C    1.65573702   -1.21164898   -0.04697152   -0.02173687   -0.00660304   -0.01849406
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H    2.35479650   -2.04478399    0.01162166   -0.00052464    0.00071399    0.00243052
C    2.29960443    0.06518117    0.02759612   -0.01318651    0.02482959    0.01415454
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   15
   -420.53874113
H   -2.59252959    0.45189621    0.08939836   -0.00624767   -0.00302435    0.00270116
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O   -1.97347194   -1.26075720    0.00829821   -0.00451931    0.00451363    0.00332884
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C   -0.80203408   -0.80802750   -0.06083810    0.03452717   -0.02719953   -0.00756924
C    0.31763067    1.56091369    0.00068419   -0.00770362   -0.00847604   -0.00040276
C    0.34276566   -1.58053053    0.06330585   -0.02043561    0.02044979    0.01685238
C    1.69924014    1.29092447   -0.00318181   -0.01205123   -0.00816248   -0.01107442
C    1.65310683   -1.21088933   -0.05088799   -0.02293952   -0.00830700   -0.02091541
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H    2.43195876    2.10377797    0.12085324    0.01453987   -0.00276322    0.00345462
H    2.34384876   -2.04827970    0.02056426   -0.00209402    0.00075672    0.00325994
C    2.29971779    0.06807869    0.03007207   -0.01037884    0.02839459    0.01585676
H    3.40639630    0.03636914    0.06609855    0.01307193   -0.00052094    0.00036480
   15
   -420.53809741
H   -2.59663287    0.45824276    0.09205244   -0.00788514   -0.00387913    0.00299200
O   -1.96490597    1.23464938    0.03490343   -0.00878298    0.01224887    0.00561587
O   -1.97132264   -1.26000330    0.01088947   -0.00053859    0.00626898    0.00370778
C   -0.72676390    0.67173593   -0.09291569    0.02735616   -0.01837602   -0.01454310
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   15
   -420.53738491
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   15
   -420.53654499
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   15
   -420.53567251
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   15
   -420.53483303
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   15
   -420.53410936
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   15
   -420.53360377
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   15
   -420.53328494
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   15
   -420.53314110
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   15
   -420.53310266
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   15
   -420.53311744
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   15
   -420.53319746
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O   -1.95838796   -1.26019944    0.03604038    0.03849373    0.01564284    0.00570680
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   15
   -420.53337446
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O   -1.95929760   -1.26126405    0.03797386    0.03784955    0.01429295    0.00598947
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C    0.33987264   -1.60290559    0.05046177   -0.00765692   -0.00865324    0.02287499
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   15
   -420.53370752
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   15
   -420.53425738
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O   -1.96238193   -1.26385769    0.04163276    0.03326671    0.01021170    0.00676875
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C    1.65680385    1.27764369    0.02990892   -0.01679521   -0.02488273    0.00128820
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   15
   -420.53501038
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O   -1.96450479   -1.26534054    0.04334936    0.02946962    0.00760329    0.00725084
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C    1.65484523    1.27908731    0.03245923   -0.01785998   -0.02215724    0.00230709
C    1.66041887   -1.19354425   -0.05722976   -0.00850044    0.02361688   -0.02201244
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H    2.31957817   -2.05646095    0.02285034   -0.00764772   -0.00217819    0.00440392
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H    3.39560610    0.15833155   -0.03032017    0.01166990    0.01292740   -0.00334257
   15
   -420.53593072
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O   -1.96696116   -1.26690936    0.04498367    0.02483839    0.00471062    0.00777195
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C   -0.82892529   -0.79629364   -0.08207848   -0.02462358    0.00818688   -0.02338761
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C    0.34621669   -1.61297287    0.03489054   -0.00019470   -0.01976291    0.01786309
C    1.65315590    1.28086434    0.03497471   -0.01830338   -0.01812361    0.00328509
C    1.66324732   -1.19397432   -0.05404653   -0.00628143    0.02459585   -0.01968993
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H    2.33030678   -2.05095566    0.01338247   -0.00687294   -0.00124390    0.00361366
C    2.29434297    0.05671455    0.02736212   -0.00972620   -0.01650462    0.01424366
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   15
   -420.53688201
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O   -1.96969866   -1.26853148    0.04652979    0.01953893    0.00165835    0.00830859
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C    1.65174265    1.28291405    0.03744060   -0.01820397   -0.01298132    0.00419762
C    1.66617107   -1.19477583   -0.05056578   -0.00431869    0.02519505   -0.01721882
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H    2.34226810   -2.04522452    0.00326523   -0.00579460   -0.00042208    0.00276758
C    2.29429135    0.05513441    0.02467946   -0.00617509   -0.01950287    0.01265592
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   15
   -420.53773376
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O   -1.97265737   -1.27017233    0.04798167    0.01377022   -0.00146307    0.00883881
C   -0.73519915    0.67438565   -0.06131658   -0.01508222    0.00420512   -0.00281245
C   -0.82850459   -0.79200586   -0.07892275   -0.01969106    0.01509026   -0.02391430
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C    0.34951439   -1.61634098    0.02539906    0.00219913   -0.01809750    0.01382376
C    1.65060415    1.28515907    0.03984313   -0.01770526   -0.00703979    0.00503146
C    1.66916048   -1.19595779   -0.04682488   -0.00265229    0.02541056   -0.01461297
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C    2.29433179    0.05384823    0.02180561   -0.00155584   -0.02174898    0.01094291
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   15
   -420.53836119
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C   -0.82782733   -0.79017874   -0.07680425   -0.01626455    0.01794277   -0.02395759
C    0.29742258    1.56507252    0.02499472   -0.00777402    0.00301606    0.00572225
C    0.35112198   -1.61760609    0.02032392    0.00291105   -0.01622353    0.01152875
C    1.64973308    1.28751011    0.04216969   -0.01701394   -0.00075112    0.00578287
C    1.67219035   -1.19752348   -0.04286319   -0.00127774    0.02523750   -0.01189571
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C    2.29439500    0.05289004    0.01876640    0.00362935   -0.02322800    0.00914695
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   15
   -420.53875807
H   -2.56478967    0.51267610    0.03523323   -0.00307596   -0.00150186    0.00193307
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O   -1.97897427   -1.27336944    0.05057910    0.00159686   -0.00750419    0.00977693
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C    0.29578270    1.56401847    0.02532853   -0.01165978    0.00090709    0.00545979
C    0.35268600   -1.61862634    0.01507461    0.00329295   -0.01405662    0.00910677
C    1.64911931    1.28987271    0.04440892   -0.01640118    0.00533460    0.00645864
C    1.67523986   -1.19947028   -0.03872174   -0.00018212    0.02466624   -0.00908228
H   -0.02212775    2.59449201    0.02508044   -0.00014331   -0.00629406   -0.00270246
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H    2.38333217   -2.02799980   -0.02943123   -0.00082617    0.00103243    0.00001778
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   15
   -420.53888291
H   -2.55905358    0.51197843    0.02740523   -0.00061621   -0.00006065    0.00153624
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O   -1.98219472   -1.27485732    0.05171406   -0.00442612   -0.01025281    0.01013753
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C    0.35420102   -1.61943410    0.00968763    0.00325002   -0.01190569    0.00663548
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C    1.67829236   -1.20178945   -0.03444309    0.00070555    0.02363998   -0.00618648
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H    2.39775429   -2.02253970   -0.04056162    0.00122048    0.00126259   -0.00095840
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H    3.36740218    0.05702570   -0.03321772   -0.00899180   -0.00067799   -0.00137451
   15
   -420.53884723
H   -2.55321030    0.51128926    0.01930051    0.00207781    0.00159280    0.00114362
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C    0.35566733   -1.62006151    0.00420033    0.00287702   -0.01002874    0.00416045
C    1.64863383    1.29428051    0.04858518   -0.01656731    0.01440555    0.00766819
C    1.68133433   -1.20446549   -0.03007097    0.00146206    0.02212729   -0.00323302
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C    2.29396458    0.05214714    0.00892995    0.01568651   -0.02290855    0.00369991
H    3.36418805    0.03799831   -0.03245064   -0.01123419   -0.00312161   -0.00108835
   15
   -420.53873554
H   -2.54773986    0.51031522    0.01098957    0.00466378    0.00315023    0.00077563
O   -1.89822875    1.25464511   -0.01702724    0.03905067   -0.00864042    0.00113786
O   -1.98842054   -1.27745706    0.05363627   -0.01553403   -0.01485413    0.01055668
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C   -0.82325254   -0.78589697   -0.06474195   -0.00034831    0.02428235   -0.02238482
C    0.29212814    1.56097199    0.02585256   -0.02086203   -0.01023066    0.00459390
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C    1.64876514    1.29618971    0.05050387   -0.01777407    0.01642965    0.00823700
C    1.68435426   -1.20747544   -0.02565000    0.00215930    0.02006975   -0.00025248
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H    2.22375045    2.19746884    0.00932446   -0.01652405   -0.00621267   -0.00374416
H    2.42556606   -2.01233659   -0.06212613    0.00525166    0.00169585   -0.00293586
C    2.29341334    0.05260460    0.00550296    0.01643014   -0.02115411    0.00197250
H    3.36297055    0.01953245   -0.03148663   -0.01169378   -0.00552977   -0.00086936
   15
   -420.53861045
H   -2.54310267    0.50878016    0.00253843    0.00679710    0.00427788    0.00044925
O   -1.90162956    1.25694282   -0.01936738    0.03287644   -0.00746536    0.00139445
O   -1.99130015   -1.27851679    0.05441879   -0.02035914   -0.01662248    0.01059539
C   -0.72040540    0.68706520   -0.04468513    0.02582730    0.02521546   -0.00008245
C   -0.82194343   -0.78570306   -0.06085901    0.00340207    0.02452990   -0.02152386
C    0.29148590    1.56018169    0.02588260   -0.02262545   -0.01484134    0.00435029
C    0.35848119   -1.62088163   -0.00692661    0.00121876   -0.00764147   -0.00059991
C    1.64916619    1.29785285    0.05229804   -0.01978955    0.01653947    0.00878735
C    1.68734149   -1.21078819   -0.02122522    0.00288735    0.01746435    0.00272216
H   -0.05364421    2.58563557   -0.00364053   -0.00412638   -0.00537800   -0.00374445
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   15
   -420.53847205
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O   -1.99394937   -1.27938833    0.05508123   -0.02457107   -0.01799581    0.01051749
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C    1.69028497   -1.21436432   -0.01684153    0.00370713    0.01428862    0.00564829
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   15
   -420.53829824
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O   -1.99632050   -1.28005608    0.05562448   -0.02810291   -0.01896814    0.01032061
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C    1.65090769    1.30045840    0.05548012   -0.02535286    0.01215796    0.00975894
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C    2.29038969    0.05572120   -0.00485677    0.00765636   -0.01110911   -0.00294281
H    3.37052487   -0.02819076   -0.02776767   -0.00340685   -0.01247098   -0.00041863
   15
   -420.53809905
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O   -1.99837351   -1.28050905    0.05605076   -0.03091318   -0.01952666    0.01001429
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C    0.29165431    1.55940982    0.02558990   -0.02329998   -0.02569307    0.00380284
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   15
   -420.53783549
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O   -2.00007657   -1.28074087    0.05636352   -0.03297405   -0.01967395    0.00961446
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C    0.29242028    1.55986687    0.02537398   -0.02210180   -0.02703643    0.00363448
C    0.36404208   -1.62113167   -0.02881786   -0.00364164   -0.00798696   -0.00873248
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C    1.69871749   -1.22615386   -0.00437108    0.00708721    0.00184811    0.01369330
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   15
   -420.53764640
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O   -2.00140628   -1.28074992    0.05656736   -0.03430820   -0.01938567    0.00910164
C   -0.71726586    0.68823956   -0.03069527    0.04279752    0.02089742    0.00096729
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C    0.29351984    1.56073087    0.02510316   -0.02035464   -0.02686269    0.00343470
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C    1.70133888   -1.23022865   -0.00057615    0.00851280   -0.00292975    0.01599350
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C    2.28638061    0.06030260   -0.01481752   -0.00619844    0.00296205   -0.00769221
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   15
   -420.53760623
H   -2.54392772    0.48623504   -0.04815967    0.00366001   -0.00409010   -0.00122634
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O   -2.00234748   -1.28053943    0.05666803   -0.03490609   -0.01869313    0.00850928
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C    0.29492661    1.56199913    0.02478047   -0.01815131   -0.02513036    0.00318865
C    0.36707511   -1.62055503   -0.03908997   -0.00529472   -0.00792114   -0.01215714
C    1.65927378    1.30390082    0.06004320   -0.03204338   -0.00016780    0.01047911
C    1.70383149   -1.23425910    0.00297725    0.01000108   -0.00775131    0.01805745
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C    2.28514269    0.06183652   -0.01793688   -0.00943312    0.00752719   -0.00921334
H    3.38536938   -0.05924493   -0.02195628    0.01008251   -0.01830251    0.00044321
   15
   -420.53781182
H   -2.54787475    0.48269178   -0.05614434    0.00200631   -0.00636315   -0.00155350
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O   -2.00289339   -1.28011727    0.05667224   -0.03479359   -0.01759327    0.00784226
C   -0.72029944    0.68630824   -0.02518496    0.04030721    0.01286229    0.00105489
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C    0.29660745    1.56364559    0.02440965   -0.01563255   -0.02194234    0.00288020
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C    1.66254329    1.30466517    0.06079038   -0.03100931   -0.00147054    0.01036312
C    1.70617292   -1.23817254    0.00625794    0.01145016   -0.01241072    0.01988322
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H    2.48280290   -1.99268817   -0.11546484    0.00799483    0.00829640   -0.00766521
C    2.28404600    0.06325713   -0.02091702   -0.01151088    0.01167911   -0.01066616
H    3.38574731   -0.05925221   -0.02059418    0.01084799   -0.01851009    0.00070024
   15
   -420.53825341
H   -2.55218822    0.48028666   -0.06384983    0.00071271   -0.00813118   -0.00186730
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O   -2.00304525   -1.27949589    0.05658755   -0.03400091   -0.01610222    0.00710765
C   -0.72274250    0.68501888   -0.02245348    0.03723507    0.00794638    0.00105968
C   -0.81675244   -0.79628402   -0.01974179    0.01679462    0.01082924   -0.00876321
C    0.29852437    1.56562228    0.02399536   -0.01290977   -0.01750229    0.00249930
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C    1.66628003    1.30545040    0.06138099   -0.02862046   -0.00165080    0.01015876
C    1.70834142   -1.24189874    0.00923832    0.01274473   -0.01672047    0.02145294
H   -0.06908354    2.59377568   -0.02735862   -0.00824417    0.00047128   -0.00396330
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   15
   -420.53897776
H   -2.55663755    0.47933517   -0.07121979   -0.00006677   -0.00919649   -0.00214539
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O   -2.00281201   -1.27869219    0.05642228   -0.03256198   -0.01423900    0.00631565
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C    1.67044788    1.30625920    0.06181807   -0.02488198   -0.00068582    0.00989560
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H    2.48115252   -1.99904191   -0.11629813    0.00566125    0.00939761   -0.00759469
C    2.28238261    0.06551676   -0.02637327   -0.01195145    0.01815267   -0.01327665
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   15
   -420.53981930
H   -2.56108343    0.48002769   -0.07820417   -0.00025379   -0.00946087   -0.00237604
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O   -2.00220997   -1.27772726    0.05618541   -0.03050682   -0.01203876    0.00547926
C   -0.72925267    0.68216040   -0.01703843    0.02830642   -0.00273796    0.00104372
C   -0.81778180   -0.80129118   -0.00757626    0.01470501    0.00449867   -0.00446787
C    0.30290130    1.57028554    0.02306060   -0.00731813   -0.00625363    0.00151686
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C    1.67499040    1.30707708    0.06210557   -0.01989215    0.00135218    0.00960008
C    1.71208668   -1.24853884    0.01420694    0.01429287   -0.02339080    0.02387216
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C    2.28182279    0.06625812   -0.02880996   -0.01050141    0.02030577   -0.01438789
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   15
   -420.54063645
H   -2.56549246    0.48241114   -0.08476182    0.00017181   -0.00888117   -0.00254411
O   -1.95369163    1.27937610   -0.04639259   -0.00075035    0.02710227    0.00158334
O   -2.00126239   -1.27662607    0.05588639   -0.02788599   -0.00950979    0.00460350
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C   -0.81863898   -0.80392108   -0.00137579    0.01284671    0.00112540   -0.00225001
C    0.30527687    1.57280303    0.02255494   -0.00454478   -0.00030094    0.00093645
C    0.37601761   -1.61748304   -0.06115408   -0.00253942    0.00373795   -0.01905903
C    1.67983239    1.30787341    0.06224792   -0.01384034    0.00428492    0.00929789
C    1.71364029   -1.25135227    0.01615853    0.01432941   -0.02542784    0.02474239
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C    2.28142079    0.06669340   -0.03102929   -0.00826011    0.02169840   -0.01534766
H    3.37016699   -0.02726241   -0.01680681    0.00125398   -0.01364887    0.00142931
   15
   -420.54133015
H   -2.56994040    0.48638158   -0.09086219    0.00115259   -0.00749237   -0.00263332
O   -1.95892452    1.28011306   -0.04897226   -0.00376847    0.02639473    0.00132816
O   -1.99999897   -1.27541727    0.05553515   -0.02473034   -0.00672830    0.00370887
C   -0.73746356    0.67946649   -0.01168658    0.01712192   -0.01323962    0.00104147
C   -0.81968977   -0.80656797    0.00485868    0.01046178   -0.00232116   -0.00001054
C    0.30772113    1.57532555    0.02203517   -0.00179793    0.00524811    0.00031738
C    0.37798493   -1.61685329   -0.06477622   -0.00086165    0.00711026   -0.01990626
C    1.68488269    1.30860422    0.06224967   -0.00701668    0.00780457    0.00900776
C    1.71497795   -1.25378247    0.01773631    0.01380590   -0.02646945    0.02538512
H   -0.04238575    2.59705572   -0.02186805   -0.00374319   -0.00636596   -0.00267405
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H    2.37520752    2.14986983    0.08053239    0.00362706   -0.00255897   -0.00029325
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C    2.28114327    0.06680144   -0.03301675   -0.00568457    0.02239100   -0.01614914
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   15
   -420.54173352
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O   -1.99845546   -1.27413238    0.05514185   -0.02109202   -0.00373268    0.00280820
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   15
   -420.54187314
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O   -1.99667309   -1.27280525    0.05471667   -0.01703810   -0.00060364    0.00192116
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C    2.28081264    0.06600396   -0.03625002   -0.00194084    0.02186695   -0.01728596
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   15
   -420.54177935
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O   -1.99469776   -1.27147136    0.05426968   -0.01264877    0.00260350    0.00105762
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C    2.28070442    0.06510611   -0.03747862   -0.00200290    0.02079368   -0.01764313
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   15
   -420.54150247
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O   -1.99257916   -1.27016699    0.05381066   -0.00803231    0.00579720    0.00023653
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H    2.44939018   -2.06637374   -0.07840278    0.00344413   -0.00134062   -0.00521145
C    2.28062872    0.06389450   -0.03844061   -0.00389173    0.01920582   -0.01788184
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   15
   -420.54109048
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O   -1.99036953   -1.26892830    0.05334891   -0.00332254    0.00890536   -0.00052887
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C   -0.82633839   -0.81822014    0.03536114   -0.00771031   -0.01935028    0.01083588
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C    1.70964366    1.30951719    0.06029955    0.02259330    0.01798099    0.00733195
C    1.71892525   -1.26012166    0.01980522    0.00639759   -0.01923459    0.02480252
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   15
   -420.54053282
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O   -1.98812215   -1.26779046    0.05289310    0.00132264    0.01183645   -0.00123072
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C    2.28071583    0.06063366   -0.03955193   -0.01267458    0.01452415   -0.01802826
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   15
   -420.53977565
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C    0.39041178   -1.61709645   -0.08150671    0.01290409    0.00930474   -0.01887726
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C    1.71964865   -1.26039447    0.01796895    0.00417676   -0.01375335    0.02264742
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C    2.28101010    0.05865511   -0.03969905   -0.01849947    0.01150449   -0.01793740
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   15
   -420.53881958
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O   -1.98372148   -1.26594703    0.05203036    0.00969015    0.01681363   -0.00243179
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C    1.72115671    1.30706191    0.05776624    0.02677149    0.01054621    0.00510048
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C    2.28158404    0.05650300   -0.03957510   -0.02430803    0.00816007   -0.01773400
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   15
   -420.53769215
H   -2.64568568    0.53429091   -0.12536646    0.00028439    0.00374595   -0.00278031
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O   -1.98166276   -1.26529772    0.05163707    0.01303271    0.01870202   -0.00293688
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C    0.32624173    1.58963872    0.01832177    0.01729583    0.01154342   -0.00549724
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C    2.28252462    0.05422779   -0.03918314   -0.02940271    0.00462087   -0.01742181
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   15
   -420.53648354
H   -2.65825330    0.53627030   -0.12694360   -0.00317172    0.00216219   -0.00300722
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C   -0.83009714   -0.82274388    0.06184089   -0.02443655   -0.03039209    0.01943815
C    0.32730656    1.59015511    0.01819629    0.01763135    0.01048316   -0.00606768
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C    1.72683796    1.30455401    0.05567226    0.02662937    0.00490181    0.00330657
C    1.72025683   -1.25932820    0.01271020    0.00410337   -0.00725910    0.01785893
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C    2.28390823    0.05188271   -0.03852790   -0.03323389    0.00108117   -0.01700198
H    3.38326369    0.16615712   -0.02608397    0.00725267    0.01653348    0.00050056
   15
   -420.53536008
H   -2.67025125    0.53785873   -0.12797974   -0.00653658    0.00069573   -0.00321311
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O   -1.97801556   -1.26464988    0.05095535    0.01723059    0.02094293   -0.00379310
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C   -0.82990463   -0.82237362    0.06635024   -0.02559789   -0.03118132    0.02076233
C    0.32810538    1.59051240    0.01816250    0.01748565    0.00991796   -0.00658673
C    0.39393383   -1.62044826   -0.08466272    0.01690862   -0.00535586   -0.01555299
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H    2.39175082   -2.12469860    0.00146310   -0.00327330   -0.00895112    0.00176986
C    2.28579233    0.04952117   -0.03761573   -0.03543796   -0.00233331   -0.01648321
H    3.38762523    0.17568216   -0.02800827    0.00911260    0.01834013    0.00022859
   15
   -420.53446106
H   -2.68107942    0.53931527   -0.12843768   -0.00941133   -0.00033023   -0.00337494
O   -2.01078454    1.27255740   -0.07997286   -0.01018476    0.01035466   -0.00172819
O   -1.97647451   -1.26467673    0.05067667    0.01786752    0.02121897   -0.00416453
C   -0.78706610    0.69298976    0.01886888   -0.02579919   -0.02504622    0.00214806
C   -0.82932638   -0.82153262    0.07054583   -0.02569967   -0.03140266    0.02195411
C    0.32864033    1.59071903    0.01822820    0.01690947    0.00990631   -0.00703623
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C    1.73090617    1.30173321    0.05337707    0.02688958    0.00244810    0.00175038
C    1.72035086   -1.25801048    0.00781355    0.00578218   -0.00502335    0.01413970
H    0.07464648    2.66152119    0.02582998    0.00281829    0.00888782    0.00137079
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H    2.44726996    2.14129396    0.15793133    0.01355251    0.00721808    0.00565226
H    2.38375141   -2.12686992    0.01320958   -0.00515499   -0.00796175    0.00288884
C    2.28820999    0.04719452   -0.03645444   -0.03580272   -0.00545056   -0.01587873
H    3.39036589    0.18191383   -0.02997310    0.00962398    0.01958303   -0.00007691
   15
   -420.53392752
H   -2.69022373    0.54082152   -0.12828903   -0.01152006   -0.00070772   -0.00345741
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   15
   -420.53378086
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   15
   -420.53394528
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   15
   -420.53435070
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   15
   -420.53488394
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C   -0.82115208   -0.81043803    0.08626005   -0.01144871   -0.02472248    0.02581008
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   15
   -420.53542109
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   15
   -420.53598036
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C   -0.81627617   -0.80319332    0.08988207   -0.00166562   -0.01940411    0.02626315
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C    2.31715747    0.03491003   -0.02224294    0.00228627   -0.01295157   -0.01005773
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   15
   -420.53657946
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O   -1.96980740   -1.27250322    0.05046338   -0.00497215    0.00607607   -0.00650520
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   15
   -420.53729648
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O   -1.96917699   -1.27410308    0.05073910   -0.00885446    0.00305773   -0.00664395
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   15
   -420.53808320
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C   -0.80895314   -0.79024431    0.09234656    0.01214196   -0.01029601    0.02559926
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C    1.72489880    1.28024078    0.04114100    0.02453635    0.02306249   -0.00107839
C    1.71439831   -1.24807192   -0.02496736    0.00238520    0.00309117   -0.00394604
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   15
   -420.53886626
H   -2.68212608    0.51801094   -0.09543752   -0.00282876    0.01188473   -0.00210443
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O   -1.96757599   -1.27737277    0.05151733   -0.01542634   -0.00288349   -0.00673042
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C    1.72184793    1.27653563    0.03993684    0.01936157    0.02017489   -0.00169645
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H    2.39361271   -2.09870686    0.07201132   -0.00135967   -0.00325314    0.01100934
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   15
   -420.53946690
H   -2.67624523    0.50550957   -0.08958883   -0.00424251    0.00926732   -0.00181557
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O   -1.96653103   -1.27897534    0.05202081   -0.01791532   -0.00569300   -0.00667113
C   -0.79263663    0.74957947    0.04423280   -0.00230110    0.02232060    0.00641020
C   -0.80486631   -0.78075561    0.09204975    0.01877666   -0.00415178    0.02423068
C    0.32062396    1.57923373    0.02796575    0.00263060   -0.00246296   -0.00614689
C    0.37948738   -1.61708393   -0.07550213    0.00140218   -0.01464883    0.00053242
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C    1.71221241   -1.24609200   -0.03164978   -0.00073888    0.00482055   -0.00665725
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H    2.35526752    2.13949881    0.12239940   -0.00477742   -0.00436893    0.00347927
H    2.40164004   -2.09336469    0.06747828    0.00074859   -0.00330799    0.01119931
C    2.33986392    0.03155106   -0.00730067    0.00884285   -0.00427488   -0.00450581
H    3.42494097    0.01926438   -0.03790090   -0.00134616   -0.00091767   -0.00275825
   15
   -420.53976240
H   -2.66959624    0.49135073   -0.08341487   -0.00595886    0.00590483   -0.00141984
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C   -0.79176295    0.75353993    0.04588431    0.00149440    0.02546946    0.00700813
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   15
   -420.53969705
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O   -1.96381189   -1.28195735    0.05325317   -0.02102161   -0.01075296   -0.00635206
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C    2.34794371    0.03088830   -0.00072344    0.00482120    0.00177045   -0.00219548
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   15
   -420.53935437
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C    0.37325062   -1.61163039   -0.07223968   -0.00581379   -0.02138350    0.00078548
C    1.70767114    1.25940785    0.03547733   -0.00596205   -0.00101750   -0.00409950
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   15
   -420.53885389
H   -2.64220628    0.44511676   -0.06374851   -0.00881122   -0.00442003    0.00034075
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O   -1.96014866   -1.28445495    0.05477288   -0.02155347   -0.01484429   -0.00579515
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C   -0.80027689   -0.76136880    0.08719549    0.02300806    0.00683225    0.01945754
C    0.31532949    1.57307487    0.03451943   -0.00109917   -0.01480071   -0.00375303
C    0.37130036   -1.60921184   -0.07117626   -0.00783417   -0.02317837    0.00071302
C    1.70411305    1.25495073    0.03449724   -0.01134996   -0.00597914   -0.00442914
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   15
   -420.53839810
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O   -1.95795085   -1.28546239    0.05563301   -0.02088865   -0.01644876   -0.00544498
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C    0.31401019    1.57200649    0.03632419   -0.00213680   -0.01538884   -0.00304898
C    0.36946815   -1.60644373   -0.07012370   -0.00951975   -0.02424017    0.00069903
C    1.70072539    1.25058280    0.03358395   -0.01578402   -0.00995791   -0.00462418
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C    2.35949664    0.02958376    0.00935533    0.00649642    0.01001355    0.00066680
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   15
   -420.53809953
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O   -1.95551662   -1.28628357    0.05655487   -0.01964922   -0.01771595   -0.00505621
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C    0.31272320    1.57116941    0.03817502   -0.00316880   -0.01481383   -0.00232607
C    0.36777934   -1.60331024   -0.06908183   -0.01078631   -0.02434873    0.00079033
C    1.69757505    1.24636402    0.03274043   -0.01912703   -0.01276051   -0.00470359
C    1.70634937   -1.24176402   -0.04891472   -0.00365207    0.00058458   -0.00950874
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C    2.36318036    0.02889745    0.01271266    0.01005318    0.01181082    0.00140081
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   15
   -420.53794780
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O   -1.95286000   -1.28690412    0.05753406   -0.01786058   -0.01862678   -0.00463548
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C    0.31148403    1.57055501    0.04006102   -0.00413378   -0.01315046   -0.00160037
C    0.36625311   -1.59980992   -0.06805206   -0.01160482   -0.02338508    0.00100848
C    1.69471249    1.24233658    0.03196792   -0.02131227   -0.01427810   -0.00470314
C    1.70556159   -1.24117762   -0.05130246   -0.00331816   -0.00072187   -0.00926922
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C    2.36671030    0.02803335    0.01604895    0.01508911    0.01294971    0.00202241
H    3.46793621   -0.11114440   -0.01401809    0.01384904   -0.01828026   -0.00238377
   15
   -420.53796030
H   -2.58606327    0.39502298   -0.03897034   -0.00087766   -0.00937242    0.00283636
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O   -1.95000124   -1.28731371    0.05856581   -0.01556749   -0.01916029   -0.00418972
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C   -0.80101789   -0.74357277    0.07767625    0.01568886    0.01476519    0.01261818
C    0.31030732    1.57013846    0.04197120   -0.00501941   -0.01060306   -0.00087899
C    0.36490177   -1.59595726   -0.06703765   -0.01195432   -0.02140366    0.00131956
C    1.69217077    1.23852349    0.03126647   -0.02234556   -0.01453775   -0.00466010
C    1.70482403   -1.24058062   -0.05355024   -0.00302306   -0.00178353   -0.00887378
H    0.07680398    2.63527775    0.01971928   -0.00256420    0.00059223    0.00136556
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C    2.37001053    0.02697431    0.01935478    0.02141182    0.01337665    0.00254358
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   15
   -420.53799486
H   -2.57038494    0.38648518   -0.03379025    0.00281469   -0.00877619    0.00327828
O   -2.04258669    1.24513362   -0.12165520   -0.01304556    0.01278243   -0.01304746
O   -1.94696630   -1.28750633    0.05964508   -0.01281152   -0.01929476   -0.00372705
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C   -0.80188729   -0.73961477    0.07475145    0.01245954    0.01614491    0.01070907
C    0.30920620    1.56988156    0.04389467   -0.00571554   -0.00746025   -0.00016821
C    0.36373063   -1.59178200   -0.06604323   -0.01185820   -0.01858923    0.00165995
C    1.68996554    1.23492884    0.03063547   -0.02227588   -0.01366801   -0.00461241
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H    0.07376737    2.63051680    0.01496963   -0.00260400   -0.00198934    0.00111822
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C    2.37298589    0.02571385    0.02262226    0.02866111    0.01311788    0.00297977
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   15
   -420.53795847
H   -2.55521599    0.37952004   -0.02919922    0.00674880   -0.00768043    0.00362608
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O   -1.94378642   -1.28748044    0.06076662   -0.00963047   -0.01903694   -0.00325137
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C    0.30819127    1.56973717    0.04582070   -0.00622407   -0.00406980    0.00053537
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C    1.68809593    1.23153977    0.03007425   -0.02123430   -0.01191340   -0.00459438
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H    0.11047770   -2.62407051   -0.27815615    0.00059610   -0.00006412   -0.00601659
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C    2.37552748    0.02425579    0.02584475    0.03625465    0.01226744    0.00335419
H    3.45055913   -0.12565014    0.00316765   -0.00193266   -0.01860329   -0.00125065
   15
   -420.53783964
H   -2.54126133    0.37393309   -0.02525927    0.01063182   -0.00628334    0.00386977
O   -2.04158378    1.24191163   -0.12334174   -0.01392121    0.01076275   -0.01354876
O   -1.94049763   -1.28723898    0.06192503   -0.00607546   -0.01838133   -0.00276962
C   -0.79099967    0.76816017    0.05501799    0.01209430    0.02573970    0.01258118
C   -0.80413496   -0.73244685    0.06844568    0.00487136    0.01807803    0.00679341
C    0.30727016    1.56965452    0.04773862   -0.00649421   -0.00084973    0.00124190
C    0.36191756   -1.58264060   -0.06413382   -0.01057927   -0.01166637    0.00212327
C    1.68654645    1.22833020    0.02958256   -0.01942571   -0.00964527   -0.00462995
C    1.70288456   -1.23860220   -0.05952454   -0.00360759   -0.00184031   -0.00680427
H    0.06909500    2.62250788    0.00490886   -0.00254895   -0.00652165    0.00064267
H    0.10165575   -2.62435012   -0.26351932   -0.00072398   -0.00269141   -0.00555750
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H    2.43720544   -2.03813925   -0.10199203    0.00614297    0.00974641    0.00400408
C    2.37752146    0.02261278    0.02901658    0.04337287    0.01098233    0.00369237
H    3.44403922   -0.12372386    0.00944333   -0.00805956   -0.01771065   -0.00083924
   15
   -420.53768003
H   -2.52921639    0.36947704   -0.02201557    0.01418115   -0.00484953    0.00404208
O   -2.04084783    1.24011095   -0.12395569   -0.01391548    0.00923977   -0.01359761
O   -1.93714022   -1.28678934    0.06311486   -0.00219199   -0.01736683   -0.00228630
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C   -0.80539871   -0.72926614    0.06512385    0.00069228    0.01860640    0.00483127
C    0.30644693    1.56958538    0.04963775   -0.00650570    0.00183259    0.00196692
C    0.36125648   -1.57777834   -0.06322565   -0.00957164   -0.00820819    0.00210784
C    1.68529006    1.22526645    0.02916093   -0.01712519   -0.00735095   -0.00472520
C    1.70233912   -1.23787955   -0.06129441   -0.00449141   -0.00050873   -0.00579311
H    0.06745115    2.62006687   -0.00031630   -0.00257330   -0.00782824    0.00038732
H    0.09296312   -2.62414874   -0.24788408   -0.00204925   -0.00509471   -0.00495155
H    2.28493119    2.12400071   -0.00105331   -0.00833144   -0.00334720   -0.00122758
H    2.43383369   -2.03994077   -0.12510733    0.00646298    0.00911374    0.00277856
C    2.37886147    0.02080401    0.03213259    0.04900716    0.00945419    0.00401911
H    3.43895680   -0.11861335    0.01587034   -0.01321168   -0.01653706   -0.00044363
   15
   -420.53758402
H   -2.51971471    0.36589647   -0.01949843    0.01706118   -0.00360516    0.00414487
O   -2.03995448    1.23820544   -0.12441546   -0.01341021    0.00772495   -0.01355492
O   -1.93375817   -1.28614299    0.06433064    0.00194794   -0.01601806   -0.00180913
C   -0.79332597    0.76572885    0.05479460    0.00675962    0.01965690    0.01307130
C   -0.80667281   -0.72636639    0.06172894   -0.00360106    0.01882655    0.00289232
C    0.30572175    1.56948957    0.05150706   -0.00624382    0.00366594    0.00274749
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   15
   -420.53776201
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O   -1.93039838   -1.28531521    0.06556695    0.00626291   -0.01438541   -0.00133758
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   15
   -420.53815017
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O   -1.92710970   -1.28432445    0.06681844    0.01065335   -0.01252243   -0.00087959
C   -0.79605855    0.76211105    0.05378219    0.00091447    0.01309647    0.01326629
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C    1.70118307   -1.23579722   -0.06615323   -0.00815554    0.00679394   -0.00182132
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   15
   -420.53873076
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O   -1.92394182   -1.28319180    0.06807993    0.01499647   -0.01049245   -0.00044087
C   -0.79746777    0.75998019    0.05297571   -0.00183241    0.00990655    0.01326269
C   -0.80991159   -0.71936260    0.05139502   -0.01591605    0.01766253   -0.00259144
C    0.30407925    1.56883751    0.05681368   -0.00438395    0.00367049    0.00545166
C    0.35988904   -1.55750115   -0.05986024   -0.00531291    0.00027213    0.00006648
C    1.68250131    1.21394753    0.02820852   -0.00926833   -0.00743363   -0.00508009
C    1.70101899   -1.23525392   -0.06768928   -0.00916044    0.00974784   -0.00028164
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C    2.37662174    0.01237699    0.04393846    0.04185578    0.00314492    0.00533927
H    3.44540191   -0.07082111    0.04173357   -0.00984537   -0.01086559    0.00095407
   15
   -420.53930357
H   -2.51484521    0.35722690   -0.01702715    0.01830206   -0.00405088    0.00439932
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O   -1.92094389   -1.28194022    0.06934643    0.01915173   -0.00836166   -0.00002159
C   -0.79884957    0.75769933    0.05196877   -0.00434594    0.00689754    0.01319659
C   -0.81059016   -0.71757365    0.04799275   -0.01933197    0.01674845   -0.00425939
C    0.30367835    1.56849830    0.05843664   -0.00366979    0.00235814    0.00646213
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C    1.68221443    1.21135291    0.02816076   -0.00851848   -0.01066239   -0.00495713
C    1.70099295   -1.23485790   -0.06922110   -0.00978460    0.01259315    0.00126564
H    0.06678040    2.62731102   -0.02626541   -0.00369541   -0.00088555   -0.00165345
H    0.05899726   -2.60482485   -0.15969775   -0.00617902   -0.00646321    0.00051759
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C    2.37429721    0.01009129    0.04670040    0.03308240    0.00129882    0.00563259
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   15
   -420.53965910
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C    0.35975249   -1.54727935   -0.05822193   -0.00414223    0.00061215   -0.00167153
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C    1.70111424   -1.23465188   -0.07077195   -0.00992087    0.01510631    0.00274019
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C    2.37147372    0.00778634    0.04937721    0.02329501   -0.00084857    0.00590237
H    3.46110017   -0.03417997    0.05387676    0.00358811   -0.00682420    0.00170550
   15
   -420.53970986
H   -2.53239177    0.35690967   -0.02049678    0.01272154   -0.00710170    0.00437301
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O   -1.91564210   -1.27917702    0.07187573    0.02632008   -0.00408778    0.00075338
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C    0.30303450    1.56773574    0.06137381   -0.00266613   -0.00048008    0.00849072
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C    1.68202230    1.20671004    0.02828641   -0.00788603   -0.01887261   -0.00444495
C    1.70138489   -1.23467362   -0.07236405   -0.00952816    0.01708694    0.00406262
H    0.07080513    2.63410012   -0.03515240   -0.00385255    0.00409885   -0.00267090
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C    2.36829790    0.00549457    0.05196479    0.01358432   -0.00329744    0.00616554
H    3.46861290   -0.01382664    0.05952215    0.01017737   -0.00428979    0.00209732
   15
   -420.53939814
H   -2.54487359    0.35852275   -0.02341475    0.00899512   -0.00860470    0.00424659
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O   -1.91341929   -1.27771374    0.07312974    0.02904249   -0.00207809    0.00111109
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C   -0.81071971   -0.71365629    0.03826505   -0.02526594    0.01310784   -0.00866318
C    0.30277647    1.56735455    0.06265754   -0.00247486   -0.00145150    0.00941891
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C    1.70179893   -1.23495284   -0.07401730   -0.00860416    0.01837447    0.00515959
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H    2.36043248   -2.08813589   -0.30553666    0.00427249   -0.00357568   -0.00910221
C    2.36491555    0.00325295    0.05445913    0.00480332   -0.00597711    0.00644116
H    3.47431060    0.00729509    0.06479017    0.01559374   -0.00149665    0.00247623
   15
   -420.53879101
H   -2.55897142    0.36168013   -0.02709578    0.00504189   -0.00979673    0.00400476
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O   -1.91152526   -1.27622674    0.07437115    0.03102851   -0.00023554    0.00145173
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C   -0.81002814   -0.71277265    0.03525618   -0.02535648    0.01180608   -0.00992136
C    0.30255614    1.56699466    0.06379896   -0.00251248   -0.00188799    0.01026198
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C    1.68230470    1.20320187    0.02868072   -0.00683270   -0.02581134   -0.00390137
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H    2.34603776   -2.09379993   -0.32342041    0.00219728   -0.00373191   -0.01007321
C    2.36145868    0.00110184    0.05685604   -0.00243087   -0.00875150    0.00675560
H    3.47722563    0.02868408    0.06961285    0.01932067    0.00144384    0.00282299
   15
   -420.53804391
H   -2.57397721    0.36659249   -0.03149651    0.00114369   -0.01043802    0.00364895
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O   -1.90998244   -1.27473686    0.07559612    0.03219405    0.00138635    0.00177462
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C   -0.80895446   -0.71206756    0.03239718   -0.02437678    0.01055369   -0.01107238
C    0.30237409    1.56666256    0.06478535   -0.00277420   -0.00170167    0.01099131
C    0.36023745   -1.52689017   -0.05454679   -0.00467757    0.00012517   -0.00446836
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C    1.70299517   -1.23634899   -0.07756904   -0.00553729    0.01848993    0.00646092
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C    2.35803620   -0.00091703    0.05915073   -0.00773641   -0.01145592    0.00712961
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   15
   -420.53727137
H   -2.58919381    0.37337396   -0.03655250   -0.00241091   -0.01038549    0.00317360
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O   -1.90880403   -1.27326247    0.07680097    0.03250145    0.00274989    0.00208552
C   -0.80472990    0.74313175    0.04183495   -0.01388370   -0.00540404    0.01164109
C   -0.80751353   -0.71152215    0.02970545   -0.02231849    0.00939521   -0.01211681
C    0.30223421    1.56635539    0.06560573   -0.00321537   -0.00087340    0.01159084
C    0.36052339   -1.52179150   -0.05348154   -0.00515903    0.00153605   -0.00483660
C    1.68299132    1.20123253    0.02931289   -0.00402112   -0.02841072   -0.00374979
C    1.70373121   -1.23746759   -0.07948711   -0.00361959    0.01727486    0.00660335
H    0.08657723    2.63729727   -0.04661995   -0.00176355    0.00626019   -0.00387661
H    0.05152194   -2.55578666   -0.05930731   -0.00412709    0.00814303    0.00686959
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C    2.35472819   -0.00276299    0.06133754   -0.01094117   -0.01391852    0.00757555
H    3.47238873    0.07015413    0.07768221    0.02077475    0.00719035    0.00334996
   15
   -420.53652821
H   -2.60398497    0.38201340   -0.04217874   -0.00536720   -0.00953685    0.00260443
O   -2.02601434    1.21320855   -0.11985405    0.01836539   -0.00308066   -0.00897963
O   -1.90799351   -1.27181900    0.07798217    0.03195600    0.00382802    0.00238525
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C   -0.80573638   -0.71111893    0.02719679   -0.01923960    0.00835380   -0.01305575
C    0.30214309    1.56606077    0.06625102   -0.00378809    0.00051302    0.01205371
C    0.36088738   -1.51671740   -0.05234333   -0.00567477    0.00406614   -0.00507068
C    1.68343751    1.20088485    0.02971432   -0.00179132   -0.02767710   -0.00390690
C    1.70452192   -1.23884649   -0.08150462   -0.00166805    0.01531856    0.00642064
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H    2.33657036    2.08728307   -0.09420144    0.00560426    0.00862872   -0.00756125
H    2.30229080   -2.10716612   -0.36576992   -0.00560463   -0.00122870   -0.01131724
C    2.35158293   -0.00439899    0.06340971   -0.01194358   -0.01597914    0.00810238
H    3.46437728    0.08920444    0.08083447    0.01837111    0.00970950    0.00350575
   15
   -420.53579998
H   -2.61782155    0.39235777   -0.04827243   -0.00752005   -0.00785790    0.00194436
O   -2.02529911    1.21078748   -0.11868184    0.01952637   -0.00686260   -0.00803111
O   -1.90754475   -1.27041870    0.07913633    0.03060941    0.00461714    0.00267301
C   -0.80521770    0.73865818    0.03699670   -0.01527734   -0.00736825    0.01077465
C   -0.80366945   -0.71084218    0.02488540   -0.01525043    0.00743783   -0.01388517
C    0.30210930    1.56575790    0.06671422   -0.00440778    0.00230555    0.01238731
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C    1.68391015    1.20095400    0.03017503    0.00096046   -0.02559923   -0.00423430
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   15
   -420.53503258
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O   -1.90744257   -1.26907050    0.08026017    0.02855741    0.00511914    0.00295427
C   -0.80511996    0.73658156    0.03432986   -0.01559335   -0.00805834    0.01030115
C   -0.80137285   -0.71067803    0.02278382   -0.01051314    0.00664854   -0.01460696
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C    1.68436776    1.20140874    0.03069994    0.00413851   -0.02230724   -0.00471370
C    1.70615234   -1.24225888   -0.08582294    0.00163460    0.00989404    0.00529077
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C    2.34580913   -0.00692530    0.06717686   -0.00766924   -0.01836526    0.00941939
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   15
   -420.53413823
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O   -1.90766380   -1.26778010    0.08135051    0.02592721    0.00535007    0.00322176
C   -0.80478681    0.73462660    0.03150731   -0.01559691   -0.00859055    0.00981028
C   -0.79891795   -0.71061456    0.02090295   -0.00522643    0.00597781   -0.01521053
C    0.30225083    1.56501797    0.06707567   -0.00553617    0.00605746    0.01275332
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C    1.68476248    1.20219961    0.03129628    0.00757698   -0.01806105   -0.00531623
C    1.70694249   -1.24421096   -0.08810686    0.00267755    0.00692272    0.00449743
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C    2.34311673   -0.00777975    0.06885193   -0.00300853   -0.01853020    0.01019301
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   15
   -420.53303043
H   -2.65056528    0.42984394   -0.06814577   -0.00842031    0.00185681   -0.00016324
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O   -1.90817875   -1.26655017    0.08240431    0.02286887    0.00536011    0.00347093
C   -0.80421829    0.73280135    0.02853644   -0.01523793   -0.00899442    0.00930829
C   -0.79638443   -0.71064162    0.01925190    0.00037758    0.00541561   -0.01569155
C    0.30244301    1.56452492    0.06696835   -0.00587989    0.00738195    0.01284135
C    0.36327943   -1.49767834   -0.04701554   -0.00776410    0.02382095   -0.00490125
C    1.68504260    1.20326281    0.03197307    0.01102847   -0.01321298   -0.00599371
C    1.70769290   -1.24626792   -0.09045876    0.00314677    0.00411945    0.00367503
H    0.11125251    2.62232591   -0.04587790    0.00360991   -0.00474148   -0.00328189
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C    2.34046870   -0.00835480    0.07037281    0.00250452   -0.01803236    0.01101741
H    3.40890333    0.14465322    0.08708621   -0.00767709    0.01506441    0.00334578
   15
   -420.53182660
H   -2.65837560    0.44255291   -0.07488053   -0.00711128    0.00600263   -0.00078822
O   -2.02459177    1.20242625   -0.11319304    0.01357791   -0.02727490   -0.00430941
O   -1.90895285   -1.26538089    0.08341876    0.01953603    0.00519269    0.00370097
C   -0.80341986    0.73111199    0.02542483   -0.01447801   -0.00929955    0.00879904
C   -0.79385670   -0.71075068    0.01783795    0.00605515    0.00495150   -0.01604235
C    0.30272381    1.56392122    0.06666694   -0.00597658    0.00791101    0.01289981
C    0.36415091   -1.49360685   -0.04549306   -0.00831453    0.02971493   -0.00457999
C    1.68515634    1.20452565    0.03274046    0.01416199   -0.00825160   -0.00665462
C    1.70839647   -1.24838765   -0.09286625    0.00301155    0.00170068    0.00287385
H    0.11501427    2.62016781   -0.04382602    0.00442355   -0.00636572   -0.00311952
H    0.07220666   -2.54402320   -0.00109446   -0.00301520    0.00093356    0.00911883
H    2.35663958    2.04611981   -0.08682230    0.00010829   -0.00642469   -0.00636658
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C    2.33778301   -0.00865785    0.07172709    0.00785418   -0.01699547    0.01186071
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   15
   -420.53066279
H   -2.66491025    0.45418305   -0.08147481   -0.00545771    0.00999491   -0.00131034
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O   -1.90994844   -1.26427038    0.08439124    0.01608700    0.00489819    0.00391019
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C   -0.79142031   -0.71093473    0.01666639    0.01155623    0.00458945   -0.01625680
C    0.30309454    1.56319916    0.06617051   -0.00575709    0.00742769    0.01294792
C    0.36514808   -1.48998420   -0.04390150   -0.00887526    0.03525479   -0.00412312
C    1.68505679    1.20591378    0.03360839    0.01658291   -0.00370479   -0.00725583
C    1.70905521   -1.25053369   -0.09531726    0.00229047   -0.00022822    0.00212957
H    0.11798256    2.61914274   -0.04121159    0.00503455   -0.00709049   -0.00301944
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C    2.33498020   -0.00870435    0.07290204    0.01186441   -0.01564233    0.01269661
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   15
   -420.52988652
H   -2.67045600    0.46401912   -0.08783390   -0.00401818    0.01343453   -0.00173076
O   -2.02526084    1.19985193   -0.11011328    0.00665711   -0.03634250   -0.00304105
O   -1.91112655   -1.26321527    0.08531934    0.01267032    0.00449922    0.00410435
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C   -0.78915815   -0.71118829    0.01574047    0.01664561    0.00432774   -0.01633045
C    0.30355191    1.56236613    0.06547833   -0.00521513    0.00584699    0.01298306
C    0.36627916   -1.48689373   -0.04224777   -0.00933252    0.04010066   -0.00352349
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C    1.70967987   -1.25267696   -0.09780053    0.00107979   -0.00163936    0.00142756
H    0.12004840    2.61937946   -0.03805263    0.00538112   -0.00679430   -0.00298408
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H    2.36241961    2.03303633   -0.07535741   -0.00267531   -0.01249629   -0.00557709
H    2.25245457   -2.13991110   -0.39511023   -0.01398336    0.00082992   -0.01064771
C    2.33200110   -0.00851464    0.07388506    0.01340801   -0.01414679    0.01350099
H    3.37661527    0.15889038    0.08544295   -0.02471936    0.01483391    0.00274712
   15
   -420.52959920
H   -2.67526940    0.47145237   -0.09388282   -0.00317203    0.01577871   -0.00204216
O   -2.02572878    1.19915846   -0.10851828    0.00367584   -0.03904124   -0.00259847
O   -1.91244853   -1.26221116    0.08620090    0.00941473    0.00406336    0.00426738
C   -0.79979225    0.72690021    0.01532298   -0.00970925   -0.00984501    0.00723336
C   -0.78714691   -0.71150741    0.01506128    0.02110695    0.00417196   -0.01625653
C    0.30408776    1.56144593    0.06458989   -0.00435208    0.00325181    0.01298963
C    0.36755118   -1.48440840   -0.04054094   -0.00964843    0.04400072   -0.00277810
C    1.68409024    1.20880788    0.03567935    0.01774736    0.00212861   -0.00795069
C    1.71028866   -1.25479595   -0.10030538   -0.00049959   -0.00263084    0.00072189
H    0.12114930    2.62082542   -0.03435580    0.00546620   -0.00552611   -0.00299793
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H    2.36591806    2.02961071   -0.06808399   -0.00294072   -0.01378850   -0.00534892
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C    2.32882311   -0.00811100    0.07466400    0.01183277   -0.01269459    0.01427059
H    3.37370251    0.15824998    0.08385572   -0.02473160    0.01468507    0.00251618
   15
   -420.52987554
H   -2.67949739    0.47606503   -0.09956522   -0.00329270    0.01673486   -0.00227400
O   -2.02623923    1.19890628   -0.10689372    0.00157320   -0.04004185   -0.00224342
O   -1.91387753   -1.26125316    0.08703410    0.00642402    0.00363537    0.00439975
C   -0.79825227    0.72579092    0.01172633   -0.00740450   -0.00996435    0.00668618
C   -0.78545382   -0.71188977    0.01462770    0.02476660    0.00414063   -0.01603592
C    0.30468904    1.56047750    0.06350512   -0.00318553   -0.00011035    0.01293694
C    0.36896882   -1.48258700   -0.03879228   -0.00976105    0.04679691   -0.00189785
C    1.68320617    1.21022635    0.03689289    0.01606523    0.00282269   -0.00801011
C    1.71090524   -1.25687549   -0.10282107   -0.00229082   -0.00336378   -0.00005289
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H    0.09668900   -2.54506183    0.00600120   -0.00054987   -0.00355258    0.00837235
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H    2.26003543   -2.15199802   -0.38616890   -0.01134786   -0.00322509   -0.01085527
C    2.32547008   -0.00751541    0.07522722    0.00713545   -0.01130734    0.01500674
H    3.37519367    0.15496324    0.08181623   -0.02141935    0.01459804    0.00225377
   15
   -420.53064735
H   -2.68311669    0.47768644   -0.10483866   -0.00449458    0.01621764   -0.00247089
O   -2.02676850    1.19910666   -0.10524368    0.00053043   -0.03926598   -0.00192676
O   -1.91537971   -1.26033644    0.08781741    0.00377712    0.00324156    0.00450018
C   -0.79660062    0.72483229    0.00802862   -0.00487471   -0.01007810    0.00611187
C   -0.78413405   -0.71233487    0.01443641    0.02748810    0.00423147   -0.01566881
C    0.30533820    1.55951122    0.06222486   -0.00177764   -0.00387731    0.01279116
C    0.37053352   -1.48147171   -0.03701506   -0.00955229    0.04840128   -0.00089458
C    1.68208097    1.21160396    0.03822734    0.01292814    0.00204637   -0.00791402
C    1.71155650   -1.25890428   -0.10533577   -0.00413172   -0.00402147   -0.00096771
H    0.12043531    2.62630343   -0.02533678    0.00499933   -0.00095897   -0.00304128
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C    2.32201216   -0.00674886    0.07556357    0.00001428   -0.00992551    0.01572224
H    3.38050169    0.14904981    0.07937154   -0.01544003    0.01439416    0.00195238
   15
   -420.53166925
H   -2.68591377    0.47640715   -0.10966725   -0.00658899    0.01439342   -0.00266854
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O   -1.91692511   -1.25945654    0.08854971    0.00153728    0.00289937    0.00456330
C   -0.79487543    0.72402606    0.00423855   -0.00220905   -0.01020494    0.00550333
C   -0.78322865   -0.71284411    0.01448185    0.02919390    0.00445540   -0.01515693
C    0.30601403    1.55860361    0.06075135   -0.00018459   -0.00767257    0.01252568
C    0.37224232   -1.48108678   -0.03522444   -0.00906163    0.04882727    0.00020639
C    1.68076168    1.21295198    0.03968136    0.00864438    0.00013165   -0.00773060
C    1.71227009   -1.26087208   -0.10783560   -0.00586863   -0.00481146   -0.00208013
H    0.11870449    2.62952299   -0.02000794    0.00453755    0.00167523   -0.00300495
H    0.11003806   -2.54233764    0.00031632    0.00170997   -0.00136885    0.00722868
H    2.37877190    2.03377499   -0.04053843    0.00198768   -0.00960747   -0.00522507
H    2.27573162   -2.16175930   -0.36944108   -0.00776772   -0.00733136   -0.01056158
C    2.31855562   -0.00583243    0.07566223   -0.00842423   -0.00839211    0.01642194
H    3.38856703    0.14054899    0.07657630   -0.00792203    0.01391795    0.00159106
   15
   -420.53274353
H   -2.68751701    0.47254944   -0.11401508   -0.00919647    0.01166990   -0.00288932
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O   -1.91848834   -1.25860960    0.08923029   -0.00026170    0.00263498    0.00458451
C   -0.79311685    0.72337416    0.00036532    0.00048060   -0.01035535    0.00485246
C   -0.78276333   -0.71342083    0.01475628    0.02982581    0.00478961   -0.01450525
C    0.30669264    1.55781159    0.05908863    0.00148740   -0.01109854    0.01211483
C    0.37408770   -1.48143878   -0.03343704   -0.00822040    0.04817434    0.00138044
C    1.67931255    1.21429882    0.04125225    0.00364623   -0.00245063   -0.00752716
C    1.71307212   -1.26276683   -0.11030374   -0.00736784   -0.00586990   -0.00342361
H    0.11616072    2.63244510   -0.01413945    0.00394958    0.00404972   -0.00289100
H    0.11635369   -2.54048780   -0.00453253    0.00289192    0.00065435    0.00651835
H    2.38286401    2.03914677   -0.02947391    0.00477628   -0.00640368   -0.00518775
H    2.28584168   -2.16484202   -0.35820785   -0.00596833   -0.00885100   -0.01008321
C    2.31522651   -0.00478942    0.07551261   -0.01696366   -0.00660360    0.01710313
H    3.39805389    0.12954908    0.07349534   -0.00005742    0.01300791    0.00117506
   15
   -420.53378566
H   -2.68746510    0.46659800   -0.11784238   -0.01178967    0.00847115   -0.00313576
O   -2.02839914    1.20225230   -0.10017784    0.00168345   -0.02904143   -0.00081288
O   -1.92004903   -1.25779261    0.08985889   -0.00160315    0.00244035    0.00456475
C   -0.79136542    0.72287890   -0.00358119    0.00307975   -0.01053485    0.00414631
C   -0.78274775   -0.71407011    0.01524986    0.02942015    0.00522737   -0.01371903
C    0.30734875    1.55718667    0.05724289    0.00318296   -0.01386476    0.01156962
C    0.37605693   -1.48251807   -0.03167058   -0.00701841    0.04664821    0.00259836
C    1.67780849    1.21568300    0.04293696   -0.00156143   -0.00522304   -0.00735522
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   15
   -420.53478357
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O   -1.92159194   -1.25700336    0.09043576   -0.00249067    0.00232091    0.00449981
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   15
   -420.53582493
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   15
   -420.53701052
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   15
   -420.53832899
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O   -1.92603785   -1.25479245    0.09186585   -0.00264686    0.00236675    0.00402514
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C   -0.78684148   -0.71753700    0.01914897    0.01871579    0.00734713   -0.00934153
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   15
   -420.53972587
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   15
   -420.54104472
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C   -0.79077785   -0.71990354    0.02201598    0.00959935    0.00819223   -0.00652515
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C    2.30356789    0.00345640    0.06676565   -0.02853426    0.00709476    0.01945794
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   15
   -420.54204568
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O   -1.93023773   -1.25282724    0.09288856    0.00002409    0.00286420    0.00313769
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C   -0.79299913   -0.72126955    0.02360831    0.00460134    0.00848270   -0.00499302
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C    1.67131508    1.22883681    0.05782359   -0.01788471   -0.00454782   -0.00725072
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C    2.30387206    0.00440225    0.06435332   -0.02193475    0.00752857    0.01917656
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   15
   -420.54257828
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O   -1.93162251   -1.25223433    0.09315342    0.00127215    0.00306658    0.00276367
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C   -0.79528990   -0.72276366    0.02527606   -0.00048141    0.00867167   -0.00339788
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C    1.67139325    1.23119626    0.06039257   -0.01631345   -0.00111731   -0.00698910
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C    2.30450636    0.00523514    0.06165128   -0.01409203    0.00725521    0.01870700
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   15
   -420.54262158
H   -2.58431625    0.39444657   -0.12263779    0.00330239   -0.00124906   -0.00384922
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O   -1.93302178   -1.25167620    0.09338694    0.00258822    0.00324048    0.00236678
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   15
   -420.54217296
H   -2.56734891    0.38780086   -0.11960953    0.00734201   -0.00082049   -0.00372665
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O   -1.93445043   -1.25115475    0.09359361    0.00390291    0.00337690    0.00194678
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C    0.30837934    1.56220788    0.03124735    0.00755301    0.00040970    0.00264537
C    0.39626580   -1.52732757   -0.01918423    0.01665839    0.03235751    0.01405145
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C    1.72930847   -1.27145141   -0.12789917    0.00398826   -0.02062839   -0.02228560
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C    2.30628885    0.00658907    0.05540916    0.00179163    0.00468670    0.01722958
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   15
   -420.54147005
H   -2.55169538    0.38130982   -0.11591016    0.01081196   -0.00085368   -0.00362933
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O   -1.93592327   -1.25067154    0.09377821    0.00513421    0.00344547    0.00151452
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C   -0.80181918   -0.72803694    0.03048729   -0.01479511    0.00873654    0.00161637
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C    1.67297063    1.23816241    0.06870577   -0.00939092    0.00844302   -0.00540790
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C    2.30719967    0.00714865    0.05189139    0.00758691    0.00265434    0.01624277
H    3.36756239   -0.07089073    0.04348190   -0.01988854   -0.01362967   -0.00330088
   15
   -420.54075096
H   -2.53797758    0.37498206   -0.11155737    0.01353080   -0.00152104   -0.00354826
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O   -1.93745421   -1.25022734    0.09394564    0.00620898    0.00341964    0.00107866
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C   -0.80364109   -0.73005943    0.03220948   -0.01878799    0.00863882    0.00330524
C    0.30708535    1.56430792    0.02512135    0.00560588    0.00079507    0.00072006
C    0.39848833   -1.54264302   -0.01871529    0.01919984    0.02693036    0.01537251
C    1.67382847    1.24028753    0.07165248   -0.00740485    0.00986468   -0.00477875
C    1.73262251   -1.26928754   -0.12759607    0.00765769   -0.01539449   -0.02348663
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   15
   -420.54019028
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O   -1.93905537   -1.24982182    0.09410083    0.00705002    0.00327441    0.00064091
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C   -0.80517968   -0.73221251    0.03388171   -0.02216905    0.00851412    0.00497667
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C    2.30864287    0.00818263    0.04413711    0.01033167   -0.00196013    0.01375892
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   15
   -420.53983441
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O   -1.94073622   -1.24945333    0.09424874    0.00758537    0.00299200    0.00021179
C   -0.78085418    0.73317882   -0.05923046    0.00691403   -0.00454624   -0.00885391
C   -0.80638400   -0.73449431    0.03547874   -0.02481029    0.00838573    0.00661281
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C    1.67585971    1.24409500    0.07775440   -0.00500073    0.00855222   -0.00377226
C    1.73547670   -1.26620518   -0.12587710    0.01068879   -0.00769589   -0.02378173
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C    2.30913395    0.00872642    0.03993820    0.00706999   -0.00425416    0.01222885
H    3.37082526   -0.09061834    0.04584433   -0.01783103   -0.01592052   -0.00355809
   15
   -420.53960328
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O   -1.94250277   -1.24911865    0.09439424    0.00774555    0.00257608   -0.00020814
C   -0.78120377    0.73493497   -0.06265356    0.00609445   -0.00243603   -0.00959984
C   -0.80721424   -0.73690293    0.03697585   -0.02661446    0.00826886    0.00820007
C    0.30455477    1.56745230    0.01589228    0.00199030   -0.00452334   -0.00253977
C    0.39965738   -1.56846328   -0.01975641    0.01862698    0.01137994    0.01558201
C    1.67699666    1.24579684    0.08089448   -0.00447542    0.00610997   -0.00347168
C    1.73667255   -1.26445918   -0.12447897    0.01210670   -0.00353601   -0.02360734
H    0.02833188    2.61803127    0.10627646   -0.00399484   -0.00046479    0.00325290
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H    2.29024142    2.12286081    0.22924093   -0.00826687   -0.00160072    0.00123379
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C    2.30952082    0.00933442    0.03555465    0.00161014   -0.00647684    0.01048428
H    3.37897570   -0.09162239    0.04790544   -0.01185840   -0.01629707   -0.00339825
   15
   -420.53938394
H   -2.50988303    0.35524440   -0.08787599    0.01593196   -0.00890888   -0.00319228
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O   -1.94435678   -1.24881307    0.09454209    0.00747748    0.00202700   -0.00061845
C   -0.78164551    0.73672765   -0.06593157    0.00528114   -0.00007949   -0.01029115
C   -0.80764320   -0.73943660    0.03834907   -0.02749026    0.00817961    0.00971948
C    0.30362543    1.56859503    0.01287018    0.00053327   -0.00667546   -0.00366605
C    0.39947231   -1.57753091   -0.02057661    0.01731022    0.00455273    0.01513678
C    1.67820153    1.24740708    0.08408720   -0.00415320    0.00302038   -0.00328368
C    1.73768528   -1.26265966   -0.12272417    0.01356503    0.00054215   -0.02321180
H    0.02368931    2.62136827    0.11190618   -0.00488241    0.00180979    0.00373780
H    0.10934899   -2.62473019   -0.14299948   -0.00291081   -0.00128344   -0.00627607
H    2.28769645    2.13132269    0.24684373   -0.00674522    0.00190469    0.00215211
H    2.48178825   -2.06534049   -0.06535182    0.00934533    0.00232226    0.00903539
C    2.30988463    0.01004029    0.03101284   -0.00490622   -0.00867121    0.00853182
H    3.38924457   -0.08969719    0.05057591   -0.00474203   -0.01636404   -0.00307134
   15
   -420.53914390
H   -2.51009190    0.35337131   -0.08046768    0.01478995   -0.01086062   -0.00298185
O   -2.03009809    1.24596925   -0.07398934   -0.01175860    0.02025887    0.00536646
O   -1.94629519   -1.24853037    0.09469694    0.00674299    0.00137296   -0.00101513
C   -0.78216705    0.73852128   -0.06905406    0.00442633    0.00247690   -0.01093373
C   -0.80765772   -0.74209398    0.03957543   -0.02737821    0.00812165    0.01116038
C    0.30268821    1.56983826    0.00990346   -0.00106827   -0.00847800   -0.00475549
C    0.39902606   -1.58666686   -0.02162540    0.01554569   -0.00269546    0.01446369
C    1.67946914    1.24897180    0.08732961   -0.00378550   -0.00020106   -0.00313504
C    1.73849283   -1.26086793   -0.12061869    0.01508386    0.00428315   -0.02258703
H    0.01992299    2.62438560    0.11686358   -0.00558312    0.00366180    0.00418228
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H    2.48659414   -2.06031363   -0.05454542    0.00972873    0.00232737    0.00947995
C    2.31032252    0.01087725    0.02634224   -0.01135705   -0.01086603    0.00640375
H    3.40036622   -0.08483238    0.05379709    0.00244851   -0.01600507   -0.00258944
   15
   -420.53888964
H   -2.51295674    0.35344769   -0.07252415    0.01320092   -0.01241597   -0.00269046
O   -2.02892482    1.24796579   -0.07285619   -0.00971688    0.02219032    0.00532843
O   -1.94830967   -1.24826313    0.09486331    0.00553710    0.00062867   -0.00140280
C   -0.78275536    0.74027730   -0.07201130    0.00345284    0.00517497   -0.01152760
C   -0.80725948   -0.74487419    0.04063316   -0.02626952    0.00809477    0.01250868
C    0.30176729    1.57120896    0.00700858   -0.00279459   -0.00968542   -0.00577673
C    0.39834519   -1.59576207   -0.02289268    0.01344024   -0.00998675    0.01360745
C    1.68079370    1.25053911    0.09061937   -0.00317736   -0.00306736   -0.00294125
C    1.73907223   -1.25914037   -0.11817198    0.01667881    0.00752370   -0.02172974
H    0.01715818    2.62675284    0.12106917   -0.00602760    0.00487918    0.00454488
H    0.10669721   -2.63400747   -0.14790864   -0.00269936    0.00354704   -0.00606857
H    2.28592899    2.14656794    0.28069922   -0.00331249    0.00880531    0.00422149
H    2.48965492   -2.05570960   -0.04544367    0.00965867    0.00258388    0.00977680
C    2.31093093    0.01187850    0.02157499   -0.01683213   -0.01306117    0.00414594
H    3.41105894   -0.07709258    0.05748276    0.00883934   -0.01518195   -0.00199126
   15
   -420.53869498
H   -2.51819347    0.35575130   -0.06409744    0.01130490   -0.01343510   -0.00233137
O   -2.02764139    1.24971140   -0.07178339   -0.00760913    0.02326920    0.00519677
O   -1.95038654   -1.24800298    0.09504559    0.00386060   -0.00015151   -0.00177623
C   -0.78339564    0.74195497   -0.07479429    0.00229682    0.00795040   -0.01207874
C   -0.80646524   -0.74777681    0.04150188   -0.02418265    0.00808659    0.01374620
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C    0.39746128   -1.60470673   -0.02436557    0.01116011   -0.01691940    0.01263217
C    1.68216582    1.25215191    0.09395344   -0.00218280   -0.00519460   -0.00261040
C    1.73939940   -1.25752580   -0.11539703    0.01830263    0.01010817   -0.02063011
H    0.01547503    2.62825307    0.12445700   -0.00618691    0.00531971    0.00482744
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H    2.28609577    2.15212075    0.29658196   -0.00191200    0.01137217    0.00517649
H    2.49098394   -2.05157437   -0.03809915    0.00909836    0.00308795    0.00989222
C    2.31179188    0.01307723    0.01674514   -0.02070739   -0.01521742    0.00182291
H    3.42018078   -0.06662567    0.06152534    0.01383845   -0.01389115   -0.00130821
   15
   -420.53870065
H   -2.52546267    0.36046421   -0.05525249    0.00923917   -0.01382392   -0.00189692
O   -2.02627161    1.25119388   -0.07076950   -0.00552984    0.02341981    0.00499611
O   -1.95250680   -1.24774112    0.09524800    0.00175425   -0.00092519   -0.00213014
C   -0.78407037    0.74351242   -0.07739472    0.00091034    0.01073277   -0.01258492
C   -0.80530648   -0.75080168    0.04216292   -0.02118612    0.00807751    0.01485893
C    0.30007982    1.57439343    0.00149410   -0.00644002   -0.00972200   -0.00745663
C    0.39640867   -1.61339653   -0.02602938    0.00883547   -0.02306859    0.01158508
C    1.68357037    1.25384201    0.09732673   -0.00072449   -0.00631502   -0.00206800
C    1.73944991   -1.25606318   -0.11231042    0.01987710    0.01196750   -0.01930415
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H    2.28661319    2.15563982    0.31153448   -0.00095256    0.01299016    0.00597241
H    2.49068105   -2.04799843   -0.03253292    0.00811325    0.00382073    0.00983275
C    2.31296352    0.01450593    0.01188774   -0.02261953   -0.01724624   -0.00050081
H    3.42683671   -0.05366359    0.06580318    0.01709691   -0.01217546   -0.00060740
   15
   -420.53892598
H   -2.53439510    0.36765617   -0.04606684    0.00715072   -0.01354896   -0.00141463
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O   -1.95464663   -1.24746882    0.09547454   -0.00071734   -0.00164349   -0.00245343
C   -0.78475855    0.74490769   -0.07980492   -0.00073667    0.01345082   -0.01304814
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C    0.29936820    1.57620770   -0.00110014   -0.00822239   -0.00847931   -0.00808430
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C    1.68498527    1.25562621    0.10073095    0.00122328   -0.00629332   -0.00125320
C    1.73920009   -1.25478062   -0.10893221    0.02128700    0.01309295   -0.01775984
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H    0.10626147   -2.65346642   -0.14719453   -0.00231762    0.00798978   -0.00545511
H    2.28730942    2.15683685    0.32541515   -0.00051044    0.01349273    0.00653094
H    2.48892260   -2.04511247   -0.02873456    0.00678405    0.00470246    0.00961070
C    2.31447457    0.01619506    0.00703784   -0.02239401   -0.01902679   -0.00276537
H    3.43044242   -0.03851543    0.07019097    0.01843703   -0.01009533    0.00006050
   15
   -420.53938109
H   -2.54461631    0.37727673   -0.03662717    0.00516190   -0.01257811   -0.00090122
O   -2.02336583    1.25337387   -0.06890878   -0.00180360    0.02083233    0.00446413
O   -1.95677807   -1.24717793    0.09572890   -0.00346854   -0.00227903   -0.00275404
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C   -0.80208783   -0.75721708    0.04279683   -0.01298513    0.00794578    0.01665205
C    0.29878075    1.57814926   -0.00357232   -0.00987785   -0.00648937   -0.00856476
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C    1.68638111    1.25750412    0.10415377    0.00363018   -0.00510101   -0.00014069
C    1.73862878   -1.25369518   -0.10528573    0.02238652    0.01353600   -0.01601783
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H    2.28810561    2.15562145    0.33812409   -0.00062135    0.01284627    0.00681359
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C    2.31632155    0.01817140    0.00222963   -0.01998198   -0.02043739   -0.00491758
H    3.43075746   -0.02155413    0.07456918    0.01780357   -0.00774781    0.00064423
   15
   -420.53996161
H   -2.55576806    0.38915073   -0.02702610    0.00335499   -0.01093614   -0.00036681
O   -2.02187193    1.25410054   -0.06805596   -0.00033686    0.01821915    0.00418539
O   -1.95887003   -1.24686120    0.09601452   -0.00639219   -0.00281825   -0.00302285
C   -0.78607198    0.74704965   -0.08402720   -0.00474758    0.01840804   -0.01385681
C   -0.80015155   -0.76060551    0.04274261   -0.00809427    0.00775125    0.01730796
C    0.29834237    1.58018827   -0.00591515   -0.01131429   -0.00393710   -0.00891656
C    0.39258066   -1.63709951   -0.03200697    0.00273741   -0.03398305    0.00838382
C    1.68772159    1.25945784    0.10757834    0.00642642   -0.00281893    0.00127821
C    1.73771957   -1.25281373   -0.10139728    0.02300708    0.01340304   -0.01410273
H    0.01935078    2.62615154    0.12922438   -0.00404908   -0.00033904    0.00458900
H    0.10812213   -2.67305633   -0.14173605   -0.00280715    0.00610910   -0.00523872
H    2.28902136    2.15210933    0.34961074   -0.00126225    0.01109985    0.00679704
H    2.48202547   -2.04204623   -0.02625596    0.00364464    0.00644212    0.00875602
C    2.31846809    0.02045615   -0.00250443   -0.01545863   -0.02135779   -0.00690518
H    3.42789529   -0.00320062    0.07883325    0.01524225   -0.00522648    0.00109830
   15
   -420.54045231
H   -2.56753003    0.40298561   -0.01735800    0.00188295   -0.00872597    0.00013056
O   -2.02037388    1.25462147   -0.06725065    0.00076375    0.01476895    0.00393772
O   -1.96088942   -1.24651264    0.09633439   -0.00938104   -0.00320316   -0.00324195
C   -0.78663673    0.74772155   -0.08582707   -0.00700677    0.02051454   -0.01419206
C   -0.79809323   -0.76411098    0.04242691   -0.00292167    0.00743105    0.01779188
C    0.29807468    1.58228646   -0.00812328   -0.01243700   -0.00108502   -0.00916911
C    0.39118360   -1.64402846   -0.03427443    0.00115778   -0.03493703    0.00731282
C    1.68896453    1.26145306    0.11098323    0.00950705    0.00037638    0.00297941
C    1.73646329   -1.25213442   -0.09729580    0.02299951    0.01285523   -0.01204320
H    0.02248849    2.62487676    0.12827302   -0.00303205   -0.00280126    0.00427910
H    0.10978391   -2.68461343   -0.13758386   -0.00325497    0.00371503   -0.00516722
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H    2.47744755   -2.04217461   -0.02742273    0.00215517    0.00700221    0.00816947
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   15
   -420.54072689
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   15
   -420.54064441
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O   -1.96457592   -1.24570444    0.09708623   -0.01507566   -0.00348214   -0.00352347
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   15
   -420.54016789
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O   -1.96617866   -1.24524164    0.09752137   -0.01754788   -0.00336858   -0.00357745
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C   -0.79196897   -0.77526849    0.03985151    0.01234083    0.00543657    0.01815988
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C    2.32829647    0.03280985   -0.02014555    0.01659148   -0.01820785   -0.01280606
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   15
   -420.53944394
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O   -1.96758267   -1.24474082    0.09799706   -0.01965180   -0.00305562   -0.00357952
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C   -0.79020046   -0.77916780    0.03844407    0.01676436    0.00437869    0.01792789
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C    1.69203402    1.26879353    0.12385528    0.02024597    0.01473397    0.01069156
C    1.72814505   -1.25123829   -0.07940783    0.01529068    0.00970646   -0.00272031
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C    2.33045714    0.03664254   -0.02412056    0.02433817   -0.01555413   -0.01392775
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   15
   -420.53856928
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O   -1.96876420   -1.24420551    0.09851329   -0.02128725   -0.00256642   -0.00352816
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C    0.29965382    1.59228389   -0.01702586   -0.01088337    0.00700937   -0.01029933
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C    1.72538796   -1.25140977   -0.07474149    0.01173225    0.00907173   -0.00015582
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C    2.33225242    0.04070973   -0.02788497    0.02996384   -0.01231392   -0.01510268
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   15
   -420.53771967
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O   -1.96970473   -1.24364126    0.09906950   -0.02239805   -0.00188973   -0.00342742
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C    2.33359813    0.04496256   -0.03142098    0.03275691   -0.00862021   -0.01640063
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   15
   -420.53698583
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O   -1.97039171   -1.24305575    0.09966454   -0.02293526   -0.00103532   -0.00328360
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C   -0.78663230   -0.79118236    0.03262276    0.02610937    0.00002606    0.01628443
C    0.30152339    1.59564338   -0.01952384   -0.00681197    0.00504497   -0.01091479
C    0.38197444   -1.67823383   -0.05220388   -0.00684197   -0.03109912   -0.00234893
C    1.69135322    1.27226461    0.13194887    0.01901263    0.01492276    0.01347215
C    1.71940063   -1.25215439   -0.06544195    0.00395619    0.00766247    0.00518188
H    0.05068335    2.64443802    0.10275250    0.00118549   -0.00250921    0.00321338
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C    2.33445221    0.04934529   -0.03470870    0.03253882   -0.00461237   -0.01791190
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   15
   -420.53631049
H   -2.66098103    0.52732806    0.05365840   -0.00542703    0.00936581    0.00263590
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C    0.30262893    1.59719983   -0.02052763   -0.00434831    0.00361625   -0.01114328
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C    1.69052706    1.27295161    0.13425169    0.01622040    0.01207932    0.01343143
C    1.71628739   -1.25270595   -0.06088937    0.00019037    0.00662659    0.00790121
H    0.05428223    2.65124514    0.09674171    0.00117286    0.00036557    0.00322813
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C    2.33481749    0.05379756   -0.03772542    0.02970332   -0.00042715   -0.01956657
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   15
   -420.53561646
H   -2.67034082    0.53814250    0.06093932   -0.00722825    0.00927199    0.00302421
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C   -0.78614229   -0.79922995    0.02749753    0.02828459   -0.00372601    0.01450831
C    0.30380007    1.59870141   -0.02136306   -0.00176826    0.00235399   -0.01125680
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H    2.43053633   -2.08507550   -0.08770846    0.00189452   -0.00510088    0.00012808
C    2.33473580    0.05825610   -0.04044621    0.02509378    0.00391765   -0.02128333
H    3.39961480    0.16446891    0.10847805   -0.00654392    0.01356497    0.00340303
   15
   -420.53481592
H   -2.67839820    0.54729345    0.06767538   -0.00910016    0.00879030    0.00344459
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O   -1.97090541   -1.24127940    0.10166465   -0.02084854    0.00261831   -0.00267923
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C    0.30499793    1.60016688   -0.02202840    0.00080622    0.00154181   -0.01124922
C    0.37925261   -1.68565771   -0.05981290   -0.00910338   -0.03456264   -0.00700470
C    1.68819655    1.27383783    0.13825485    0.00851884    0.00405600    0.01248741
C    1.71010331   -1.25408659   -0.05218328   -0.00627342    0.00329494    0.01323175
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C    2.33427567    0.06265523   -0.04284532    0.01968073    0.00840092   -0.02291213
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   15
   -420.53395407
H   -2.68481992    0.55486488    0.07379137   -0.01079891    0.00811847    0.00386029
O   -2.00463900    1.25875138   -0.06110204    0.00034103   -0.00969190    0.00260102
O   -1.97058720   -1.24072668    0.10239542   -0.01891587    0.00413583   -0.00244216
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C   -0.78734505   -0.80704957    0.02149690    0.02689492   -0.00800326    0.01231991
C    0.30618373    1.60160818   -0.02252386    0.00326395    0.00143454   -0.01108509
C    0.37860728   -1.68711576   -0.06216789   -0.00946028   -0.03616162   -0.00836069
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C    1.70712993   -1.25486515   -0.04811024   -0.00875642    0.00085832    0.01574060
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H    2.41812091   -2.09312914   -0.10608503    0.00133713   -0.00701276   -0.00204004
C    2.33351783    0.06692724   -0.04489824    0.01437568    0.01298776   -0.02434187
H    3.41611203    0.17744282    0.10984361    0.00574455    0.01517043    0.00523359
   15
   -420.53309888
H   -2.68930335    0.56097429    0.07921324   -0.01209957    0.00747973    0.00422090
O   -2.00323988    1.25968294   -0.06076212   -0.00005184   -0.00837497    0.00230517
O   -1.97005495   -1.24022099    0.10315388   -0.01640505    0.00578587   -0.00220139
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C   -0.78856340   -0.81079426    0.01820869    0.02489346   -0.01029012    0.01110584
C    0.30732048    1.60302673   -0.02285188    0.00550731    0.00217870   -0.01077632
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C    1.68535203    1.27447860    0.14150336    0.00053980   -0.00397007    0.01141712
C    1.70428831   -1.25565605   -0.04427497   -0.01068944   -0.00210122    0.01807132
H    0.06654817    2.67311287    0.06706497    0.00155547    0.00865121    0.00244499
H    0.18052268   -2.75534069   -0.03255393    0.00234467   -0.00114896    0.00117709
H    2.36619766    2.09781632    0.41320971    0.00974560    0.00111803    0.00768205
H    2.41151860   -2.09533643   -0.11481923    0.00050113   -0.00711422   -0.00302869
C    2.33254170    0.07100280   -0.04658350    0.00985854    0.01763254   -0.02547203
H    3.42336521    0.17989802    0.10919429    0.01077303    0.01537806    0.00590046
   15
   -420.53240108
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   15
   -420.53192076
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   15
   -420.53178142
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   15
   -420.53189818
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   15
   -420.53227466
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   15
   -420.53268897
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   15
   -420.53315461
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   15
   -420.53355076
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   15
   -420.53397817
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   15
   -420.53451665
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   15
   -420.53528199
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O   -1.96122569   -1.24330071    0.11256047    0.02279022    0.02039583    0.00084979
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   15
   -420.53624435
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O   -1.96126850   -1.24478266    0.11343506    0.02365659    0.01997522    0.00143432
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C    1.68547270   -1.24827381   -0.02567839   -0.01513619   -0.02145898    0.02527068
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   15
   -420.53731020
H   -2.59884578    0.51703736    0.08008450    0.00052851    0.00029553    0.00397837
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O   -1.96157876   -1.24649075    0.11429328    0.02353773    0.01907508    0.00213360
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   15
   -420.53832117
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C   -0.81686076   -0.83216320   -0.03589760   -0.02600723   -0.02836963   -0.00999219
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   15
   -420.53914943
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O   -1.96298489   -1.25053898    0.11592735    0.02036486    0.01584433    0.00391425
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C    1.68564632   -1.23886701   -0.02977164   -0.01241435   -0.00933621    0.02068679
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   15
   -420.53968434
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O   -1.96404493   -1.25284259    0.11668302    0.01746528    0.01360372    0.00497255
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C    0.30681454    1.59547411   -0.01146216   -0.00027244    0.00778854   -0.00283218
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C    1.67245664    1.29157352    0.13859362   -0.01159395   -0.00692800    0.01617098
C    1.68610528   -1.23536170   -0.03179642   -0.01022657   -0.00463531    0.01857137
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C    2.28980732    0.06873599   -0.02330753   -0.00308752    0.01996221   -0.01456222
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   15
   -420.53997043
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O   -1.96530245   -1.25530017    0.11738219    0.01386635    0.01102607    0.00613075
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C    0.37699834   -1.64271952   -0.07239189    0.00811242   -0.00584350   -0.00845432
C    1.67254731    1.29305178    0.13635213   -0.01251139   -0.00821816    0.01597011
C    1.68671804   -1.23178643   -0.03410171   -0.00736390    0.00015994    0.01621606
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   15
   -420.54008142
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O   -1.96671679   -1.25788254    0.11801177    0.00973558    0.00818883    0.00735023
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C    0.37625969   -1.63871927   -0.07112175    0.00744820   -0.00728936   -0.00691601
C    1.67282624    1.29465304    0.13386904   -0.01268538   -0.00848666    0.01587844
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C    2.28042592    0.05938329   -0.01512000   -0.01816423    0.00563440   -0.01133662
H    3.38668838   -0.02573751   -0.02144732    0.01262215   -0.01139566   -0.00263268
   15
   -420.54007684
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O   -1.96824124   -1.26055765    0.11855793    0.00526180    0.00519052    0.00860394
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C    0.30434895    1.58659368   -0.00726104   -0.00888411   -0.00058591   -0.00201243
C    0.37540854   -1.63460948   -0.06974705    0.00670041   -0.00817624   -0.00537081
C    1.67329594    1.29638115    0.13114580   -0.01203072   -0.00756285    0.01586466
C    1.68822289   -1.22471525   -0.03940891    0.00007729    0.00958715    0.01102378
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H    3.38556265   -0.03228620   -0.02902653    0.01435919   -0.01201061   -0.00332386
   15
   -420.54000870
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C    1.67394655    1.29822212    0.12818261   -0.01055361   -0.00540286    0.01590076
C    1.68900288   -1.22136149   -0.04233244    0.00435212    0.01398164    0.00830306
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   15
   -420.53990377
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O   -1.97141600   -1.26604954    0.11934315   -0.00401885   -0.00094016    0.01107804
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C   -0.81285352   -0.81399209   -0.05590471   -0.00362271   -0.01072713   -0.02238753
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C    2.26854503    0.04505658   -0.00162214   -0.02927618   -0.02030855   -0.00605239
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   15
   -420.53968406
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O   -1.97296142   -1.26879695    0.11955424   -0.00847023   -0.00391553    0.01222902
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C   -0.81155102   -0.81038680   -0.05761337    0.00108850   -0.00747927   -0.02379605
C    0.30309695    1.57772130   -0.00277881   -0.01776388   -0.00300509   -0.00179585
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C    1.69030037   -1.21534870   -0.04851499    0.01277387    0.02175448    0.00289764
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   15
   -420.53932340
H   -2.51491324    0.45539227    0.00337779    0.01044270   -0.00414009    0.00062916
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O   -1.97441104   -1.27150006    0.11962670   -0.01260873   -0.00674650    0.01328263
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C    0.30315944    1.57484566   -0.00122967   -0.01998775   -0.00308948   -0.00178400
C    0.37109167   -1.61702355   -0.06366373    0.00453401   -0.00213442    0.00055271
C    1.67670540    1.30400951    0.11784982   -0.00208116    0.00744931    0.01575772
C    1.69069119   -1.21280703   -0.05169238    0.01634904    0.02499446    0.00028922
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H    2.43019185   -2.00704226   -0.03714962    0.00172359    0.00566615    0.00190710
C    2.26273299    0.03681486    0.00787972   -0.02789357   -0.03729280   -0.00278478
H    3.35693031   -0.03687120   -0.05221074    0.00464449   -0.01076172   -0.00548952
   15
   -420.53876841
H   -2.51282670    0.45540766   -0.00643681    0.01109466   -0.00310514    0.00012072
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O   -1.97571800   -1.27412686    0.11954863   -0.01632653   -0.00937181    0.01421214
C   -0.72281751    0.68450960   -0.04348975    0.02444918    0.00208748    0.00691892
C   -0.80906436   -0.80288595   -0.05993353    0.01002668   -0.00104144   -0.02603655
C    0.30352327    1.57201686    0.00034643   -0.02150675   -0.00327341   -0.00175252
C    0.36982542   -1.61245472   -0.06210869    0.00435797    0.00135921    0.00200678
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C    1.69083585   -1.21064262   -0.05487425    0.01909401    0.02771379   -0.00223709
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H    2.29056040    2.20484964    0.15945672   -0.00646100    0.00594339   -0.00111244
H    2.43062290   -2.00111723   -0.02545080    0.00107823    0.00736427    0.00293310
C    2.26046843    0.03347618    0.01270597   -0.02501371   -0.04457221   -0.00129662
H    3.34592814   -0.03289386   -0.05573515   -0.00108750   -0.00973127   -0.00569607
   15
   -420.53807277
H   -2.51272843    0.45598656   -0.01627349    0.01111592   -0.00236508   -0.00035019
O   -1.93121646    1.26310793   -0.05510575    0.00695782    0.01565933   -0.00009168
O   -1.97684024   -1.27664758    0.11930948   -0.01953420   -0.01175838    0.01500216
C   -0.72415478    0.68497332   -0.04202413    0.02127967    0.00494039    0.00684699
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   15
   -420.53733619
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   15
   -420.53670819
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O   -1.97839155   -1.28126574    0.11831382   -0.02422050   -0.01567530    0.01611550
C   -0.72773354    0.68563859   -0.03940064    0.01290972    0.00978102    0.00643514
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   15
   -420.53634309
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O   -1.97876753   -1.28331877    0.11754471   -0.02564186   -0.01716353    0.01642120
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C   -0.80633351   -0.78805875   -0.05978250    0.02267752    0.01063177   -0.02775559
C    0.30823355    1.56133792    0.00689770   -0.01760442   -0.00948533   -0.00101832
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H    2.43057829   -1.99219407    0.01435530    0.00214119    0.00849304    0.00657405
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   15
   -420.53624255
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O   -1.97885320   -1.28517743    0.11658949   -0.02643942   -0.01830720    0.01655358
C   -0.73208269    0.68572037   -0.03716489    0.00247571    0.01302244    0.00572917
C   -0.80640782   -0.78464828   -0.05870342    0.02430834    0.01314990   -0.02757792
C    0.31015113    1.55894458    0.00858334   -0.01404996   -0.01247292   -0.00068464
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C    1.68181533    1.31049296    0.09101761    0.00937373    0.02763581    0.01087439
C    1.68701758   -1.20659300   -0.06955146    0.01557928    0.03124296   -0.01388935
H   -0.05179896    2.57764796   -0.03707206   -0.00520811   -0.00727329   -0.00349295
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C    2.25375523    0.02826756    0.03670092   -0.01342829   -0.05607115    0.00634675
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   15
   -420.53645378
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O   -1.97863953   -1.28682876    0.11544665   -0.02661365   -0.01910828    0.01651307
C   -0.73435382    0.68547733   -0.03617975   -0.00316324    0.01390881    0.00529080
C   -0.80684882   -0.78143637   -0.05720767    0.02524455    0.01545514   -0.02716266
C    0.31228018    1.55673997    0.01027932   -0.00971762   -0.01559639   -0.00032740
C    0.36086770   -1.58724534   -0.05418247    0.00372998    0.01619329    0.01030658
C    1.68222202    1.31024702    0.08587382    0.00733696    0.02549271    0.00954164
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C    2.25307969    0.02976772    0.04131180   -0.01588804   -0.05261031    0.00831403
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   15
   -420.53671483
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O   -1.97812452   -1.28826374    0.11411668   -0.02617735   -0.01952481    0.01629692
C   -0.73657713    0.68502466   -0.03527456   -0.00883105    0.01424549    0.00480282
C   -0.80767063   -0.77845787   -0.05530150    0.02545473    0.01753063   -0.02651662
C    0.31455550    1.55477089    0.01198027   -0.00487021   -0.01850259    0.00002668
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C    1.68251905    1.30961743    0.08058580    0.00424858    0.02185652    0.00818227
C    1.68364444   -1.20827650   -0.07419404    0.00791381    0.02648233   -0.01804062
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C    2.25264619    0.03206128    0.04579684   -0.01984988   -0.04746728    0.01039408
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   15
   -420.53698481
H   -2.55407373    0.47295039   -0.07900121   -0.00219812   -0.00446171   -0.00338801
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C   -0.80887643   -0.77574407   -0.05299468    0.02493419    0.01933045   -0.02564828
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C    1.68174827   -1.20973882   -0.07612167    0.00378393    0.02266741   -0.01989043
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   15
   -420.53714298
H   -2.56169251    0.47800626   -0.08614778   -0.00388302   -0.00421855   -0.00375774
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O   -1.97621720   -1.29046971    0.11090705   -0.02349336   -0.01923954    0.01535075
C   -0.74054131    0.68347882   -0.03367387   -0.01936881    0.01317939    0.00371163
C   -0.81045834   -0.77332217   -0.05030032    0.02367485    0.02083898   -0.02456816
C    0.31924999    1.55170563    0.01537600    0.00519633   -0.02246273    0.00066575
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C    1.67979466   -1.21154284   -0.07774883   -0.00016764    0.01800872   -0.02153111
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   15
   -420.53715353
H   -2.56862180    0.48381489   -0.09261875   -0.00493484   -0.00348606   -0.00405655
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C    1.68325666    1.30603816    0.06406071   -0.00712399    0.00707519    0.00420945
C    1.67784309   -1.21361830   -0.07905074   -0.00370717    0.01265580   -0.02292432
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   15
   -420.53712556
H   -2.57467252    0.49024322   -0.09836081   -0.00530834   -0.00220021   -0.00426035
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C   -0.74334768    0.68114778   -0.03229710   -0.02722841    0.00973351    0.00251388
C   -0.81466335   -0.76943989   -0.04381726    0.01897111    0.02279617   -0.02181884
C    0.32363704    1.54997966    0.01873198    0.01392669   -0.02265058    0.00120615
C    0.35195642   -1.57208385   -0.05156297   -0.00025528    0.01029344    0.01370947
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C    1.67594689   -1.21588451   -0.08000639   -0.00668118    0.00681390   -0.02403426
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C    2.25461867    0.04732085    0.06186108   -0.03611657   -0.01539080    0.01768499
H    3.35699709    0.07541221   -0.02438764    0.00925087    0.00440509   -0.00700019
   15
   -420.53712286
H   -2.57978045    0.49706188   -0.10333790   -0.00492426   -0.00044534   -0.00435674
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O   -1.97144178   -1.29217474    0.10481232   -0.01502814   -0.01605037    0.01278291
C   -0.74416158    0.67974725   -0.03167030   -0.02960408    0.00716825    0.00189123
C   -0.81721533   -0.76800901   -0.04007011    0.01555158    0.02317353   -0.02017258
C    0.32554683    1.54963174    0.02038461    0.01722316   -0.02116757    0.00146302
C    0.35012699   -1.56961280   -0.05163368   -0.00133801    0.00923477    0.01383546
C    1.68417931    1.30298092    0.05269226   -0.01235524   -0.00136678    0.00169820
C    1.67415090   -1.21825343   -0.08059900   -0.00899700    0.00070796   -0.02484470
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H    2.37317491    2.16712885    0.02392648    0.00919241    0.00794586   -0.00369021
H    2.40047106   -2.03007747    0.03080525    0.00479293    0.00053375    0.00928233
C    2.25634679    0.05205036    0.06527020   -0.03742593   -0.00595966    0.01882442
H    3.36369705    0.08503847   -0.01446608    0.01208852    0.00541557   -0.00669083
   15
   -420.53719740
H   -2.58401142    0.50395539   -0.10753193   -0.00391423    0.00170641   -0.00435907
O   -1.90570023    1.22849455   -0.05213977    0.05650151   -0.02546819    0.00346240
O   -1.96946077   -1.29235946    0.10247643   -0.01105358   -0.01430739    0.01167894
C   -0.74452941    0.67823894   -0.03107208   -0.03074044    0.00410376    0.00126041
C   -0.82000163   -0.76692799   -0.03601816    0.01145496    0.02311619   -0.01836477
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   15
   -420.53744025
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O   -1.96735486   -1.29238213    0.10000816   -0.00655174   -0.01227642    0.01048004
C   -0.74443413    0.67666909   -0.03049292   -0.03053264    0.00062582    0.00062610
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H    2.38332961   -2.04300869    0.01840735    0.00181432    0.00098799    0.00836095
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   15
   -420.53770817
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C   -0.74387880    0.67509013   -0.02992323   -0.02898819   -0.00314775   -0.00000906
C   -0.82602074   -0.76580474   -0.02711125    0.00149995    0.02160433   -0.01433970
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C    1.68695271    1.29861258    0.03549302   -0.01207807   -0.00678866   -0.00198337
C    1.66966534   -1.22505880   -0.08009984   -0.01224721   -0.01665392   -0.02542865
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   15
   -420.53790545
H   -2.59359365    0.52106458   -0.11548210    0.00074833    0.00859448   -0.00396175
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O   -1.96297776   -1.29203652    0.09472950    0.00379629   -0.00749186    0.00791131
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C   -0.82910321   -0.76573969   -0.02231708   -0.00416677    0.02015915   -0.01216996
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C    0.34316385   -1.56116954   -0.05399277   -0.00503817    0.01391827    0.01300040
C    1.68825922    1.29733922    0.02979523   -0.00983199   -0.00646763   -0.00321725
C    1.66852582   -1.22693570   -0.07916461   -0.01246388   -0.02125289   -0.02504691
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H    2.39207000    2.13499714   -0.00276000    0.00808010   -0.00104327   -0.00353462
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C    2.26872000    0.07048022    0.07596905   -0.02619536    0.02880447    0.02016080
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   15
   -420.53800740
H   -2.59667550    0.52420764   -0.11666655    0.00177796    0.01010743   -0.00381323
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O   -1.96082376   -1.29172233    0.09194819    0.00943046   -0.00488712    0.00660391
C   -0.74150083    0.67213472   -0.02877389   -0.02211938   -0.01101188   -0.00126799
C   -0.83212233   -0.76597893   -0.01733899   -0.01011545    0.01828589   -0.00993438
C    0.33070438    1.55178378    0.02822364    0.01978596   -0.00392596    0.00326589
C    0.34158148   -1.55950789   -0.05508584   -0.00580749    0.01693585    0.01249213
C    1.68971353    1.29616263    0.02414609   -0.00685516   -0.00529602   -0.00445220
C    1.66757453   -1.22849247   -0.07785101   -0.01250322   -0.02485002   -0.02440156
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C    2.27296614    0.07430825    0.07788417   -0.01979010    0.03561329    0.01989818
H    3.36512030    0.11615429    0.05094980    0.00215271    0.00764277   -0.00298787
   15
   -420.53794430
H   -2.60006712    0.52554402   -0.11716340    0.00206279    0.01077959   -0.00372531
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O   -1.95877683   -1.29135277    0.08909198    0.01516185   -0.00223303    0.00531302
C   -0.73978173    0.67087682   -0.02817521   -0.01708554   -0.01479138   -0.00188762
C   -0.83498841   -0.76649420   -0.01221074   -0.01614900    0.01604393   -0.00766444
C    0.33080424    1.55262322    0.02966856    0.01796013   -0.00076182    0.00374834
C    0.34008695   -1.55810243   -0.05636761   -0.00659995    0.02005660    0.01183111
C    1.69127102    1.29506547    0.01856425   -0.00351740   -0.00359753   -0.00568427
C    1.66681222   -1.22967493   -0.07616878   -0.01249829   -0.02727979   -0.02349518
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H    0.10687482   -2.61647332   -0.15151963   -0.00018646    0.00166889   -0.00299091
H    2.39218663    2.11798751   -0.01222976    0.00335038   -0.00911606   -0.00315998
H    2.34751285   -2.07143078   -0.02345050   -0.00395414    0.00117018    0.00554041
C    2.27751061    0.07759916    0.07949857   -0.01267950    0.04131469    0.01951731
H    3.36152034    0.11841247    0.06625370   -0.00328594    0.00757431   -0.00217766
   15
   -420.53774081
H   -2.60381711    0.52495362   -0.11698836    0.00146155    0.01050289   -0.00371154
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O   -1.95690179   -1.29095783    0.08617545    0.02079174    0.00036931    0.00407612
C   -0.73780526    0.66984218   -0.02754801   -0.01125429   -0.01826088   -0.00249919
C   -0.83761047   -0.76725169   -0.00696662   -0.02204916    0.01350657   -0.00538628
C    0.33063308    1.55347534    0.03105680    0.01571150    0.00145755    0.00422947
C    0.33869232   -1.55699990   -0.05782809   -0.00746958    0.02288985    0.01099827
C    1.69288185    1.29402257    0.01306835   -0.00030862   -0.00180065   -0.00690168
C    1.66623895   -1.23044649   -0.07413163   -0.01253291   -0.02843659   -0.02232535
H    0.03763949    2.58827794    0.09014981    0.00425241   -0.00719727    0.00254555
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H    2.33978271   -2.07915976   -0.03674565   -0.00455670    0.00022492    0.00471707
C    2.28224680    0.08026690    0.08081797   -0.00557491    0.04580366    0.01906953
H    3.35851043    0.11930889    0.08195098   -0.00862534    0.00739145   -0.00145654
   15
   -420.53753101
H   -2.60781833    0.52248472   -0.11614439    0.00004287    0.00934125   -0.00376032
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O   -1.95526228   -1.29056694    0.08321262    0.02608254    0.00281340    0.00291294
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C   -0.83989962   -0.76821317   -0.00164104   -0.02756650    0.01077431   -0.00313496
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C    0.33741080   -1.55624270   -0.05945460   -0.00845968    0.02509221    0.00996798
C    1.69449805    1.29300735    0.00767677    0.00229663   -0.00037640   -0.00809564
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H    0.04693874    2.59129588    0.09817752    0.00529874   -0.00691652    0.00289499
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H    2.38986741    2.10743426   -0.01942451   -0.00097008   -0.01537061   -0.00277502
H    2.33286756   -2.08692170   -0.05088925   -0.00474669   -0.00121595    0.00383892
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   15
   -420.53744542
H   -2.61181772    0.51834300   -0.11462250   -0.00196726    0.00749541   -0.00385626
O   -1.93166126    1.22245428   -0.05271919    0.02213093   -0.02578355    0.00241069
O   -1.95391810   -1.29020774    0.08021667    0.03078318    0.00498752    0.00183699
C   -0.73344010    0.66864516   -0.02617113    0.00183686   -0.02375888   -0.00369553
C   -0.84177285   -0.76933743    0.00373202   -0.03240908    0.00795733   -0.00093711
C    0.32961715    1.55510171    0.03363464    0.01050164    0.00239045    0.00508703
C    0.33625733   -1.55586377   -0.06123158   -0.00959047    0.02640980    0.00873618
C    1.69608077    1.29199879    0.00240756    0.00388283    0.00025857   -0.00926504
C    1.66566294   -1.23070564   -0.06906758   -0.01279241   -0.02709624   -0.01914987
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C    2.29188150    0.08348127    0.08259956    0.00528451    0.05086216    0.01799354
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   15
   -420.53754428
H   -2.61545973    0.51285808   -0.11240580   -0.00419436    0.00522549   -0.00394932
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O   -1.95292236   -1.28990476    0.07719978    0.03465107    0.00677002    0.00086964
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C   -0.84315718   -0.77058206    0.00911933   -0.03633771    0.00518300    0.00118755
C    0.32885091    1.55586168    0.03481132    0.00773350    0.00122546    0.00543543
C    0.33524904   -1.55588283   -0.06314039   -0.01087538    0.02668172    0.00730465
C    1.69760630    1.29098756   -0.00272158    0.00423129   -0.00012843   -0.01041659
C    1.66566389   -1.23021315   -0.06608870   -0.01288336   -0.02489121   -0.01713728
H    0.06256639    2.60079687    0.11259824    0.00633562   -0.00352912    0.00370521
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H    2.32155666   -2.10144202   -0.08107362   -0.00416549   -0.00513152    0.00183175
C    2.29661748    0.08395143    0.08307815    0.00768386    0.05140881    0.01727645
H    3.36151243    0.11422597    0.13017676   -0.01596766    0.00643052    0.00037038
   15
   -420.53779246
H   -2.61834941    0.50643478   -0.10947886   -0.00628523    0.00287501   -0.00399834
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O   -1.95231869   -1.28967815    0.07417292    0.03745296    0.00808189    0.00000700
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C   -0.84399348   -0.77190524    0.01448878   -0.03909401    0.00256837    0.00323012
C    0.32796773    1.55660402    0.03590594    0.00494423   -0.00067366    0.00571991
C    0.33440541   -1.55630397   -0.06515946   -0.01230975    0.02584168    0.00569938
C    1.69906933    1.28997950   -0.00769323    0.00336542   -0.00152926   -0.01157236
C    1.66585949   -1.22934522   -0.06285104   -0.01282634   -0.02196680   -0.01485800
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H    0.10366767   -2.62725520   -0.16075517   -0.00178703   -0.00597406   -0.00164543
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H    2.31706017   -2.10750064   -0.09675294   -0.00365201   -0.00722810    0.00069293
C    2.30124012    0.08364587    0.08329578    0.00777262    0.05067745    0.01634947
H    3.36797950    0.11013276    0.14626252   -0.01389960    0.00602508    0.00110929
   15
   -420.53819481
H   -2.62011441    0.49949069   -0.10583361   -0.00791140    0.00074971   -0.00397623
O   -1.94691129    1.22559154   -0.05341713    0.01200995   -0.01228002    0.00217972
O   -1.95213873   -1.28954270    0.07114588    0.03901251    0.00880667   -0.00074575
C   -0.72735604    0.66958385   -0.02366533    0.02147588   -0.02732280   -0.00540024
C   -0.84424034   -0.77326756    0.01980952   -0.04048805    0.00021134    0.00517744
C    0.32700978    1.55735696    0.03691417    0.00214069   -0.00293096    0.00596824
C    0.33374801   -1.55711446   -0.06726451   -0.01383622    0.02388648    0.00393517
C    1.70048260    1.28899549   -0.01248988    0.00154112   -0.00367835   -0.01275117
C    1.66624873   -1.22814571   -0.05938902   -0.01252151   -0.01859300   -0.01234263
H    0.07368895    2.61270399    0.12434560    0.00637432    0.00199078    0.00462113
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H    2.38738065    2.11912721   -0.02801246    0.00093185   -0.01098577   -0.00223167
H    2.31322186   -2.11226101   -0.11255596   -0.00317758   -0.00912478   -0.00052340
C    2.30574758    0.08257554    0.08326652    0.00594026    0.04874740    0.01517178
H    3.37691940    0.10495551    0.16214583   -0.00980748    0.00558291    0.00203370
   15
   -420.53855165
H   -2.62046487    0.49240537   -0.10147322   -0.00886248   -0.00091455   -0.00387480
O   -1.95231852    1.22698428   -0.05370094    0.00825718   -0.00825307    0.00196628
O   -1.95240007   -1.28950674    0.06812727    0.03920733    0.00896333   -0.00143254
C   -0.72584858    0.67070739   -0.02267807    0.02715665   -0.02722274   -0.00593620
C   -0.84387686   -0.77463348    0.02505206   -0.04038557   -0.00180196    0.00704062
C    0.32601945    1.55815414    0.03783216   -0.00064236   -0.00514220    0.00621474
C    0.33330005   -1.55828501   -0.06942890   -0.01545628    0.02095543    0.00206111
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   15
   -420.53885432
H   -2.61923207    0.48547665   -0.09641675   -0.00897959   -0.00199305   -0.00368272
O   -1.95781908    1.22847123   -0.05400700    0.00414513   -0.00485794    0.00166876
O   -1.95310488   -1.28957188    0.06512484    0.03800888    0.00849840   -0.00205304
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C   -0.84290464   -0.77597267    0.03018824   -0.03874361   -0.00341219    0.00882566
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C    1.70327727    1.28723240   -0.02148615   -0.00339869   -0.00848133   -0.01524897
C    1.66758443   -1.22495788   -0.05194637   -0.01093340   -0.01145851   -0.00684487
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H    2.30720817   -2.11660492   -0.14365491   -0.00275441   -0.01155892   -0.00301515
C    2.31454256    0.07827372    0.08254219   -0.00050832    0.04165547    0.01213549
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   15
   -420.53903061
H   -2.61639527    0.47889708   -0.09069879   -0.00823893   -0.00241593   -0.00340568
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O   -1.95423961   -1.28973290    0.06214567    0.03546261    0.00746473   -0.00263750
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C   -0.84134840   -0.77726074    0.03519108   -0.03562891   -0.00461806    0.01053964
C    0.32410890    1.56000735    0.03938195   -0.00598841   -0.00808309    0.00681485
C    0.33312920   -1.56151786   -0.07382123   -0.01853987    0.01303469   -0.00186798
C    1.70473229    1.28652481   -0.02564801   -0.00566254   -0.01022267   -0.01656971
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H    2.30495808   -2.11575443   -0.15850300   -0.00294339   -0.01182005   -0.00421376
C    2.31892558    0.07514915    0.08189284   -0.00347909    0.03671927    0.01043073
H    3.41032785    0.08378395    0.20675968    0.00677499    0.00384408    0.00571760
   15
   -420.53913099
H   -2.61208594    0.47274274   -0.08436832   -0.00675085   -0.00218452   -0.00307330
O   -1.96891006    1.23158219   -0.05467138   -0.00497459   -0.00021139    0.00084796
O   -1.95577548   -1.28997821    0.05919640    0.03170088    0.00594726   -0.00320777
C   -0.72407011    0.67649543   -0.01914728    0.03932638   -0.02377615   -0.00739590
C   -0.83925503   -0.77847952    0.04003464   -0.03118394   -0.00541749    0.01219180
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C    0.33345282   -1.56346119   -0.07598989   -0.01985611    0.00871027   -0.00381334
C    1.70627224    1.28597067   -0.02955931   -0.00736713   -0.01106793   -0.01791760
C    1.66957445   -1.22107369   -0.04409037   -0.00802116   -0.00500434   -0.00119097
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H    2.38077055    2.15933310   -0.03027370    0.00829921    0.00555192   -0.00134041
H    2.30324205   -2.11278651   -0.17259391   -0.00342677   -0.01136158   -0.00531190
C    2.32335994    0.07147034    0.08108574   -0.00544195    0.03101572    0.00874611
H    3.42036365    0.07519348    0.21988439    0.01120202    0.00316487    0.00698640
   15
   -420.53918752
H   -2.60656989    0.46697378   -0.07748504   -0.00467267   -0.00140523   -0.00269865
O   -1.97439726    1.23315338   -0.05502044   -0.00972119    0.00115301    0.00037158
O   -1.95767003   -1.29029058    0.05628354    0.02693101    0.00400017   -0.00377665
C   -0.72459621    0.67917289   -0.01775615    0.04144253   -0.02185317   -0.00781321
C   -0.83669156   -0.77961678    0.04469394   -0.02559643   -0.00587949    0.01379200
C    0.32255704    1.56233199    0.04051820   -0.01064223   -0.00762029    0.00768120
C    0.33407628   -1.56553657   -0.07810098   -0.02085837    0.00468418   -0.00566468
C    1.70792261    1.28558250   -0.03319971   -0.00829671   -0.01081227   -0.01926863
C    1.67076304   -1.21899422   -0.04011396   -0.00618924   -0.00231074    0.00152030
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H    2.30214769   -2.10778323   -0.18573045   -0.00419175   -0.01019367   -0.00627439
C    2.32787488    0.06732336    0.08014623   -0.00602442    0.02468891    0.00717890
H    3.42840195    0.06603353    0.23175305    0.01425865    0.00246077    0.00812678
   15
   -420.53928213
H   -2.60021750    0.46145244   -0.07011607   -0.00225108   -0.00026339   -0.00231297
O   -1.97977433    1.23471190   -0.05537368   -0.01431111    0.00208320   -0.00012505
O   -1.95986938   -1.29064803    0.05341352    0.02138921    0.00175851   -0.00435655
C   -0.72574761    0.68218045   -0.01624693    0.04249929   -0.01967142   -0.00818166
C   -0.83374212   -0.78066550    0.04914476   -0.01915001   -0.00605432    0.01534007
C    0.32200525    1.56367076    0.04091557   -0.01253715   -0.00593271    0.00822164
C    0.33501462   -1.56768358   -0.08012660   -0.02145365    0.00133980   -0.00736815
C    1.70969736    1.28535640   -0.03654880   -0.00835961   -0.00940054   -0.02059080
C    1.67204504   -1.21687936   -0.03616034   -0.00422572    0.00001381    0.00407648
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H    0.10975294   -2.61770733   -0.16535223   -0.00020885    0.00794450    0.00243616
H    2.36980319    2.17653455   -0.02977775    0.00805784    0.01007939   -0.00071854
H    2.30181085   -2.10095384   -0.19773980   -0.00515287   -0.00839652   -0.00707191
C    2.33247902    0.06280366    0.07909796   -0.00504061    0.01789184    0.00579797
H    3.43389704    0.05643064    0.24216195    0.01567327    0.00175172    0.00903454
   15
   -420.53934819
H   -2.59346248    0.45597825   -0.06233114    0.00029359    0.00093733   -0.00191575
O   -1.98498943    1.23624705   -0.05572552   -0.01848964    0.00277939   -0.00062402
O   -1.96231089   -1.29102529    0.05059293    0.01534131   -0.00064958   -0.00495267
C   -0.72754031    0.68548521   -0.01461409    0.04250877   -0.01730270   -0.00849224
C   -0.83050376   -0.78162293    0.05336374   -0.01216623   -0.00601490    0.01682845
C    0.32164256    1.56509819    0.04118856   -0.01404778   -0.00338805    0.00881470
C    0.33627665   -1.56985199   -0.08204108   -0.02153357   -0.00105402   -0.00887720
C    1.71159741    1.28527105   -0.03958664   -0.00752866   -0.00685225   -0.02184829
C    1.67339093   -1.21476432   -0.03226814   -0.00225805    0.00201785    0.00644506
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H    2.36211192    2.18259317   -0.02930739    0.00661843    0.01066211   -0.00041077
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C    2.33715742    0.05801381    0.07796172   -0.00245262    0.01079178    0.00466787
H    3.43659489    0.04651208    0.25094792    0.01538119    0.00106207    0.00966183
   15
   -420.53941407
H   -2.58675687    0.45033778   -0.05420137    0.00259235    0.00197466   -0.00152124
O   -1.98999541    1.23775059   -0.05607029   -0.02199909    0.00356908   -0.00111620
O   -1.96492621   -1.29139512    0.04782853    0.00905446   -0.00313026   -0.00556192
C   -0.72997450    0.68905143   -0.01285292    0.04150714   -0.01481158   -0.00873720
C   -0.82708175   -0.78248959    0.05732836   -0.00492261   -0.00583209    0.01825078
C    0.32149172    1.56657607    0.04132826   -0.01510105   -0.00020187    0.00942986
C    0.33786359   -1.57200577   -0.08382161   -0.02107888   -0.00236316   -0.01018584
C    1.71361028    1.28528808   -0.04229426   -0.00585233   -0.00327834   -0.02300213
C    1.67477109   -1.21267948   -0.02847313   -0.00042650    0.00379349    0.00860758
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H    2.35324075    2.18674909   -0.02876278    0.00437770    0.01009060   -0.00012373
H    2.30411751   -2.08319142   -0.21783543   -0.00728941   -0.00350299   -0.00814919
C    2.34187111    0.05306096    0.07675455    0.00168142    0.00355741    0.00382988
H    3.43654770    0.03640167    0.25799891    0.01337684    0.00040202    0.00995120
   15
   -420.53933587
H   -2.58051184    0.44434874   -0.04579742    0.00445564    0.00254085   -0.00113952
O   -1.99475264    1.23921339   -0.05640239   -0.02463260    0.00465061   -0.00162184
O   -1.96764425   -1.29172949    0.04512723    0.00277634   -0.00556858   -0.00618325
C   -0.73303512    0.69284150   -0.01095975    0.03955768   -0.01223714   -0.00890712
C   -0.82358524   -0.78326818    0.06101712    0.00226695   -0.00555975    0.01959695
C    0.32156856    1.56805661    0.04132538   -0.01562569    0.00330845    0.01003544
C    0.33976851   -1.57412501   -0.08544842   -0.02006287   -0.00267131   -0.01126387
C    1.71571072    1.28535366   -0.04465426   -0.00343773    0.00112597   -0.02402254
C    1.67615806   -1.21065191   -0.02480802    0.00110242    0.00549539    0.01056588
H    0.07189857    2.62058025    0.13074872    0.00419789   -0.00082728    0.00517140
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H    2.34359123    2.18910423   -0.02819546    0.00147835    0.00844856    0.00013143
H    2.30714143   -2.07313333   -0.22572703   -0.00817963   -0.00082480   -0.00847759
C    2.34655778    0.04805427    0.07548912    0.00719324   -0.00363877    0.00330171
H    3.43411397    0.02621797    0.26326293    0.00981842   -0.00021148    0.00989666
   15
   -420.53901229
H   -2.57506012    0.43791207   -0.03718824    0.00572040    0.00243287   -0.00075558
O   -1.99923138    1.24062302   -0.05671605   -0.02626313    0.00618943   -0.00215775
O   -1.97039398   -1.29200080    0.04249607   -0.00327898   -0.00788041   -0.00680434
C   -0.73669278    0.69681653   -0.00893199    0.03674076   -0.00961452   -0.00899351
C   -0.82012263   -0.78396275    0.06440971    0.00914578   -0.00524468    0.02085586
C    0.32188093    1.56948722    0.04117085   -0.01554383    0.00674402    0.01057768
C    0.34197616   -1.57620486   -0.08690519   -0.01854703   -0.00217423   -0.01212304
C    1.71786248    1.28540153   -0.04665125   -0.00048066    0.00607593   -0.02488148
C    1.67752894   -1.20870754   -0.02130244    0.00215544    0.00728901    0.01234208
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C    2.35113443    0.04310233    0.07417342    0.01375207   -0.01062895    0.00305409
H    3.42993106    0.01607156    0.26675006    0.00499385   -0.00076784    0.00951256
   15
   -420.53846945
H   -2.57062692    0.43104573   -0.02844497    0.00628498    0.00166668   -0.00030267
O   -2.00341314    1.24196188   -0.05700523   -0.02687509    0.00826660   -0.00272144
O   -1.97310689   -1.29218285    0.03994207   -0.00893314   -0.01002513   -0.00740793
C   -0.74090497    0.70093689   -0.00676835    0.03313311   -0.00696709   -0.00899249
C   -0.81679764   -0.78457802    0.06748710    0.01549839   -0.00492928    0.02200553
C    0.32242754    1.57081641    0.04085652   -0.01479760    0.00970915    0.01101684
C    0.34446367   -1.57825236   -0.08817891   -0.01658154   -0.00122752   -0.01277753
C    1.72002119    1.28535736   -0.04827227    0.00274325    0.01116466   -0.02555685
C    1.67886789   -1.20687362   -0.01798330    0.00262570    0.00930548    0.01396656
H    0.06202640    2.61494876    0.12131332    0.00301152   -0.00573184    0.00467515
H    0.11755442   -2.63753752   -0.17857646   -0.00214167    0.00059099    0.00260863
H    2.32411310    2.18973410   -0.02716936   -0.00539639    0.00292514    0.00053115
H    2.31769492   -2.05301071   -0.23688798   -0.00885195    0.00378298   -0.00895085
C    2.35550252    0.03831066    0.07281128    0.02084944   -0.01724522    0.00301907
H    3.42486008    0.00606253    0.26852808   -0.00062333   -0.00126674    0.00886419
   15
   -420.53764993
H   -2.56731616    0.42388813   -0.01964813    0.00626054    0.00024819    0.00018766
O   -2.00729090    1.24320657   -0.05726348   -0.02655317    0.01073695   -0.00335048
O   -1.97571895   -1.29225142    0.03747209   -0.01406449   -0.01191481   -0.00798480
C   -0.74561727    0.70516260   -0.00446885    0.02883947   -0.00431650   -0.00890278
C   -0.81370612   -0.78511876    0.07023192    0.02113824   -0.00462176    0.02303969
C    0.32319707    1.57199979    0.04037576   -0.01335548    0.01185119    0.01133013
C    0.34720157   -1.58028145   -0.08925964   -0.01428070   -0.00017003   -0.01326130
C    1.72213850    1.28514479   -0.04950711    0.00590134    0.01589941   -0.02603759
C    1.68016809   -1.20518077   -0.01487517    0.00237750    0.01164545    0.01546275
H    0.05621960    2.61346964    0.11531042    0.00203774   -0.00708459    0.00448796
H    0.11987815   -2.64358835   -0.18271656   -0.00270225   -0.00235085    0.00231426
H    2.31551276    2.18899179   -0.02678268   -0.00873700   -0.00016882    0.00068532
H    2.32534254   -2.04376875   -0.24007071   -0.00838194    0.00530261   -0.00919055
C    2.35955547    0.03377911    0.07140332    0.02784350   -0.02333733    0.00310394
H    3.41990281   -0.00371956    0.26871102   -0.00637720   -0.00171375    0.00809339
   15
   -420.53669849
H   -2.56512522    0.41669151   -0.01088665    0.00575579   -0.00160874    0.00074834
O   -2.01086817    1.24432925   -0.05748369   -0.02543994    0.01342755   -0.00403508
O   -1.97817206   -1.29218502    0.03509265   -0.01858066   -0.01353238   -0.00852132
C   -0.75076488    0.70945357   -0.00203486    0.02394412   -0.00167802   -0.00872097
C   -0.81093319   -0.78558959    0.07262855    0.02595000   -0.00434025    0.02394207
C    0.32416762    1.57300527    0.03972391   -0.01120470    0.01294583    0.01150314
C    0.35015514   -1.58230763   -0.09014009   -0.01171090    0.00063018   -0.01359076
C    1.72416709    1.28469296   -0.05034851    0.00863204    0.01971302   -0.02632241
C    1.68143323   -1.20366439   -0.01200069    0.00141586    0.01432529    0.01683876
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   15
   -420.53580322
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C   -0.75627387    0.71376989    0.00053087    0.01852062    0.00094442   -0.00844863
C   -0.80855154   -0.78599473    0.07466335    0.02986127   -0.00410201    0.02470030
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   15
   -420.53510147
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C    0.32657195    1.57443321    0.03789877   -0.00504098    0.01195940    0.01144728
C    0.35655168   -1.58639072   -0.09128155   -0.00617501    0.00048050   -0.01394593
C    1.72780585    1.28286479   -0.05083669    0.01162067    0.02269851   -0.02631332
C    1.68392624   -1.20132664   -0.00703357   -0.00236954    0.02030047    0.01911218
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C    2.36886197    0.02261079    0.06690012    0.03977939   -0.03694779    0.00245091
H    3.41519400   -0.03088823    0.26102956   -0.01628566   -0.00316465    0.00646533
   15
   -420.53466128
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O   -2.01995138    1.24667301   -0.05783639   -0.01934915    0.01981741   -0.00623295
O   -1.98410373   -1.29100943    0.02855520   -0.02805509   -0.01654635   -0.00977135
C   -0.76804171    0.72232082    0.00603978    0.00642150    0.00606447   -0.00764043
C   -0.80518408   -0.78662168    0.07760414    0.03484183   -0.00376572    0.02573258
C    0.32791299    1.57487000    0.03672613   -0.00131707    0.01030072    0.01128690
C    0.35991121   -1.58844495   -0.09153713   -0.00340789   -0.00076855   -0.01402150
C    1.72937116    1.28144383   -0.05048361    0.01160865    0.02142948   -0.02602178
C    1.68521093   -1.20059514   -0.00497517   -0.00486300    0.02321577    0.01989808
H    0.03184453    2.61973050    0.08345809   -0.00431360   -0.00259679    0.00397428
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C    2.37081427    0.01992511    0.06531717    0.03872914   -0.03949614    0.00158439
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   15
   -420.53445801
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O   -1.98548569   -1.29025414    0.02659209   -0.02983848   -0.01687186   -0.01003271
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C   -0.80427361   -0.78684856    0.07849451    0.03592212   -0.00368515    0.02599483
C    0.32927373    1.57515148    0.03538291    0.00258444    0.00828934    0.01107364
C    0.36332238   -1.59048658   -0.09158077   -0.00074036   -0.00281860   -0.01405289
C    1.73076204    1.27970089   -0.04973732    0.01069794    0.01849263   -0.02553506
C    1.68656929   -1.20021421   -0.00321723   -0.00748220    0.02577332    0.02036914
H    0.02689784    2.62332644    0.07364939   -0.00612772   -0.00004894    0.00378350
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C    2.37218395    0.01783530    0.06371059    0.03522554   -0.04094494    0.00043634
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   15
   -420.53441108
H   -2.56675325    0.39178580    0.02861710    0.00217944   -0.00903558    0.00384277
O   -2.02486939    1.24715834   -0.05773287   -0.01440701    0.02064711   -0.00748219
O   -1.98652979   -1.28930778    0.02474270   -0.03095172   -0.01684559   -0.01020231
C   -0.78019217    0.73050625    0.01200919   -0.00679089    0.01094510   -0.00651561
C   -0.80390520   -0.78701962    0.07899207    0.03610391   -0.00367920    0.02607230
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C    1.73199194    1.27767982   -0.04860522    0.00914885    0.01432908   -0.02484436
C    1.68804065   -1.20022222   -0.00176681   -0.00999893    0.02773737    0.02046857
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H    0.14569347   -2.65917072   -0.21417531   -0.00239458   -0.00625251    0.00049008
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H    2.39290941   -2.01025956   -0.22269596    0.00370640    0.00400319   -0.01026381
C    2.37302331    0.01636324    0.06209756    0.02987296   -0.04128599   -0.00084828
H    3.43398812   -0.05280718    0.24247159   -0.00660097   -0.00544690    0.00742364
   15
   -420.53447272
H   -2.56867534    0.39091840    0.03487281    0.00204480   -0.00913315    0.00429786
O   -2.02706914    1.24705074   -0.05755725   -0.01196709    0.01975072   -0.00794733
O   -1.98722340   -1.28817067    0.02300894   -0.03141332   -0.01646031   -0.01027411
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C   -0.80408159   -0.78713494    0.07909565    0.03540569   -0.00376664    0.02596236
C    0.33181987    1.57536836    0.03219811    0.01008250    0.00458018    0.01054172
C    0.37014134   -1.59439733   -0.09103076    0.00404148   -0.00892575   -0.01400690
C    1.73308387    1.27544291   -0.04709774    0.00729094    0.00949671   -0.02394228
C    1.68966282   -1.20064865   -0.00062539   -0.01222473    0.02893202    0.02016847
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H    0.15189188   -2.65719549   -0.22000223   -0.00162321   -0.00402094    0.00034764
H    2.31473893    2.19629085   -0.02895587   -0.00766081    0.00535012    0.00160220
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C    2.37341210    0.01551409    0.06049726    0.02359293   -0.04055508   -0.00208041
H    3.44370869   -0.05835323    0.23372380   -0.00074469   -0.00634708    0.00790562
   15
   -420.53458137
H   -2.57096960    0.39168725    0.04035657    0.00219072   -0.00867145    0.00463411
O   -2.02913304    1.24671989   -0.05729161   -0.00963608    0.01799244   -0.00827245
O   -1.98756126   -1.28684716    0.02139164   -0.03123456   -0.01572651   -0.01024284
C   -0.79193084    0.73803141    0.01837137   -0.02020104    0.01549058   -0.00512528
C   -0.80479231   -0.78719318    0.07880693    0.03388402   -0.00396739    0.02565763
C    0.33289237    1.57535921    0.03036458    0.01329741    0.00340524    0.01023136
C    0.37347694   -1.59617466   -0.09043779    0.00608952   -0.01252937   -0.01391038
C    1.73406550    1.27306249   -0.04522851    0.00547529    0.00457784   -0.02283411
C    1.69146926   -1.20151143    0.00021159   -0.01399671    0.02923382    0.01945373
H    0.01978537    2.63250695    0.04034360   -0.01009057    0.00582229    0.00279595
H    0.15838013   -2.65450253   -0.22589170   -0.00071851   -0.00135404    0.00023490
H    2.32270340    2.19728852   -0.03025596   -0.00482158    0.00869865    0.00161356
H    2.41469587   -2.00614947   -0.20231053    0.00744604    0.00314067   -0.00935179
C    2.37344428    0.01527697    0.05892819    0.01723619   -0.03886622   -0.00311219
H    3.45356442   -0.06275733    0.22355490    0.00504324   -0.00723358    0.00821434
   15
   -420.53477193
H   -2.57366185    0.39400957    0.04500797    0.00259182   -0.00769193    0.00483904
O   -2.03108747    1.24618564   -0.05693225   -0.00748506    0.01545366   -0.00845057
O   -1.98754538   -1.28534558    0.01989043   -0.03042582   -0.01464555   -0.01010630
C   -0.79739275    0.74145968    0.02167408   -0.02660480    0.01759132   -0.00434270
C   -0.80601438   -0.78719129    0.07813050    0.03156049   -0.00429443    0.02515853
C    0.33376451    1.57529774    0.02837639    0.01594455    0.00290368    0.00987859
C    0.37672071   -1.59776264   -0.08963463    0.00791574   -0.01605639   -0.01372073
C    1.73496396    1.27061240   -0.04301428    0.00398289    0.00002994   -0.02153229
C    1.69348658   -1.20281497    0.00075494   -0.01517625    0.02854909    0.01833720
H    0.02078033    2.63386319    0.02814570   -0.01061094    0.00643898    0.00235927
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H    2.33153786    2.19672955   -0.03184550   -0.00211729    0.01141669    0.00155454
H    2.42373770   -2.00497546   -0.18954514    0.00855090    0.00320523   -0.00853335
C    2.37321507    0.01562643    0.05740580    0.01153303   -0.03628626   -0.00383909
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   15
   -420.53512886
H   -2.57682352    0.39770998    0.04879019    0.00318543   -0.00627129    0.00491070
O   -2.03295677    1.24547668   -0.05647715   -0.00556936    0.01226294   -0.00848037
O   -1.98718495   -1.28367814    0.01850378   -0.02899053   -0.01323186   -0.00986198
C   -0.80245295    0.74462218    0.02504240   -0.03255504    0.01953257   -0.00350744
C   -0.80771269   -0.78712430    0.07707392    0.02846557   -0.00476876    0.02446347
C    0.33439641    1.57519148    0.02623892    0.01791318    0.00312952    0.00947010
C    0.37984504   -1.59910843   -0.08862417    0.00953657   -0.01911573   -0.01339740
C    1.73580151    1.26816096   -0.04047470    0.00305158   -0.00378261   -0.02005642
C    1.69573259   -1.20454904    0.00102151   -0.01569545    0.02690755    0.01686132
H    0.02367860    2.63407297    0.01552331   -0.01065217    0.00620501    0.00190459
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H    2.43124806   -2.00438364   -0.17524544    0.00906187    0.00363058   -0.00750156
C    2.37281009    0.01652356    0.05594103    0.00697344   -0.03292737   -0.00420939
H    3.46968761   -0.06752328    0.19878800    0.01384820   -0.00864291    0.00796415
   15
   -420.53569615
H   -2.58056036    0.40253404    0.05169053    0.00389572   -0.00451882    0.00485836
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O   -1.98649627   -1.28186083    0.01722890   -0.02693291   -0.01151170   -0.00951267
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C   -0.80984049   -0.78698501    0.07564768    0.02462862   -0.00540912    0.02357827
C    0.33475836    1.57503703    0.02395835    0.01914082    0.00405841    0.00898429
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C    1.73659207    1.26576555   -0.03763205    0.00282936   -0.00664150   -0.01843492
C    1.69821510   -1.20668887    0.00103353   -0.01552648    0.02437315    0.01507838
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H    2.34994649    2.18917048   -0.03583881    0.00204356    0.01382636    0.00124940
H    2.43713539   -2.00445014   -0.15959731    0.00897706    0.00438194   -0.00629562
C    2.37229794    0.01791771    0.05453945    0.00384604   -0.02888636   -0.00422031
H    3.47438105   -0.06763314    0.18423518    0.01609121   -0.00905230    0.00738001
   15
   -420.53651539
H   -2.58499848    0.40816883    0.05371776    0.00460313   -0.00258010    0.00470470
O   -2.03652358    1.24368436   -0.05527992   -0.00261009    0.00461629   -0.00815691
O   -1.98550264   -1.27991316    0.01606185   -0.02426915   -0.00951126   -0.00906628
C   -0.81101899    0.75003540    0.03192455   -0.04232803    0.02281040   -0.00168459
C   -0.81233983   -0.78676373    0.07386516    0.02009497   -0.00622057    0.02251005
C    0.33483186    1.57482050    0.02154205    0.01959833    0.00558082    0.00840737
C    0.38563967   -1.60090277   -0.08600410    0.01230752   -0.02243214   -0.01213906
C    1.73733883    1.26346929   -0.03451081    0.00342127   -0.00843387   -0.01670473
C    1.70093155   -1.20919631    0.00081785   -0.01469292    0.02108352    0.01305672
H    0.03512891    2.63136147   -0.01066995   -0.00932915    0.00342542    0.00103645
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H    2.35877491    2.18174112   -0.03818795    0.00324649    0.01323856    0.00103138
H    2.44141401   -2.00530900   -0.14281768    0.00835648    0.00537690   -0.00496894
C    2.37172572    0.01974797    0.05320134    0.00229194   -0.02429006   -0.00391686
H    3.47620290   -0.06611680    0.16835813    0.01663532   -0.00922648    0.00652030
   15
   -420.53750277
H   -2.59026287    0.41426814    0.05489939    0.00515820   -0.00064324    0.00447238
O   -2.03825465    1.24268727   -0.05454139   -0.00159020    0.00064407   -0.00786823
O   -1.98423426   -1.27785782    0.01499757   -0.02102143   -0.00726074   -0.00853013
C   -0.81437754    0.75223667    0.03541083   -0.04576448    0.02406663   -0.00069459
C   -0.81514222   -0.78644822    0.07174250    0.01490949   -0.00719832    0.02126809
C    0.33460995    1.57451910    0.01899877    0.01930764    0.00750197    0.00773009
C    0.38826805   -1.60130170   -0.08441359    0.01349108   -0.02226663   -0.01113139
C    1.73803284    1.26129922   -0.03113708    0.00484816   -0.00913802   -0.01490129
C    1.70386945   -1.21202186    0.00040496   -0.01328232    0.01724309    0.01087895
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   15
   -420.53858071
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O   -1.98272791   -1.27572032    0.01402997   -0.01723491   -0.00480201   -0.00791343
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C   -0.81816935   -0.78602369    0.06929849    0.00914183   -0.00833510    0.01986204
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C    2.37047114    0.02443287    0.05069348    0.00380116   -0.01388487   -0.00260947
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   15
   -420.53954106
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O   -1.98102649   -1.27352849    0.01315208   -0.01298273   -0.00217278   -0.00722697
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C    1.71031799   -1.21839200   -0.00087979   -0.00926627    0.00898465    0.00634230
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H    2.44605693   -2.01448249   -0.08810342    0.00457505    0.00835612   -0.00090275
C    2.36976645    0.02713039    0.04950413    0.00650516   -0.00829371   -0.00176294
H    3.46499117   -0.05169204    0.11450116    0.00843661   -0.00834295    0.00298635
   15
   -420.54030720
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O   -2.04336970    1.23981300   -0.05180434    0.00003889   -0.00879837   -0.00700648
O   -1.97917814   -1.27131201    0.01235614   -0.00836557    0.00053863   -0.00649237
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C    0.33226437    1.57281532    0.01071659    0.01480448    0.01255959    0.00516809
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C    1.73952371    1.25558050   -0.01977504    0.01347154   -0.00601178   -0.00943475
C    1.71376831   -1.22181247   -0.00168324   -0.00700986    0.00516839    0.00411936
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H    3.45732653   -0.04377173    0.09517692    0.00322171   -0.00760970    0.00178650
   15
   -420.54071382
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O   -1.97723510   -1.26910168    0.01163380   -0.00352197    0.00329439   -0.00571863
C   -0.82066436    0.75728774    0.04929811   -0.04694521    0.02587663    0.00382604
C   -0.82769410   -0.78391607    0.06026107   -0.01048439   -0.01228539    0.01486817
C    0.33099794    1.57189673    0.00778135    0.01249203    0.01283056    0.00425830
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C    1.73967925    1.25388628   -0.01566587    0.01712572   -0.00418086   -0.00768155
C    1.71732474   -1.22531169   -0.00254908   -0.00482161    0.00190172    0.00197577
H    0.08827882    2.62142655   -0.07839274   -0.00127818   -0.00671951   -0.00049593
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H    2.39401327    2.11819419   -0.05192607    0.00059948   -0.00398326    0.00012038
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C    2.36800664    0.03281476    0.04719258    0.01373806    0.00314718   -0.00013134
H    3.44908823   -0.03448360    0.07552964   -0.00242370   -0.00675776    0.00070197
   15
   -420.54080993
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C   -0.82042684    0.75757779    0.05267002   -0.04400681    0.02549666    0.00509324
C   -0.83068747   -0.78286927    0.05676398   -0.01723724   -0.01358482    0.01301823
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C    1.73957600    1.25225565   -0.01144047    0.02063641   -0.00265370   -0.00598384
C    1.72095424   -1.22884063   -0.00344491   -0.00279263   -0.00059033   -0.00006725
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C    2.36684381    0.03562885    0.04604586    0.01689807    0.00880584    0.00052328
H    3.44128143   -0.02398053    0.05575400   -0.00772575   -0.00581593   -0.00022672
   15
   -420.54062267
H   -2.63978645    0.44540454    0.04671868   -0.00071113    0.00237393    0.00308569
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O   -1.97328466   -1.26482378    0.01037473    0.00611555    0.00861901   -0.00412827
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C   -0.83342052   -0.78161725    0.05307012   -0.02372780   -0.01474313    0.01111396
C    0.32793704    1.56949522    0.00173081    0.00734625    0.00984969    0.00259620
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C    1.73916144    1.25066604   -0.00712456    0.02358549   -0.00187497   -0.00432187
C    1.72462622   -1.23236167   -0.00433986   -0.00097552   -0.00224627   -0.00200775
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H    0.20996768   -2.65945705   -0.28023892    0.00333934   -0.00655263   -0.00665900
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C    2.36542717    0.03831001    0.04489137    0.01867359    0.01429131    0.00105758
H    3.43484821   -0.01243076    0.03601693   -0.01183712   -0.00484727   -0.00100174
   15
   -420.54029351
H   -2.64937844    0.44883441    0.04319562   -0.00301341    0.00144657    0.00292312
O   -2.05018265    1.23735886   -0.04703995   -0.00040703   -0.01154995   -0.00674017
O   -1.97138620   -1.26281639    0.00981997    0.01049309    0.01098961   -0.00333929
C   -0.81802084    0.75701282    0.05916287   -0.03495295    0.02384781    0.00774849
C   -0.83579542   -0.78014259    0.04920826   -0.02971271   -0.01566918    0.00917917
C    0.32622025    1.56805720   -0.00135939    0.00462902    0.00669740    0.00190728
C    0.40032871   -1.59655777   -0.06981882    0.01508316   -0.00514933   -0.00031271
C    1.73839143    1.24910608   -0.00274328    0.02561002   -0.00216991   -0.00266795
C    1.72831318   -1.23584971   -0.00520457    0.00066646   -0.00310074   -0.00384461
H    0.12553625    2.62624479   -0.11830250    0.00319862   -0.00386143   -0.00177947
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H    2.41224993    2.08232049   -0.06067878   -0.00098346   -0.01340372   -0.00014475
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C    2.36373073    0.04077546    0.04372098    0.01837254    0.01946949    0.00152364
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   15
   -420.53988741
H   -2.65842916    0.45200375    0.03914672   -0.00525407    0.00053644    0.00270732
O   -2.05188367    1.23706993   -0.04565734   -0.00134799   -0.01109634   -0.00677191
O   -1.96960621   -1.26093340    0.00930312    0.01427352    0.01306713   -0.00257173
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C   -0.83772202   -0.77843143    0.04520764   -0.03492425   -0.01626576    0.00723109
C    0.32443345    1.56651881   -0.00447854    0.00190447    0.00280028    0.00131627
C    0.40110180   -1.59527440   -0.06752614    0.01394273   -0.00421418    0.00088906
C    1.73723557    1.24758041    0.00167829    0.02650336   -0.00367598   -0.00098616
C    1.73199015   -1.23929165   -0.00601128    0.00223925   -0.00329232   -0.00557114
H    0.13713642    2.62962699   -0.13108217    0.00446774   -0.00125670   -0.00239669
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H    2.41864960    2.07458981   -0.06356765    0.00010184   -0.01401920   -0.00034275
H    2.43705819   -2.07055167    0.02033869    0.00200697    0.00152106    0.00547505
C    2.36175946    0.04294713    0.04252753    0.01565592    0.02416687    0.00201218
H    3.42868130    0.01311200   -0.00279566   -0.01391519   -0.00288915   -0.00237465
   15
   -420.53941039
H   -2.66653890    0.45507302    0.03461130   -0.00717922   -0.00015064    0.00244469
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O   -1.96798742   -1.25919823    0.00881547    0.01726336    0.01474267   -0.00183288
C   -0.81351562    0.75501061    0.06518656   -0.02297624    0.02118638    0.01050799
C   -0.83912177   -0.77647483    0.04109772   -0.03913603   -0.01644865    0.00528144
C    0.32261792    1.56493844   -0.00761766   -0.00081570   -0.00142629    0.00079037
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C    1.73568045    1.24611160    0.00611473    0.02620930   -0.00623435    0.00073754
C    1.73563323   -1.24268439   -0.00673392    0.00385108   -0.00303043   -0.00716779
H    0.14793323    2.63323138   -0.14342988    0.00566573    0.00163680   -0.00305568
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H    2.43437690   -2.08295588    0.03598878    0.00247191   -0.00111046    0.00637807
C    2.35955426    0.04475423    0.04130351    0.01066711    0.02818905    0.00260818
H    3.42931674    0.02675159   -0.02162119   -0.01154445   -0.00184309   -0.00316186
   15
   -420.53883790
H   -2.67336295    0.45816314    0.02963668   -0.00860570   -0.00045055    0.00213110
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O   -1.96656358   -1.25762984    0.00834864    0.01928611    0.01595070   -0.00112765
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C   -0.83993124   -0.77427013    0.03690793   -0.04216165   -0.01614316    0.00334544
C    0.32081465    1.56337948   -0.01076875   -0.00345546   -0.00556202    0.00028510
C    0.40203869   -1.59251413   -0.06299496    0.01074085   -0.00494937    0.00258506
C    1.73373035    1.24473786    0.01053995    0.02486354   -0.00947301    0.00250899
C    1.73921789   -1.24603157   -0.00734837    0.00561912   -0.00256762   -0.00861086
H    0.15771121    2.63654308   -0.15522743    0.00680276    0.00442129   -0.00371927
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H    2.43125319   -2.09516038    0.05049138    0.00281009   -0.00366842    0.00722428
C    2.35718981    0.04613620    0.04003988    0.00401815    0.03133675    0.00335864
H    3.43200435    0.04072152   -0.03987517   -0.00741110   -0.00069460   -0.00410042
   15
   -420.53815960
H   -2.67864780    0.46132809    0.02427896   -0.00939314   -0.00026369    0.00176881
O   -2.05681856    1.23693893   -0.04104770   -0.00753674   -0.01022190   -0.00679184
O   -1.96535751   -1.25624192    0.00789464    0.02022358    0.01663687   -0.00045636
C   -0.80762654    0.75173136    0.07057459   -0.00986639    0.01765508    0.01329657
C   -0.84010486   -0.77182201    0.03266752   -0.04385458   -0.01530156    0.00142939
C    0.31906348    1.56190401   -0.01392414   -0.00595217   -0.00920500   -0.00024313
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C    1.73140529    1.24350753    0.01492719    0.02272732   -0.01288438    0.00430765
C    1.74271733   -1.24933988   -0.00783284    0.00760898   -0.00214390   -0.00987035
H    0.16626557    2.63906595   -0.16635621    0.00789000    0.00675072   -0.00432870
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H    2.42762718   -2.10670911    0.06369395    0.00292289   -0.00588452    0.00799734
C    2.35476555    0.04704561    0.03872528   -0.00340592    0.03345291    0.00425350
H    3.43601143    0.05481435   -0.05738873   -0.00230691    0.00058106   -0.00517964
   15
   -420.53740167
H   -2.68225254    0.46453414    0.01860304   -0.00949035    0.00043763    0.00137538
O   -2.05832947    1.23712969   -0.03935696   -0.01076164   -0.01046972   -0.00676347
O   -1.96437981   -1.25504224    0.00744583    0.02002373    0.01678008    0.00018427
C   -0.80440832    0.74967757    0.07297759   -0.00344102    0.01556734    0.01467796
C   -0.83961716   -0.76914322    0.02840547   -0.04413636   -0.01390328   -0.00045729
C    0.31740203    1.56056670   -0.01707576   -0.00821981   -0.01203599   -0.00085525
C    0.40233001   -1.58944081   -0.05861572    0.00674048   -0.00836024    0.00340968
C    1.72873721    1.24247159    0.01924931    0.02011475   -0.01594443    0.00610032
C    1.74610138   -1.25261541   -0.00816832    0.00987215   -0.00199859   -0.01090371
H    0.17340008    2.64038453   -0.17670740    0.00892670    0.00834102   -0.00482927
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   15
   -420.53662956
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O   -1.96362822   -1.25403240    0.00699496    0.01871180    0.01637305    0.00079933
C   -0.80113767    0.74738868    0.07515871    0.00264485    0.01326120    0.01603059
C   -0.83846374   -0.76625486    0.02415028   -0.04304006   -0.01195546   -0.00230731
C    0.31586450    1.55941009   -0.02021429   -0.01017496   -0.01382121   -0.00159667
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C    2.35017980    0.04733622    0.03588842   -0.01695716    0.03428485    0.00616297
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   15
   -420.53596932
H   -2.68446516    0.47047743    0.00657843   -0.00786470    0.00318748    0.00059845
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O   -1.96308797   -1.25320782    0.00653505    0.01637678    0.01546459    0.00139416
C   -0.79790639    0.74489956    0.07709750    0.00823006    0.01072972    0.01734247
C   -0.83666117   -0.76318635    0.01992993   -0.04061660   -0.00950232   -0.00410896
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C    0.40221389   -1.58585931   -0.05444027    0.00272040   -0.01224759    0.00373402
C    1.72253093    1.24115313    0.02759085    0.01463924   -0.01923045    0.00947804
C    1.75238292   -1.25907028   -0.00833382    0.01509242   -0.00305158   -0.01218812
H    0.18268108    2.63843551   -0.19474210    0.01073921    0.00870007   -0.00538316
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H    2.44118846    2.07084176   -0.07705628    0.01485659   -0.00111401   -0.00318184
H    2.41385940   -2.13394836    0.09423868    0.00105277   -0.00894426    0.00947578
C    2.34822147    0.04670485    0.03433752   -0.02167672    0.03302816    0.00696996
H    3.44687629    0.09544183   -0.10349785    0.01118078    0.00491447   -0.00854166
   15
   -420.53550168
H   -2.68336026    0.47272408    0.00036922   -0.00644674    0.00489496    0.00025736
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O   -1.96273268   -1.25255827    0.00605933    0.01316822    0.01411548    0.00197315
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C   -0.83424591   -0.75997467    0.01577162   -0.03702145   -0.00662001   -0.00584883
C    0.31327293    1.55772893   -0.02640489   -0.01280896   -0.01386861   -0.00354362
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C    1.71907500    1.24091968    0.03155929    0.01221765   -0.01894505    0.01099741
C    1.75520165   -1.26223347   -0.00814442    0.01790603   -0.00440748   -0.01241335
H    0.18450450    2.63510401   -0.20232529    0.01143125    0.00739782   -0.00540843
H    0.19575789   -2.62746598   -0.23936179    0.00548378    0.00611952   -0.00593859
H    2.43801576    2.07353470   -0.07785026    0.01572281    0.00047969   -0.00357808
H    2.40868042   -2.13994979    0.10110430   -0.00032252   -0.00853836    0.00961579
C    2.34658854    0.04557531    0.03268149   -0.02446311    0.03077911    0.00756581
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   15
   -420.53532922
H   -2.68109623    0.47409123   -0.00588720   -0.00493062    0.00649104   -0.00002814
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O   -1.96252615   -1.25206851    0.00556124    0.00928061    0.01240965    0.00254011
C   -0.79188982    0.73947717    0.08016955    0.01745835    0.00499131    0.01979928
C   -0.83127211   -0.75666333    0.01170165   -0.03244339   -0.00339704   -0.00751251
C    0.31225857    1.55720516   -0.02942756   -0.01335886   -0.01218532   -0.00474354
C    0.40192887   -1.58154987   -0.05049017   -0.00041254   -0.01363615    0.00396225
C    1.71543384    1.24097094    0.03536163    0.01019494   -0.01726102    0.01236480
C    1.75774964   -1.26532938   -0.00776768    0.02070833   -0.00628727   -0.01236073
H    0.18427244    2.63045331   -0.20893744    0.01197704    0.00521436   -0.00524816
H    0.18982767   -2.62396143   -0.22855075    0.00534437    0.00722477   -0.00559652
H    2.43202733    2.07615271   -0.07800174    0.01558857    0.00129019   -0.00384700
H    2.40356266   -2.14442426    0.10624175   -0.00196297   -0.00746884    0.00957544
C    2.34532298    0.04398146    0.03091148   -0.02514539    0.02769935    0.00784159
H    3.44561218    0.11856110   -0.12692196    0.01382126    0.00757830   -0.00998301
   15
   -420.53545565
H   -2.67794221    0.47429572   -0.01213947   -0.00357675    0.00768693   -0.00025426
O   -2.06318683    1.23999751   -0.02975593   -0.02936301   -0.01251753   -0.00684272
O   -1.96242448   -1.25171928    0.00503436    0.00493729    0.01045275    0.00309730
C   -0.78924389    0.73663062    0.08126573    0.02096118    0.00181325    0.02090542
C   -0.82780869   -0.75330090    0.00774515   -0.02711504    0.00004601   -0.00908373
C    0.31144545    1.55686454   -0.03237834   -0.01331263   -0.00959999   -0.00606311
C    0.40178444   -1.57908952   -0.04860410   -0.00139682   -0.01266247    0.00411163
C    1.71163795    1.24128156    0.03897723    0.00863434   -0.01425789    0.01356975
C    1.75998476   -1.26832971   -0.00720440    0.02333236   -0.00858948   -0.01204224
H    0.18188684    2.62487313   -0.21460673    0.01235287    0.00237583   -0.00494204
H    0.18293950   -2.62174175   -0.21673067    0.00491471    0.00723291   -0.00536066
H    2.42324760    2.07855021   -0.07746280    0.01443268    0.00128347   -0.00396656
H    2.39880090   -2.14756159    0.10965773   -0.00376344   -0.00588624    0.00936924
C    2.34443505    0.04196962    0.02902329   -0.02370737    0.02397397    0.00777609
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   15
   -420.53579015
H   -2.67413858    0.47312519   -0.01834668   -0.00260954    0.00825495   -0.00043343
O   -2.06332084    1.24098861   -0.02760505   -0.03183747   -0.01159214   -0.00692462
O   -1.96237860   -1.25148848    0.00447235    0.00035666    0.00833595    0.00364108
C   -0.78691394    0.73375685    0.08204593    0.02368261   -0.00152170    0.02191464
C   -0.82393592   -0.74993929    0.00392586   -0.02127097    0.00359633   -0.01054845
C    0.31083292    1.55666829   -0.03523736   -0.01265936   -0.00641531   -0.00743858
C    0.40166059   -1.57643921   -0.04678017   -0.00192865   -0.01048011    0.00424535
C    1.70771092    1.24180632    0.04238784    0.00754572   -0.01010957    0.01462180
C    1.76186751   -1.27119989   -0.00645933    0.02560242   -0.01112578   -0.01150226
H    0.17728346    2.61887014   -0.21938687    0.01245838   -0.00079806   -0.00454807
H    0.17517108   -2.62080818   -0.20394414    0.00419339    0.00614400   -0.00520841
H    2.41188342    2.08072860   -0.07621214    0.01232728    0.00046122   -0.00391081
H    2.39471646   -2.14964378    0.11138893   -0.00555116   -0.00399537    0.00902797
C    2.34390314    0.03959584    0.02701797   -0.02025749    0.01981773    0.00732801
H    3.43478706    0.13627902   -0.14323326    0.00993869    0.00938176   -0.01020163
   15
   -420.53617782
H   -2.66985762    0.47048006   -0.02447615   -0.00215651    0.00802478   -0.00059093
O   -2.06309452    1.24211038   -0.02537564   -0.03340853   -0.00978146   -0.00699312
O   -1.96233675   -1.25135217    0.00386905   -0.00424347    0.00615534    0.00416914
C   -0.78494113    0.73090622    0.08249494    0.02563152   -0.00495670    0.02281219
C   -0.81974189   -0.74663203    0.00026591   -0.01514193    0.00713348   -0.01188998
C    0.31041101    1.55656883   -0.03798390   -0.01136179   -0.00306527   -0.00880318
C    0.40156536   -1.57363170   -0.04502032   -0.00200801   -0.00724803    0.00430689
C    1.70366935    1.24248287    0.04557766    0.00683998   -0.00509077    0.01549973
C    1.76336380   -1.27390189   -0.00554061    0.02732635   -0.01364028   -0.01077219
H    0.17044078    2.61300982   -0.22334712    0.01229447   -0.00388972   -0.00415615
H    0.16665187   -2.62096693   -0.19021889    0.00320108    0.00411795   -0.00508877
H    2.39831149    2.08283221   -0.07425675    0.00940856   -0.00100516   -0.00375408
H    2.39162795   -2.15100781    0.11149617   -0.00712808   -0.00205096    0.00859484
C    2.34367532    0.03692269    0.02490234   -0.01502159    0.01543887    0.00649668
H    3.42647640    0.14268042   -0.14863646    0.00576324    0.00984673   -0.00982556
   15
   -420.53657465
H   -2.66518055    0.46640196   -0.03049914   -0.00223299    0.00698614   -0.00075440
O   -2.06249009    1.24334229   -0.02306698   -0.03406234   -0.00708662   -0.00699580
O   -1.96224693   -1.25128570    0.00321849   -0.00867956    0.00399959    0.00467517
C   -0.78335494    0.72813057    0.08259919    0.02682260   -0.00841576    0.02357962
C   -0.81531899   -0.74343248   -0.00321443   -0.00894213    0.01054819   -0.01309527
C    0.31016006    1.55651611   -0.04059750   -0.00940245   -0.00003349   -0.01004409
C    0.40150000   -1.57071553   -0.04332545   -0.00167764   -0.00325966    0.00424239
C    1.69952410    1.24323580    0.04853330    0.00634667    0.00040801    0.01625431
C    1.76444784   -1.27639801   -0.00445920    0.02830383   -0.01585611   -0.00991097
H    0.16138826    2.60784184   -0.22655820    0.01183497   -0.00645204   -0.00382052
H    0.15755961   -2.62185779   -0.17557811    0.00200226    0.00146881   -0.00492408
H    2.38305443    2.08512334   -0.07162695    0.00587982   -0.00290977   -0.00348644
H    2.38981690   -2.15199907    0.11005670   -0.00831125   -0.00035063    0.00811450
C    2.34367296    0.03401621    0.02268888   -0.00840913    0.01100709    0.00533200
H    3.41714396    0.14731475   -0.15227475    0.00049085    0.00996159   -0.00916914
   15
   -420.53686483
H   -2.66009553    0.46107598   -0.03638586   -0.00272028    0.00526744   -0.00095099
O   -2.06150002    1.24465392   -0.02067903   -0.03389161   -0.00366937   -0.00691950
O   -1.96205894   -1.25126468    0.00251491   -0.01279482    0.00193664    0.00515209
C   -0.78217343    0.72548210    0.08234712    0.02730255   -0.01182133    0.02420348
C   -0.81076078   -0.74039213   -0.00649697   -0.00284969    0.01373150   -0.01415000
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C    0.40145966   -1.56775052   -0.04169451   -0.00102721    0.00110007    0.00398920
C    1.69528280    1.24398254    0.05124334    0.00584958    0.00593604    0.01690851
C    1.76510499   -1.27865505   -0.00322803    0.02839771   -0.01751461   -0.00895988
H    0.15021108    2.60382206   -0.22907946    0.01098596   -0.00808935   -0.00362784
H    0.14810966   -2.62300927   -0.16005235    0.00067358   -0.00143041   -0.00465416
H    2.36674221    2.08794345   -0.06837174    0.00207802   -0.00500263   -0.00313250
H    2.38949379   -2.15291981    0.10715644   -0.00892081    0.00084331    0.00762574
C    2.34379689    0.03094320    0.02039509   -0.00103540    0.00667988    0.00392479
H    3.40773073    0.15015934   -0.15426536   -0.00534095    0.00980039   -0.00831753
   15
   -420.53700314
H   -2.65451803    0.45480827   -0.04210074   -0.00340173    0.00308511   -0.00119617
O   -2.06012607    1.24600675   -0.01821269   -0.03308864    0.00020589   -0.00673513
O   -1.96172620   -1.25126578    0.00175293   -0.01646717    0.00002251    0.00559056
C   -0.78140392    0.72301219    0.08172929    0.02711094   -0.01507403    0.02467701
C   -0.80615919   -0.73755901   -0.00956575    0.00298644    0.01659311   -0.01504886
C    0.31004228    1.55638094   -0.04535440   -0.00345881    0.00343161   -0.01182249
C    0.40143458   -1.56480213   -0.04012357   -0.00014585    0.00544670    0.00350196
C    1.69095342    1.24464011    0.05369779    0.00502921    0.01097333    0.01750857
C    1.76533394   -1.28064821   -0.00186148    0.02751563   -0.01841412   -0.00794801
H    0.13706238    2.60124064   -0.23094483    0.00972765   -0.00850773   -0.00362470
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C    2.34393649    0.02776900    0.01804207    0.00631897    0.00252659    0.00240651
H    3.39927686    0.15124291   -0.15475972   -0.01102427    0.00940726   -0.00740085
   15
   -420.53708306
H   -2.64832820    0.44798747   -0.04759957   -0.00406242    0.00073465   -0.00149152
O   -2.05837718    1.24735709   -0.01567007   -0.03185376    0.00424214   -0.00643398
O   -1.96120714   -1.25126732    0.00092757   -0.01960887   -0.00170445    0.00598486
C   -0.78104352    0.72076989    0.08073856    0.02628081   -0.01808167    0.02498432
C   -0.80160230   -0.73497630   -0.01240720    0.00844077    0.01904521   -0.01578418
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C    0.40141156   -1.56193562   -0.03860528    0.00085996    0.00942889    0.00277327
C    1.68654874    1.24513300    0.05588751    0.00359307    0.01498226    0.01812253
C    1.76514800   -1.28236400   -0.00037483    0.02567100   -0.01846386   -0.00688175
H    0.12216913    2.60017225   -0.23215401    0.00802540   -0.00765713   -0.00384140
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H    2.33365182    2.09660171   -0.06022680   -0.00483585   -0.00803960   -0.00253311
H    2.39361992   -2.15527471    0.09732323   -0.00803038    0.00106177    0.00667488
C    2.34398173    0.02455635    0.01565261    0.01271377   -0.00142760    0.00094043
H    3.39279308    0.15063475   -0.15392049   -0.01570046    0.00888938   -0.00657277
   15
   -420.53716993
H   -2.64141086    0.44103313   -0.05282916   -0.00448460   -0.00150659   -0.00182883
O   -2.05626717    1.24865944   -0.01305455   -0.03038422    0.00812627   -0.00602713
O   -1.96046606   -1.25124985    0.00003438   -0.02220148   -0.00317601    0.00632524
C   -0.78107976    0.71880055    0.07937028    0.02485212   -0.02074620    0.02512160
C   -0.79717245   -0.73268097   -0.01501020    0.01342416    0.02102114   -0.01635205
C    0.31012134    1.55606218   -0.04940211    0.00491016    0.00228208   -0.01243832
C    0.40137553   -1.55921087   -0.03712868    0.00187743    0.01275930    0.00182808
C    1.68209081    1.24540115    0.05780320    0.00128931    0.01754251    0.01876544
C    1.76457500   -1.28380161    0.00121577    0.02296725   -0.01770184   -0.00574307
H    0.10583649    2.60046549   -0.23266945    0.00591990   -0.00567589   -0.00422216
H    0.12000345   -2.62305686   -0.10878723   -0.00314539   -0.00797096   -0.00293531
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H    2.39790922   -2.15674784    0.09056184   -0.00653894    0.00008436    0.00619709
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H    3.38910943    0.14842688   -0.15189475   -0.01854705    0.00835229   -0.00596927
   15
   -420.53732415
H   -2.63369216    0.43434519   -0.05772921   -0.00450230   -0.00340656   -0.00218220
O   -2.05381260    1.24987003   -0.01037078   -0.02880576    0.01156885   -0.00552023
O   -1.95947371   -1.25119658   -0.00093050   -0.02417622   -0.00441013    0.00660433
C   -0.78149108    0.71714436    0.07762238    0.02286438   -0.02298192    0.02508532
C   -0.79294493   -0.73070283   -0.01736616    0.01786679    0.02246749   -0.01675595
C    0.31008233    1.55584413   -0.05114556    0.00970017    0.00035093   -0.01236850
C    0.40131110   -1.55667821   -0.03567959    0.00284015    0.01529987    0.00071330
C    1.67761449    1.24540607    0.05943511   -0.00193582    0.01842520    0.01944927
C    1.76365555   -1.28497226    0.00289304    0.01961364   -0.01632999   -0.00450758
H    0.08844303    2.60176900   -0.23242305    0.00347188   -0.00292154   -0.00471416
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H    2.30386525    2.11079950   -0.05022267   -0.00874591   -0.00711045   -0.00240556
H    2.40337012   -2.15822663    0.08268702   -0.00455140   -0.00144572    0.00565019
C    2.34343425    0.01825232    0.01084933    0.01933463   -0.00880721   -0.00129550
H    3.38872963    0.14471442   -0.14878943   -0.01897550    0.00789077   -0.00568375
   15
   -420.53754968
H   -2.62517031    0.42826376   -0.06223638   -0.00401338   -0.00482372   -0.00252747
O   -2.05103132    1.25094996   -0.00762442   -0.02718380    0.01438212   -0.00494936
O   -1.95820765   -1.25109354   -0.00197024   -0.02554349   -0.00537250    0.00681875
C   -0.78224747    0.71583502    0.07549541    0.02034163   -0.02470154    0.02487158
C   -0.78898684   -0.72906373   -0.01946896    0.02171675    0.02334782   -0.01699615
C    0.30989652    1.55562126   -0.05270220    0.01459040   -0.00199079   -0.01214245
C    0.40120389   -1.55437578   -0.03424116    0.00364065    0.01690526   -0.00053419
C    1.67316845    1.24513444    0.06077298   -0.00599759    0.01762923    0.02013217
C    1.76244007   -1.28589647    0.00463832    0.01586462   -0.01457582   -0.00316261
H    0.07042731    2.60359338   -0.23132765    0.00079931    0.00016028   -0.00521676
H    0.10367602   -2.61667291   -0.07180351   -0.00472768   -0.00823791   -0.00112230
H    2.29118024    2.11988776   -0.04456806   -0.00923748   -0.00480585   -0.00253113
H    2.40964582   -2.15944149    0.07379601   -0.00222922   -0.00322679    0.00503522
C    2.34274238    0.01527250    0.00846917    0.01875929   -0.01221451   -0.00196164
H    3.39172890    0.13958054   -0.14465643   -0.01685360    0.00752265   -0.00569883
   15
   -420.53776257
H   -2.61593332    0.42304244   -0.06628900   -0.00300164   -0.00567586   -0.00283951
O   -2.04794171    1.25186741   -0.00482194   -0.02552009    0.01645049   -0.00433301
O   -1.95665240   -1.25092984   -0.00308727   -0.02629813   -0.00605011    0.00696365
C   -0.78331080    0.71489844    0.07299259    0.01732282   -0.02583305    0.02448337
C   -0.78535633   -0.72777692   -0.02131499    0.02493869    0.02363282   -0.01707734
C    0.30949034    1.55542845   -0.05407531    0.01929822   -0.00431405   -0.01185136
C    0.40104193   -1.55232777   -0.03279456    0.00421913    0.01754980   -0.00185093
C    1.66881375    1.24459800    0.06180651   -0.01060418    0.01541403    0.02076804
C    1.76098485   -1.28660040    0.00643127    0.01201990   -0.01274133   -0.00168956
H    0.05226802    2.60539081   -0.22929295   -0.00193468    0.00310560   -0.00566899
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H    2.28014627    2.12982711   -0.03845677   -0.00891241   -0.00153232   -0.00272958
H    2.41632133   -2.16007556    0.06400011    0.00018971   -0.00499150    0.00430606
C    2.34176975    0.01247706    0.00611838    0.01585177   -0.01535003   -0.00240102
H    3.39773020    0.13309209   -0.13949448   -0.01252620    0.00720298   -0.00592372
   15
   -420.53789059
H   -2.60616255    0.41883385   -0.06983107   -0.00150883   -0.00594171   -0.00309553
O   -2.04456270    1.25259902   -0.00197034   -0.02376983    0.01769799   -0.00368346
O   -1.95479939   -1.25069775   -0.00428322   -0.02644739   -0.00644707    0.00703383
C   -0.78463549    0.71435164    0.07011982    0.01385100   -0.02630488    0.02391878
C   -0.78210210   -0.72684670   -0.02290299    0.02751046    0.02332533   -0.01700400
C    0.30879304    1.55530036   -0.05526919    0.02351126   -0.00624414   -0.01156186
C    0.40081649   -1.55054408   -0.03131997    0.00453904    0.01734197   -0.00317104
C    1.66461961    1.24382969    0.06252617   -0.01537384    0.01223492    0.02128553
C    1.75934769   -1.28711145    0.00824960    0.00832865   -0.01110005   -0.00008945
H    0.03445680    2.60663722   -0.22623911   -0.00459071    0.00552145   -0.00599844
H    0.09068487   -2.60459030   -0.03401892   -0.00517093   -0.00463149    0.00081078
H    2.27070897    2.14003366   -0.03185400   -0.00804699    0.00231502   -0.00293234
H    2.42296467   -2.15981509    0.05343083    0.00246986   -0.00647544    0.00345270
C    2.34055939    0.00991322    0.00380379    0.01134568   -0.01810124   -0.00275106
H    3.40596519    0.12530753   -0.13326514   -0.00671926    0.00683948   -0.00622255
   15
   -420.53787614
H   -2.59612631    0.41568770   -0.07281558    0.00040103   -0.00571385   -0.00331319
O   -2.04091422    1.25313057    0.00092303   -0.02184310    0.01816058   -0.00301576
O   -1.95264692   -1.25039279   -0.00555888   -0.02599848   -0.00654008    0.00702859
C   -0.78616917    0.71420175    0.06688559    0.01000508   -0.02608442    0.02319031
C   -0.77926300   -0.72626845   -0.02423409    0.02940036    0.02244074   -0.01678260
C    0.30774118    1.55526594   -0.05628821    0.02693500   -0.00752916   -0.01132780
C    0.40052272   -1.54902169   -0.02979748    0.00461631    0.01639970   -0.00444431
C    1.66065759    1.24287693    0.06292423   -0.01989017    0.00859825    0.02162090
C    1.75758410   -1.28745417    0.01006915    0.00503197   -0.00987677    0.00162420
H    0.01746733    2.60690308   -0.22210954   -0.00700756    0.00707527   -0.00612304
H    0.08557308   -2.59711257   -0.01525833   -0.00497845   -0.00170325    0.00169818
H    2.26271697    2.14982179   -0.02472408   -0.00692926    0.00626461   -0.00307799
H    2.42916796   -2.15839671    0.04224140    0.00442271   -0.00744820    0.00249277
C    2.33917834    0.00762244    0.00153073    0.00612597   -0.02035125   -0.00311603
H    3.41540136    0.11629360   -0.12591687   -0.00032235    0.00634407   -0.00644024
   15
   -420.53769458
H   -2.58616608    0.41356420   -0.07520441    0.00257160   -0.00506929   -0.00346438
O   -2.03701823    1.25345679    0.00385061   -0.01962396    0.01787665   -0.00234754
O   -1.95020007   -1.25001393   -0.00691420   -0.02495518   -0.00633714    0.00694777
C   -0.78785375    0.71444536    0.06330092    0.00585434   -0.02513110    0.02230329
C   -0.77686756   -0.72602882   -0.02531161    0.03058598    0.02101268   -0.01641999
C    0.30628333    1.55534434   -0.05713585    0.02929836   -0.00797574   -0.01117606
C    0.40015952   -1.54774674   -0.02820791    0.00445316    0.01500525   -0.00562827
C    1.65699554    1.24179412    0.06299567   -0.02378479    0.00499252    0.02173729
C    1.75574376   -1.28764683    0.01186404    0.00230396   -0.00924443    0.00341129
H    0.00173410    2.60590997   -0.21688026   -0.00907427    0.00760690   -0.00606780
H    0.08135466   -2.58933381    0.00319800   -0.00457996    0.00161474    0.00248627
H    2.25597237    2.15848728   -0.01704233   -0.00582193    0.00986460   -0.00311448
H    2.43458220   -2.15564656    0.03060433    0.00589514   -0.00778179    0.00145060
C    2.33770449    0.00563869   -0.00069505    0.00103440   -0.02203959   -0.00362635
H    3.42489942    0.10614107   -0.11741185    0.00582693    0.00562171   -0.00647960
   15
   -420.53744416
H   -2.57667067    0.41234996   -0.07697030    0.00484745   -0.00416753   -0.00356461
O   -2.03290001    1.25358082    0.00680484   -0.01699543    0.01696555   -0.00168908
O   -1.94747069   -1.24956347   -0.00834827   -0.02331479   -0.00583816    0.00679404
C   -0.78962660    0.71506805    0.05937922    0.00150179   -0.02343605    0.02127002
C   -0.77493367   -0.72610632   -0.02614102    0.03104115    0.01909819   -0.01592202
C    0.30438404    1.55554223   -0.05781440    0.03038908   -0.00752937   -0.01111365
C    0.39972922   -1.54669851   -0.02653338    0.00413113    0.01347062   -0.00670190
C    1.65369199    1.24063533    0.06273873   -0.02676933    0.00180750    0.02161556
C    1.75386774   -1.28769891    0.01360730    0.00027634   -0.00927335    0.00523307
H   -0.01237239    2.60356336   -0.21056118   -0.01069057    0.00703445   -0.00582178
H    0.07795945   -2.58184661    0.02120848   -0.00407266    0.00497786    0.00315936
H    2.25027877    2.16538717   -0.00880179   -0.00492995    0.01274922   -0.00302457
H    2.43894353   -2.15150613    0.01870679    0.00680146   -0.00738315    0.00036036
C    2.33621403    0.00398748   -0.00286582   -0.00325684   -0.02312030   -0.00430984
H    3.43336185    0.09498149   -0.10774361    0.01105766    0.00464537   -0.00627819
   15
   -420.53725887
H   -2.56804635    0.41188423   -0.07809507    0.00701088   -0.00314817   -0.00362878
O   -2.02858949    1.25351284    0.00977822   -0.01384096    0.01559020   -0.00103014
O   -1.94447739   -1.24904702   -0.00985935   -0.02107971   -0.00506742    0.00656853
C   -0.79142206    0.71604420    0.05513608   -0.00292973   -0.02101685    0.02010563
C   -0.77346823   -0.72647205   -0.02672986    0.03075452    0.01675932   -0.01529567
C    0.30202701    1.55585289   -0.05832480    0.03006193   -0.00621702   -0.01113437
C    0.39923656   -1.54585424   -0.02475764    0.00374573    0.01216965   -0.00766756
C    1.65079183    1.23944835    0.06215525   -0.02865601   -0.00066347    0.02125762
C    1.75198664   -1.28760995    0.01527146   -0.00099291   -0.00998315    0.00703876
H   -0.02456177    2.59996607   -0.20319633   -0.01179465    0.00537575   -0.00540758
H    0.07529789   -2.57524984    0.03865152   -0.00358115    0.00796898    0.00373716
H    2.24547737    2.17000577   -0.00001858   -0.00438118    0.01466021   -0.00279684
H    2.44208942   -2.14604724    0.00674447    0.00708308   -0.00625669   -0.00073502
C    2.33477132    0.00268516   -0.00497121   -0.00629927   -0.02360023   -0.00517131
H    3.43985356    0.08298999   -0.09694852    0.01490548    0.00342843   -0.00582642
   15
   -420.53721688
H   -2.56067991    0.41198645   -0.07856679    0.00887819   -0.00221209   -0.00367822
O   -2.02412254    1.25326827    0.01276329   -0.01005908    0.01392470   -0.00037439
O   -1.94124551   -1.24847335   -0.01144488   -0.01824907   -0.00402513    0.00627637
C   -0.79317328    0.71733728    0.05058909   -0.00730530   -0.01791443    0.01882867
C   -0.77246686   -0.72709076   -0.02708758    0.02970852    0.01407590   -0.01454854
C    0.29921731    1.55625665   -0.05866682    0.02823830   -0.00416720   -0.01120082
C    0.39868718   -1.54519470   -0.02286608    0.00341297    0.01145594   -0.00854649
C    1.64832351    1.23827032    0.06125062   -0.02935713   -0.00223679    0.02068263
C    1.75011958   -1.28736931    0.01682928   -0.00148363   -0.01131393    0.00878091
H   -0.03463510    2.59541512   -0.19485982   -0.01237802    0.00274395   -0.00486306
H    0.07328257   -2.57007663    0.05542262   -0.00320691    0.01020838    0.00424708
H    2.24147105    2.17200108    0.00926665   -0.00426625    0.01544408   -0.00245395
H    2.44396839   -2.13947141   -0.00508606    0.00676778   -0.00447025   -0.00179256
C    2.33342200    0.00173897   -0.00699824   -0.00782514   -0.02352883   -0.00618290
H    3.44368547    0.07038443   -0.08510767    0.01711525    0.00198832   -0.00515775
   15
   -420.53733807
H   -2.55490489    0.41249051   -0.07837617    0.01027184   -0.00152552   -0.00373623
O   -2.01954212    1.25286587    0.01575261   -0.00558781    0.01214332    0.00028038
O   -1.93780716   -1.24785424   -0.01310155   -0.01483522   -0.00273413    0.00592323
C   -0.79481430    0.71890048    0.04575753   -0.01147512   -0.01419238    0.01745826
C   -0.77191375   -0.72792197   -0.02722547    0.02789895    0.01113764   -0.01368821
C    0.29598239    1.55672274   -0.05883951    0.02497042   -0.00158917   -0.01125519
C    0.39808601   -1.54470940   -0.02084535    0.00322188    0.01158547   -0.00937328
C    1.64629762    1.23712492    0.06003350   -0.02886813   -0.00283651    0.01991766
C    1.74827407   -1.28695703    0.01825446   -0.00125777   -0.01311968    0.01041467
H   -0.04248836    2.59038067   -0.18564866   -0.01242346   -0.00061098   -0.00424218
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H    2.23823917    2.17123248    0.01899239   -0.00461221    0.01506391   -0.00202593
H    2.44463705   -2.13209841   -0.01659497    0.00590182   -0.00215039   -0.00277743
C    2.33218902    0.00114793   -0.00893166   -0.00772102   -0.02296903   -0.00729523
H    3.44446153    0.05742304   -0.07234061    0.01755931    0.00039521   -0.00432695
   15
   -420.53763190
H   -2.55097015    0.41327473   -0.07751256    0.01105178   -0.00121596   -0.00381817
O   -2.01489896    1.25232567    0.01873875   -0.00042054    0.01039659    0.00093505
O   -1.93420104   -1.24720433   -0.01482535   -0.01086450   -0.00121416    0.00551461
C   -0.79628226    0.72067763    0.04066209   -0.01528189   -0.00995271    0.01601528
C   -0.77178154   -0.72892139   -0.02715652    0.02533770    0.00804262   -0.01272392
C    0.29237157    1.55721262   -0.05884207    0.02035231    0.00116245   -0.01126183
C    0.39743590   -1.54440040   -0.01868293    0.00321391    0.01265798   -0.01018009
C    1.64470688    1.23602129    0.05851542   -0.02727757   -0.00248640    0.01899976
C    1.74644684   -1.28634604    0.01952236   -0.00042917   -0.01519462    0.01190624
H   -0.04811154    2.58546222   -0.17567408   -0.01204153   -0.00437607   -0.00359903
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H    2.23584152    2.16776922    0.02908211   -0.00535103    0.01352235   -0.00154710
H    2.44424897   -2.12434294   -0.02760539    0.00464092    0.00050939   -0.00366106
C    2.33107084    0.00090363   -0.01075477   -0.00600978   -0.02197827   -0.00843226
H    3.44210246    0.04439153   -0.05879612    0.01621948   -0.00128301   -0.00339662
   15
   -420.53801250
H   -2.54901517    0.41428437   -0.07596098    0.01114614   -0.00134738   -0.00393326
O   -2.01025161    1.25166742    0.02171430    0.00538431    0.00878568    0.00158321
O   -1.93047213   -1.24654083   -0.01661166   -0.00638337    0.00051519    0.00505924
C   -0.79751978    0.72260477    0.03532459   -0.01857949   -0.00531413    0.01450850
C   -0.77203158   -0.73004233   -0.02689531    0.02206507    0.00488405   -0.01166081
C    0.28845440    1.55768524   -0.05867450    0.01459984    0.00364818   -0.01115480
C    0.39673704   -1.54428385   -0.01636661    0.00336780    0.01460633   -0.01097851
C    1.64352740    1.23495421    0.05671021   -0.02472251   -0.00128340    0.01796653
C    1.74462558   -1.28550537    0.02061043    0.00081517   -0.01724850    0.01323562
H   -0.05157168    2.58133104   -0.16505113   -0.01133728   -0.00809619   -0.00299366
H    0.07064230   -2.56613133    0.10078747   -0.00343530    0.01027194    0.00581939
H    2.23441224    2.16188624    0.03945023   -0.00645241    0.01096823   -0.00105911
H    2.44302929   -2.11667946   -0.03795833    0.00311961    0.00321063   -0.00445135
C    2.33004168    0.00099120   -0.01245046   -0.00279544   -0.02065431   -0.00952112
H    3.43684792    0.03159074   -0.04464085    0.01320341   -0.00297710   -0.00242910
   15
   -420.53837521
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O   -1.92667125   -1.24588331   -0.01845532   -0.00145536    0.00241542    0.00456246
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C   -0.77261444   -0.73123718   -0.02645790    0.01814629    0.00176683   -0.01051330
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   15
   -420.53862197
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O   -1.92285419   -1.24525329   -0.02035071    0.00382142    0.00444949    0.00403538
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C    0.28006065    1.55844224   -0.05783805    0.00084319    0.00585493   -0.01042679
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   15
   -420.53870115
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O   -1.91908067   -1.24467383   -0.02229186    0.00932427    0.00657211    0.00348524
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C    0.27579125    1.55869432   -0.05718023   -0.00653250    0.00472610   -0.00978282
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C    2.32691956    0.00302856   -0.01661944    0.01234462   -0.01548454   -0.01179744
H    3.41031180   -0.00245082   -0.00019201   -0.00260572   -0.00742304   -0.00001737
   15
   -420.53867864
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O   -1.91541299   -1.24416896   -0.02427252    0.01489963    0.00872741    0.00291895
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C    1.64201903    1.23058522    0.04694582   -0.01041472    0.00593740    0.01322564
C    1.73700760   -1.27933764    0.02279876    0.00544174   -0.01908983    0.01702442
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   15
   -420.53861869
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O   -1.91191423   -1.24376304   -0.02628629    0.02037295    0.01084412    0.00234921
C   -0.79887726    0.73195429    0.00582094   -0.02392816    0.01854690    0.00654165
C   -0.77698096   -0.73585304   -0.02330865   -0.00150128   -0.00845657   -0.00531454
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C    1.64217326    1.22933044    0.04395843   -0.00752442    0.00615565    0.01189624
C    1.73493208   -1.27705917    0.02273335    0.00564409   -0.01690654    0.01763910
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C    2.32405206    0.00560114   -0.01852794    0.02042535   -0.01152854   -0.01216893
H    3.39316948   -0.01893346    0.02971182   -0.01234742   -0.00937462    0.00090718
   15
   -420.53861152
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O   -1.90864630   -1.24348001   -0.02832671    0.02555702    0.01284366    0.00178128
C   -0.79806909    0.73325967   -0.00047430   -0.02257526    0.02226247    0.00489957
C   -0.77820973   -0.73677277   -0.02226970   -0.00651793   -0.00999269   -0.00393475
C    0.26401498    1.55923012   -0.05436870   -0.02770135   -0.00811318   -0.00727440
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C    1.64244228    1.22798429    0.04079130   -0.00548755    0.00498685    0.01045618
C    1.73277176   -1.27452636    0.02240142    0.00540685   -0.01367265    0.01810404
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H    2.25760991    2.10705977    0.10315820   -0.00957264   -0.00650542    0.00099181
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C    2.32218357    0.00716397   -0.01920710    0.02151301   -0.00940340   -0.01213009
H    3.38751256   -0.02472550    0.04445666   -0.01464597   -0.01002635    0.00129306
   15
   -420.53867069
H   -2.57910034    0.43635378   -0.04409551   -0.00015967   -0.00638361   -0.00401810
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O   -1.90566783   -1.24334250   -0.03038736    0.03025098    0.01463756    0.00122290
C   -0.79692038    0.73422933   -0.00684360   -0.02055426    0.02523294    0.00324602
C   -0.77934039   -0.73754209   -0.02117126   -0.01115169   -0.01096025   -0.00255327
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C    1.64279542    1.22656454    0.03746628   -0.00439652    0.00235970    0.00886159
C    1.73053012   -1.27178785    0.02179599    0.00484843   -0.00962431    0.01838121
H   -0.02644883    2.60863210   -0.07922857   -0.00713674   -0.00250542   -0.00124421
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H    2.26775287    2.09974472    0.11346382   -0.00756012   -0.00638809    0.00139605
H    2.42909754   -2.09592374   -0.08213811    0.00154410    0.00516477   -0.00806222
C    2.31999295    0.00886883   -0.01970286    0.02002805   -0.00715774   -0.01207449
H    3.38445800   -0.02871469    0.05896768   -0.01460432   -0.01049850    0.00175591
   15
   -420.53880822
H   -2.58598913    0.44336138   -0.03649158   -0.00143130   -0.00584668   -0.00365400
O   -1.98127201    1.24410904    0.04437507    0.04762108   -0.00359761    0.00428204
O   -1.90303191   -1.24337083   -0.03246189    0.03427550    0.01616380    0.00067885
C   -0.79546151    0.73481856   -0.01326197   -0.01801036    0.02731017    0.00157780
C   -0.78030314   -0.73814645   -0.02003419   -0.01519257   -0.01129597   -0.00118598
C    0.25807464    1.56008397   -0.05192147   -0.03950478   -0.02003901   -0.00578708
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C    1.64321609    1.22511066    0.03400748   -0.00417606   -0.00152815    0.00710327
C    1.72821541   -1.26890446    0.02091293    0.00413324   -0.00507840    0.01842400
H   -0.01709136    2.61876496   -0.06583090   -0.00654237    0.00201103   -0.00095167
H    0.09651861   -2.60226267    0.16831320   -0.00373533   -0.00422260    0.00835622
H    2.27924520    2.09356396    0.12351602   -0.00475326   -0.00520166    0.00193396
H    2.42684495   -2.09827689   -0.08329608    0.00278460    0.00275813   -0.00836206
C    2.31750247    0.01068176   -0.02001597    0.01609088   -0.00479685   -0.01208893
H    3.38399970   -0.03081618    0.07316045   -0.01230358   -0.01079660    0.00237319
   15
   -420.53894744
H   -2.59262770    0.45141210   -0.02823134   -0.00216974   -0.00467882   -0.00318338
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O   -1.90078403   -1.24358219   -0.03454413    0.03746190    0.01732433    0.00014845
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C   -0.78103716   -0.73858087   -0.01887916   -0.01843573   -0.01094326    0.00015747
C    0.25595689    1.56091985   -0.05056117   -0.04432993   -0.02505141   -0.00521092
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C    1.64370070    1.22368096    0.03044145   -0.00461201   -0.00628388    0.00520007
C    1.72583821   -1.26594448    0.01975167    0.00342325   -0.00036657    0.01818766
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H    2.29158556    2.08830944    0.13321822   -0.00142235   -0.00331164    0.00260484
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C    2.31477101    0.01256713   -0.02014615    0.01026334   -0.00235862   -0.01220741
H    3.38573113   -0.03097703    0.08692333   -0.00824269   -0.01089951    0.00317384
   15
   -420.53902211
H   -2.59888409    0.46029645   -0.01939909   -0.00232550   -0.00291536   -0.00263283
O   -1.97848223    1.24222493    0.04958991    0.04756643   -0.00874427    0.00410317
O   -1.89896022   -1.24398967   -0.03662807    0.03968458    0.01805648   -0.00036587
C   -0.79177182    0.73474610   -0.02614464   -0.01202418    0.02831341   -0.00183359
C   -0.78149358   -0.73885067   -0.01772648   -0.02073180   -0.00988544    0.00146807
C    0.25450823    1.56213284   -0.04912196   -0.04822551   -0.02868216   -0.00473220
C    0.38693969   -1.56059597    0.01720048   -0.00249956    0.01716627   -0.01050406
C    1.64425545    1.22234681    0.02679687   -0.00540393   -0.01143583    0.00322243
C    1.72340917   -1.26297868    0.01831585    0.00283836    0.00416224    0.01762663
H    0.00499205    2.63723171   -0.03859474   -0.00454732    0.00936774   -0.00010736
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C    2.31188562    0.01448818   -0.02009164    0.00337807    0.00007590   -0.01240440
H    3.38893245   -0.02917890    0.10011271   -0.00318247   -0.01077799    0.00413410
   15
   -420.53904430
H   -2.60472957    0.46969828   -0.01009354   -0.00194642   -0.00064359   -0.00203261
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O   -1.89758560   -1.24460154   -0.03870787    0.04086314    0.01831592   -0.00086724
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C   -0.78163780   -0.73897185   -0.01659594   -0.02197612   -0.00813046    0.00273750
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C    0.38586649   -1.56412011    0.02159321   -0.00419816    0.01251265   -0.00906640
C    1.64489196    1.22118545    0.02310367   -0.00626756   -0.01648148    0.00121809
C    1.72093702   -1.26007527    0.01661396    0.00245572    0.00823926    0.01672903
H    0.01735877    2.64425258   -0.02490733   -0.00312891    0.01148864    0.00038814
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H    2.31639828    2.07919573    0.15107533    0.00542526    0.00085785    0.00417154
H    2.41635090   -2.10659517   -0.07766864    0.00504458   -0.00376470   -0.00829533
C    2.30894929    0.01640822   -0.01984948   -0.00366280    0.00242401   -0.01263235
H    3.39270645   -0.02544373    0.11255844    0.00201916   -0.01041018    0.00515110
   15
   -420.53903194
H   -2.61023119    0.47921163   -0.00042219   -0.00115152    0.00195430   -0.00141834
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O   -1.89667352   -1.24542072   -0.04077784    0.04096590    0.01808711   -0.00135888
C   -0.78735505    0.73298439   -0.03891567   -0.00599959    0.02473660   -0.00540349
C   -0.78145111   -0.73897092   -0.01550675   -0.02211006   -0.00571697    0.00396341
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C    0.38485661   -1.56783304    0.02612282   -0.00577414    0.00752671   -0.00746414
C    1.64562301    1.22027261    0.01939198   -0.00694886   -0.02098814   -0.00071924
C    1.71842744   -1.25729559    0.01465953    0.00230905    0.01163996    0.01549757
H    0.03028640    2.64922546   -0.01128969   -0.00148780    0.01228260    0.00087990
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H    2.32764811    2.07459770    0.15895007    0.00828853    0.00235701    0.00493700
H    2.41115839   -2.10848919   -0.07277306    0.00484685   -0.00500027   -0.00788432
C    2.30606761    0.01829183   -0.01941641   -0.01010311    0.00459178   -0.01278670
H    3.39612315   -0.01983930    0.12407759    0.00673501   -0.00974137    0.00613913
   15
   -420.53906383
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   15
   -420.53918270
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   15
   -420.53941959
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   15
   -420.53968068
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   15
   -420.53992087
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   15
   -420.53998297
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   15
   -420.53976904
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   15
   -420.53928076
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   15
   -420.53856692
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   15
   -420.53778629
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   15
   -420.53702239
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   15
   -420.53637138
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H    2.35815384   -2.09001185    0.05462107   -0.00707723    0.00022977    0.00292532
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   15
   -420.53585402
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   15
   -420.53540207
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O   -1.91797062   -1.27039257   -0.06567070   -0.00591726   -0.00562552   -0.00700401
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   15
   -420.53496746
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O   -1.92025303   -1.27229918   -0.06696584   -0.00776687   -0.00643805   -0.00708778
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C    0.32400093    1.60994970   -0.02143289    0.03419775    0.00976989    0.00368964
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   15
   -420.53451641
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O   -1.92244785   -1.27413298   -0.06818065   -0.00905891   -0.00702234   -0.00710419
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C    1.66578751    1.25182715   -0.02770145   -0.01998112   -0.01501602   -0.01309283
C    1.67906793   -1.24259131   -0.02651400   -0.02670039    0.01609264   -0.02132341
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   15
   -420.53414576
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O   -1.92454042   -1.27588738   -0.06931493   -0.00978661   -0.00735840   -0.00705572
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C    0.33351442    1.61278296   -0.01891718    0.04660817    0.00699575    0.00350118
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C    1.66785736    1.25583243   -0.02938540   -0.02363451   -0.01599671   -0.01360068
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C    2.28154187    0.03191690    0.00685850   -0.01037353   -0.00527207    0.00464185
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   15
   -420.53393127
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C   -0.76797702   -0.76831958   -0.01967252    0.02921939    0.01006091    0.01309605
C    0.33725881    1.61403237   -0.01773924    0.05063820    0.00724891    0.00361637
C    0.37724973   -1.62555406    0.10134330    0.00686053   -0.01611385    0.02183274
C    1.67028317    1.26007864   -0.03086407   -0.02612082   -0.01623313   -0.01383325
C    1.67768466   -1.24475926   -0.02886238   -0.02780713    0.01376226   -0.02454216
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C    2.28041074    0.03222587    0.00845824   -0.01434197   -0.00687049    0.00536535
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   15
   -420.53391637
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O   -1.92839236   -1.27914500   -0.07134482   -0.00953094   -0.00736915   -0.00677339
C   -0.75090620    0.72212013   -0.10999470    0.00529600   -0.02278829   -0.03459851
C   -0.76992919   -0.77270296   -0.02173719    0.02767203    0.00566859    0.01252782
C    0.34023960    1.61517084   -0.01661616    0.05297238    0.00862743    0.00388194
C    0.37638433   -1.62762796    0.10355138    0.00612765   -0.01800542    0.02257364
C    1.67310221    1.26456918   -0.03213396   -0.02719921   -0.01555272   -0.01375733
C    1.67762162   -1.24616556   -0.02949172   -0.02673823    0.01144422   -0.02565124
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C    2.27949495    0.03263827    0.00997663   -0.01709033   -0.00811701    0.00623976
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   15
   -420.53422342
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O   -1.93015460   -1.28064810   -0.07224363   -0.00857694   -0.00708508   -0.00654735
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C   -0.77229883   -0.77717181   -0.02399110    0.02536195    0.00108698    0.01182917
C    0.34242161    1.61617765   -0.01555194    0.05352603    0.01099481    0.00428023
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C    1.67633060    1.26929368   -0.03319621   -0.02671561   -0.01386014   -0.01339804
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   15
   -420.53479055
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O   -2.01147956    1.25316538    0.08836846   -0.03221155    0.00944485    0.01241132
O   -1.93182002   -1.28207096   -0.07306822   -0.00711730   -0.00664539   -0.00626984
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C   -0.77505107   -0.78165701   -0.02642371    0.02233356   -0.00356107    0.01099773
C    0.34379650    1.61701735   -0.01455254    0.05230169    0.01407049    0.00477042
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C    1.67996102    1.27422648   -0.03405619   -0.02466293   -0.01111648   -0.01275394
C    1.67867286   -1.24944999   -0.02957637   -0.02161171    0.00494131   -0.02686239
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   15
   -420.53550982
H   -2.57276304    0.43952113    0.15086209    0.00335089    0.00135751    0.00378794
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O   -1.93340513   -1.28341854   -0.07382173   -0.00520646   -0.00607660   -0.00594519
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C   -0.77814018   -0.78608839   -0.02902243    0.01865550   -0.00817513    0.01003334
C    0.34438259    1.61764396   -0.01362532    0.04942866    0.01741776    0.00528040
C    0.37328270   -1.63218910    0.10809706    0.00366934   -0.01694864    0.02376390
C    1.68396261    1.27932631   -0.03472313   -0.02116807   -0.00741583   -0.01198209
C    1.67971002   -1.25123016   -0.02901333   -0.01786550    0.00107860   -0.02698419
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H    2.40334150   -2.05284416    0.11848109   -0.00013166    0.00235326    0.00761460
C    2.27834372    0.03465300    0.01390227   -0.01659391   -0.00945157    0.00949841
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   15
   -420.53626699
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C    0.34422302    1.61800769   -0.01277784    0.04515308    0.02041661    0.00570530
C    0.37212154   -1.63317379    0.10889946    0.00291581   -0.01424882    0.02380195
C    1.68828275    1.28453725   -0.03520909   -0.01643836   -0.00286143   -0.01102828
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H    2.40741331   -2.04709314    0.11744690   -0.00117127    0.00470146    0.00712488
C    2.27848383    0.03560630    0.01494640   -0.01369312   -0.00919047    0.01063088
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   15
   -420.53686572
H   -2.55629899    0.42073255    0.15069548    0.00296557   -0.00348728    0.00404206
O   -2.00988801    1.25381864    0.08874327   -0.02804524    0.01628596    0.01095150
O   -1.93642490   -1.28591468   -0.07513075   -0.00038385   -0.00469373   -0.00516173
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C   -0.78509889   -0.79451351   -0.03465803    0.00978453   -0.01685945    0.00773145
C    0.34338207    1.61806393   -0.01201640    0.03978885    0.02242232    0.00594201
C    0.37091619   -1.63394388    0.10934230    0.00219625   -0.01082013    0.02361393
C    1.69285031    1.28979074   -0.03552839   -0.01080459    0.00228679   -0.01000086
C    1.68252915   -1.25478026   -0.02666656   -0.00919108   -0.00653133   -0.02645703
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H    2.33837838    2.16416854    0.06185397   -0.00441916    0.00483160    0.00209022
H    2.41169444   -2.04218403    0.11513120   -0.00207390    0.00677147    0.00655852
C    2.27882977    0.03669823    0.01582988   -0.00981348   -0.00865793    0.01168466
H    3.37159782    0.07682759    0.07830205    0.00427051    0.00604467    0.00183384
   15
   -420.53733890
H   -2.54889040    0.41205469    0.14953283    0.00275814   -0.00583793    0.00413702
O   -2.00869448    1.25370242    0.08861142   -0.02579686    0.01827312    0.01030460
O   -1.93791406   -1.28707888   -0.07569514    0.00230439   -0.00394390   -0.00471283
C   -0.74577135    0.74374424   -0.09860108    0.00867446    0.00607488   -0.02895349
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   15
   -420.53760906
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   15
   -420.53778896
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   15
   -420.53792092
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   15
   -420.53801396
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   15
   -420.53808313
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   15
   -420.53805135
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   15
   -420.53786735
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   15
   -420.53751238
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   15
   -420.53710820
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   15
   -420.53673942
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   15
   -420.53652598
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O   -1.96087292   -1.29803609   -0.07974626    0.00765708   -0.00517218    0.00171196
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C    1.74002202    1.33544612   -0.03162135    0.02113932    0.01589529    0.00164338
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   15
   -420.53656030
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O   -1.96372153   -1.29884016   -0.08009306    0.00480286   -0.00660885    0.00230474
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C   -0.82187444   -0.81142803   -0.07420858   -0.02069945   -0.02340614   -0.01422129
C    0.31198519    1.60847917   -0.00709071   -0.03138680   -0.02295936   -0.00040519
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   15
   -420.53680483
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   15
   -420.53721126
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   15
   -420.53763164
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O   -1.97244666   -1.30073042   -0.08131589   -0.00521783   -0.01143375    0.00395552
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   15
   -420.53793577
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   15
   -420.53808638
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   15
   -420.53813918
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   15
   -420.53810602
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   15
   -420.53814296
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   15
   -420.53826465
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   15
   -420.53842519
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O   -1.98903272   -1.29990268   -0.08596932   -0.02473567   -0.01853326    0.00652666
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C    2.30925764    0.05912084   -0.01740496    0.01620633    0.00485439    0.00122191
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   15
   -420.53855434
H   -2.62014425    0.48089153   -0.01702022   -0.00697615    0.00213434   -0.00158616
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O   -1.99048712   -1.29900124   -0.08690483   -0.02604396   -0.01855726    0.00666280
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C    2.31088126    0.05874186   -0.02045533    0.01436337    0.00364158    0.00038090
H    3.38042168    0.03609782   -0.14240033   -0.00837900    0.00141721   -0.00205644
   15
   -420.53856735
H   -2.62195822    0.48878416   -0.02547831   -0.00510428    0.00476396   -0.00161482
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O   -1.99164655   -1.29788956   -0.08791587   -0.02683765   -0.01830626    0.00673463
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C    0.33091773    1.61806932   -0.00314648    0.00230512    0.01610255   -0.00107803
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   15
   -420.53838149
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   15
   -420.53805379
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   15
   -420.53772912
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   15
   -420.53753233
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   15
   -420.53755802
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   15
   -420.53785067
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C    1.71390458    1.30712684   -0.03481581   -0.00996612   -0.00184118    0.01115464
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   15
   -420.53833527
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O   -1.99153412   -1.28485678   -0.09709220   -0.01709147   -0.00917651    0.00578075
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   15
   -420.53890021
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O   -1.99053331   -1.28242314   -0.09868400   -0.01377112   -0.00703029    0.00551987
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   15
   -420.53941440
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O   -1.98937656   -1.27990983   -0.10033841   -0.01015341   -0.00476679    0.00525244
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C    1.70422930    1.29446183   -0.03951647   -0.01313197   -0.00475966    0.01009252
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   15
   -420.53977480
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O   -1.98810482   -1.27734249   -0.10205237   -0.00634006   -0.00243988    0.00497001
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C    2.32419443    0.05513696   -0.05217595    0.00813308   -0.00609255   -0.00876854
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   15
   -420.54000303
H   -2.61418652    0.47884909   -0.09522856   -0.00932805   -0.00187943   -0.00517905
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O   -1.98676121   -1.27474752   -0.10382269   -0.00245264   -0.00009221    0.00467737
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C   -0.82916899   -0.79495473   -0.04783654   -0.00611775    0.00603514   -0.01109397
C    0.34847698    1.59330766    0.00270840    0.03375872    0.04349452   -0.00467957
C    0.35763564   -1.58511931    0.02555856   -0.00191431    0.00469710   -0.00849058
C    1.69874498    1.28635565   -0.04342261   -0.01166315   -0.00392271    0.00875841
C    1.68181314   -1.19455707    0.10958054   -0.00734522    0.00734836    0.01496143
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C    2.32529503    0.05523469   -0.05456985    0.01239912   -0.00567355   -0.00976587
H    3.39786103    0.12794160   -0.15517533   -0.00578218    0.01051522   -0.00247493
   15
   -420.54014218
H   -2.60805706    0.47302724   -0.09779167   -0.00912774   -0.00289326   -0.00540114
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O   -1.98538974   -1.27215147   -0.10564606    0.00138634    0.00220751    0.00437115
C   -0.72058703    0.65599318    0.08217294    0.02183685   -0.04660737    0.01763007
C   -0.82996364   -0.79776266   -0.04335591   -0.00861963   -0.00026688   -0.00975064
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C    0.35692460   -1.58070802    0.02436296   -0.00405498    0.01044461   -0.00797244
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   15
   -420.54028332
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   15
   -420.54043454
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   15
   -420.54055613
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   15
   -420.54053308
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   15
   -420.54026155
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   15
   -420.53963438
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   15
   -420.53870689
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   15
   -420.53761577
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C   -0.82948825   -0.81244875   -0.00401221   -0.01436010   -0.03916214    0.00256786
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   15
   -420.53651792
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   15
   -420.53551543
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   15
   -420.53474924
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   15
   -420.53425446
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C   -0.82413298   -0.80776653    0.01549278   -0.00587932   -0.03739795    0.01065160
C    0.30893000    1.51039107    0.01599661   -0.03092027   -0.04084264    0.00252208
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   15
   -420.53386850
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   15
   -420.53357983
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   15
   -420.53327589
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C   -0.81907604   -0.79835693    0.02853553    0.00249948   -0.02564748    0.01725882
C    0.30290135    1.49995499    0.01868812   -0.04035793   -0.03213029    0.00207667
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   15
   -420.53295677
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   15
   -420.53268322
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C   -0.81582136   -0.79004882    0.03598248    0.00790200   -0.01398731    0.02148902
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   15
   -420.53255143
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   15
   -420.53262268
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O   -1.98079283   -1.24115760   -0.14268757   -0.01065845    0.00111022   -0.01095610
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C   -0.81304057   -0.78090447    0.04213219    0.01251013   -0.00041060    0.02523631
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C    1.68058772    1.25691547   -0.09935946   -0.00051617    0.00310629   -0.00589368
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   15
   -420.53287377
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C    0.30426291    1.49190622    0.02259769   -0.02128984   -0.02765564    0.00070618
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C    1.68078835    1.25823679   -0.10205348   -0.00184755    0.00557044   -0.00644309
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   15
   -420.53328890
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   15
   -420.53375182
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C    1.68130954    1.26061650   -0.10714287   -0.00685157    0.00639551   -0.00724270
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   15
   -420.53415437
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O   -1.98048444   -1.23784824   -0.14750280   -0.01670908   -0.00008574   -0.01374788
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C   -0.80992879   -0.76340823    0.04968364    0.01749018    0.02748355    0.03026259
C    0.30953100    1.49210234    0.02478345   -0.00051965   -0.03251620   -0.00060709
C    0.38985630   -1.55930605    0.01219654    0.01938872    0.00632325   -0.00471886
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C    2.34506159    0.04921801   -0.05998999    0.00725295   -0.00235111   -0.01178956
H    3.42658123    0.00271338   -0.03317681   -0.00291129   -0.00612446    0.00261639
   15
   -420.53447112
H   -2.56011737    0.43324278    0.02268779    0.00627805   -0.00139113    0.00245902
O   -1.95157966    1.23078419    0.04189035    0.05211938   -0.01309042   -0.00468006
O   -1.97996590   -1.23702005   -0.14833290   -0.01713904    0.00028358   -0.01407042
C   -0.80133552    0.67677761    0.08859266   -0.06483990   -0.00237340    0.00057904
C   -0.80977946   -0.75981530    0.05046672    0.01759413    0.03357410    0.03087715
C    0.31144074    1.49312316    0.02552140    0.00549634   -0.03261936   -0.00100532
C    0.39144714   -1.56123196    0.01203237    0.02029845    0.00184978   -0.00605289
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C    1.70348774   -1.18717363    0.11408198   -0.01966863    0.01332027    0.00012824
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   15
   -420.53477839
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   15
   -420.53514319
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   15
   -420.53570302
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   15
   -420.53649026
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   15
   -420.53741767
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   15
   -420.53841947
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H    3.45652636    0.07556702   -0.02285163    0.01265238    0.00292218    0.00293621
   15
   -420.53929138
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   15
   -420.53990022
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C    1.69475730    1.26848340   -0.12539688   -0.00460237    0.01178114   -0.01119097
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   15
   -420.54018609
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C   -0.81809699   -0.75632930    0.03683329   -0.00245772    0.03611873    0.02359440
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   15
   -420.54016632
H   -2.67780842    0.51029903    0.06419846   -0.00875812    0.00187471    0.00276779
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O   -1.96596630   -1.23097806   -0.14816201    0.00294657    0.01588773   -0.00897976
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   15
   -420.53995262
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C   -0.82074386   -0.76260041    0.02933429   -0.01018011    0.02218426    0.01920364
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   15
   -420.53967756
H   -2.69357226    0.52134498    0.06621512   -0.00970126    0.00365137    0.00247856
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O   -1.96250138   -1.23121521   -0.14660425    0.00999851    0.02004086   -0.00678680
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C    1.73710914   -1.22900563    0.11194866    0.01386694   -0.00321267    0.01782220
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H    2.39398141   -2.08689702    0.06749497   -0.00623474    0.00229487   -0.00578908
C    2.35641960    0.04600058   -0.02247684    0.02006006   -0.00956034   -0.00130854
H    3.42072125    0.12322104   -0.03423184   -0.01526430    0.00728774    0.00236428
   15
   -420.53937755
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   15
   -420.53905705
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   15
   -420.53861477
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O   -1.95823829   -1.23332096   -0.14372014    0.01859275    0.02471411   -0.00368302
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   15
   -420.53802908
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O   -1.95719986   -1.23456280   -0.14266009    0.02030290    0.02556416   -0.00280698
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C   -0.82374472   -0.78196160    0.00617304   -0.02505831   -0.01779838    0.00655855
C    0.31509257    1.53767670    0.03791986   -0.00094515   -0.01010831    0.00486704
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C    2.35591436    0.05069644   -0.00880034    0.00776004    0.00150732    0.00292242
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   15
   -420.53731020
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C   -0.82335219   -0.78549732    0.00108863   -0.02605840   -0.02443558    0.00408160
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C    2.35531068    0.05192738   -0.00544892    0.00161635    0.00488341    0.00419715
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   15
   -420.53656768
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O   -1.95582191   -1.23791935   -0.14045289    0.02121237    0.02582699   -0.00138729
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C    2.35468207    0.05308432   -0.00216103   -0.00413793    0.00840766    0.00553172
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   15
   -420.53589291
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C    0.31295992    1.54655163    0.03908800   -0.00607535   -0.01968355    0.00647980
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C    1.71287923    1.25974464   -0.12576426    0.01406845   -0.01011963   -0.01081009
C    1.75102886   -1.25571375    0.09570185    0.01817209   -0.00887584    0.01766343
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C    2.35411475    0.05411408    0.00104319   -0.00883900    0.01198532    0.00689190
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   15
   -420.53546631
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O   -1.95539234   -1.24244001   -0.13818101    0.01840610    0.02401809   -0.00042918
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C   -0.81982895   -0.79356703   -0.01439256   -0.02332367   -0.03823832   -0.00278464
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C    1.75191467   -1.25909452    0.09226532    0.01793347   -0.01068730    0.01663811
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C    2.35367922    0.05496268    0.00414321   -0.01201759    0.01549921    0.00823822
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   15
   -420.53538413
H   -2.69373290    0.51198935    0.05600359   -0.00682309    0.00634537    0.00170767
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O   -1.95550007   -1.24511509   -0.13703525    0.01565818    0.02236533   -0.00008458
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C    1.71342910    1.25762211   -0.12336838    0.01361241   -0.01531989   -0.00958631
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   15
   -420.53566511
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O   -1.95578473   -1.24804344   -0.13588847    0.01215435    0.02023099    0.00018631
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C   -0.81569799   -0.79617994   -0.02456102   -0.01707071   -0.04170847   -0.00688194
C    0.31164548    1.55792215    0.03937570   -0.01040232   -0.01359488    0.00796044
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C    1.71339414    1.25689103   -0.12194869    0.01383313   -0.01589530   -0.00927805
C    1.75287573   -1.26533378    0.08465901    0.01757620   -0.01588283    0.01364697
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   15
   -420.53621713
H   -2.68116674    0.49379376    0.05018237   -0.00811812    0.00172561    0.00163144
O   -2.05979482    1.26344198    0.05626574   -0.04359155    0.00804054   -0.00566517
O   -1.95620671   -1.25120089   -0.13474376    0.00804444    0.01766496    0.00040942
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C   -0.81322002   -0.79655129   -0.02950453   -0.01299354   -0.04172891   -0.00880336
C    0.31149540    1.56218749    0.03924022   -0.01127106   -0.00834562    0.00831768
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C    1.75295636   -1.26811397    0.08053438    0.01743083   -0.01904045    0.01172802
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H    2.44573155   -2.10735953   -0.05700811    0.00359099   -0.00337994   -0.01090683
C    2.35350440    0.05591060    0.01261955   -0.01043177    0.02418858    0.01183146
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   15
   -420.53693045
H   -2.67274673    0.48401856    0.04682714   -0.00815545   -0.00042434    0.00155137
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O   -1.95671953   -1.25455839   -0.13360367    0.00349510    0.01474265    0.00060698
C   -0.75814375    0.72365684    0.06811256    0.04657493    0.01237745    0.00856077
C   -0.81054607   -0.79629300   -0.03431502   -0.00852503   -0.04068585   -0.01065202
C    0.31151518    1.56657785    0.03897910   -0.01169295   -0.00214405    0.00858108
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C    1.71268856    1.25613266   -0.11868878    0.01499036   -0.01298411   -0.00934234
C    1.75277353   -1.27060614    0.07623270    0.01721246   -0.02231493    0.00958282
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H    2.44769902   -2.10427372   -0.05685585    0.00260667   -0.00140839   -0.01038346
C    2.35379672    0.05554828    0.01511013   -0.00621100    0.02604960    0.01278879
H    3.45279997    0.08024003   -0.09034767    0.01031038    0.00212622   -0.00153023
   15
   -420.53764130
H   -2.66286719    0.47431415    0.04319305   -0.00759561   -0.00218443    0.00144056
O   -2.06069686    1.26659751    0.05945873   -0.04023294    0.01383655   -0.00469573
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   15
   -420.53823725
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   15
   -420.53864397
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O   -1.95827642   -1.26548471   -0.13023297   -0.01096351    0.00453193    0.00120461
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   15
   -420.53893554
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O   -1.95861958   -1.26928280   -0.12913365   -0.01549522    0.00089721    0.00143365
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   15
   -420.53916202
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O   -1.95878729   -1.27309110   -0.12805064   -0.01966388   -0.00271211    0.00168547
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   15
   -420.53935089
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O   -1.95873238   -1.27686870   -0.12698677   -0.02335665   -0.00624455    0.00195438
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   15
   -420.53941624
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O   -1.95841307   -1.28057555   -0.12594508   -0.02649026   -0.00965462    0.00223628
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   15
   -420.53930995
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O   -1.95779383   -1.28417304   -0.12492875   -0.02901550   -0.01286726    0.00252561
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   15
   -420.53899607
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O   -1.95684606   -1.28762477   -0.12394108   -0.03089164   -0.01585976    0.00281268
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   15
   -420.53835918
H   -2.55602621    0.41490493    0.00243188    0.01249860   -0.00280637   -0.00053354
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O   -1.95554848   -1.29089683   -0.12298531   -0.03210121   -0.01858570    0.00309112
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   15
   -420.53749717
H   -2.55007405    0.41122502   -0.00228292    0.01333675   -0.00337833   -0.00094191
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O   -1.95388738   -1.29395836   -0.12206457   -0.03264316   -0.02100631    0.00334801
C   -0.81008114    0.76580745    0.04055791   -0.03790471    0.00984684    0.00503568
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C    1.69383240    1.25566309   -0.09020483   -0.00706011    0.00412684   -0.00502775
C    1.73839856   -1.27147296    0.02730572   -0.00802512   -0.00817704   -0.01640506
H    0.07847258    2.68708173   -0.03649730   -0.00355066    0.01283079   -0.00342885
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C    2.34549591    0.02673759    0.02733982    0.01156612    0.00504901    0.02264582
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   15
   -420.53651375
H   -2.54651218    0.40815816   -0.00682747    0.01344908   -0.00428593   -0.00139965
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O   -1.95185660   -1.29678191   -0.12118178   -0.03252614   -0.02310058    0.00358286
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C   -0.78573759   -0.76092016   -0.07271641    0.02138903    0.01286143   -0.02526371
C    0.31768769    1.60821179    0.02528896    0.01778674    0.00021859    0.00965480
C    0.41035319   -1.61575551    0.11270380    0.01973927   -0.01803860    0.02121964
C    1.69168259    1.25518182   -0.08687666   -0.01030142    0.00311775   -0.00401007
C    1.73694587   -1.26967174    0.02364437   -0.00935170   -0.00326167   -0.01856970
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H    2.45912902   -2.10162326    0.05255444    0.00685078   -0.00459461    0.00012443
C    2.34293300    0.02263677    0.02672893    0.00638479    0.00026600    0.02352857
H    3.43222028   -0.01212778   -0.12822302    0.00798214   -0.00675035   -0.00475350
   15
   -420.53555868
H   -2.54536163    0.40586716   -0.01111942    0.01287770   -0.00546713   -0.00189518
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O   -1.94945743   -1.29934377   -0.12033958   -0.03177611   -0.02481931    0.00378781
C   -0.81719184    0.77137309    0.03425127   -0.05188071    0.01152407    0.00381731
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   15
   -420.53482096
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   15
   -420.53436054
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   15
   -420.53426946
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   15
   -420.53441968
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O   -1.93644515   -1.30665431   -0.11741732   -0.02320404   -0.02746799    0.00423116
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   15
   -420.53473659
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   15
   -420.53516955
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   15
   -420.53567625
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   15
   -420.53630736
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   15
   -420.53709593
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   15
   -420.53804715
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   15
   -420.53913870
H   -2.61926764    0.47201224   -0.02064585   -0.00132920    0.00159919   -0.00253430
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C    0.30267171    1.62843341   -0.00735474   -0.00982785    0.01900519    0.00369294
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C    1.67805997    1.24199694   -0.04398143    0.00429280    0.01107584    0.00020531
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C    2.31043222   -0.00554594   -0.00695966    0.01075277   -0.04004101    0.01141761
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   15
   -420.54021917
H   -2.62700628    0.48367726   -0.01770955   -0.00078718    0.00492165   -0.00186632
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O   -1.90089948   -1.30747626   -0.11381135    0.01235330   -0.01274997    0.00328608
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C   -0.79372898   -0.74368236   -0.05780951   -0.02093244    0.01354391   -0.01374331
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   15
   -420.54110681
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   15
   -420.54166073
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   15
   -420.54186875
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C    1.67425883    1.23278608   -0.02930622    0.00071534   -0.01286861    0.00277567
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   15
   -420.54176529
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   15
   -420.54144831
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   15
   -420.54103900
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   15
   -420.54059111
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   15
   -420.54015441
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C   -0.78234321   -0.75207884   -0.02897209   -0.02219947   -0.02075590    0.00478734
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   15
   -420.53966224
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C    1.66832599    1.22634606   -0.00855058    0.00017788   -0.03711013    0.00381613
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   15
   -420.53905605
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   15
   -420.53830172
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O   -1.87020390   -1.29621718   -0.11209533    0.03423816    0.00310086   -0.00244350
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C    1.66640116    1.22828177   -0.00207404    0.00215700   -0.03398552    0.00449250
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C    2.28043766    0.02688146   -0.06388871   -0.01472506    0.02873730   -0.01334268
H    3.36952641    0.07181753    0.02047352    0.00273566    0.00344331    0.00349680
   15
   -420.53734124
H   -2.66944141    0.50523875    0.02549918   -0.01267766    0.00155688   -0.00004876
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C   -0.73628896    0.74065154   -0.03780645    0.04771564    0.00054020   -0.01315585
C   -0.76818283   -0.75090112   -0.01510333    0.00261653   -0.02576637    0.01441043
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   15
   -420.53636401
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   15
   -420.53538293
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   15
   -420.53451024
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O   -1.87051718   -1.29268756   -0.11116870    0.02202777   -0.00153830   -0.00588327
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   15
   -420.53384657
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O   -1.87131221   -1.29179878   -0.11079435    0.01885905   -0.00294913   -0.00666374
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C   -0.75467363   -0.74379190   -0.00466632    0.02831624   -0.01610269    0.02137588
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C    1.66104889    1.24106071    0.01278132   -0.00310529   -0.01469824    0.00695787
C    1.68475642   -1.28677976    0.05479405   -0.01988988   -0.03433569    0.01815637
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   15
   -420.53337132
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C    0.31054311    1.61226819   -0.06298831    0.01809602    0.01696752   -0.01132879
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   15
   -420.53305650
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O   -1.87351175   -1.28990525   -0.10981100    0.01336626   -0.00564654   -0.00800249
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C    1.65903469    1.24815138    0.01803713   -0.01137482   -0.00909307    0.00709134
C    1.68312268   -1.28543750    0.05923539   -0.02441087   -0.03077775    0.02166294
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C    2.27624281    0.03085549   -0.08769631    0.00685803    0.02832907   -0.02372740
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   15
   -420.53278288
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O   -1.87485412   -1.28886991   -0.10918681    0.01121348   -0.00686184   -0.00854296
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C    0.31190341    1.60643483   -0.06714034    0.02611160    0.00669202   -0.01352339
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C    1.65825269    1.25192291    0.02050432   -0.01585878   -0.00681322    0.00697897
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C    2.27526566    0.02946335   -0.08984814    0.00283677    0.02413166   -0.02539163
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   15
   -420.53249549
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O   -1.99881792    1.24755811    0.10170268   -0.01991224    0.01080228    0.00969370
O   -1.87632414   -1.28775680   -0.10846578    0.00953220   -0.00796872   -0.00899137
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C   -0.74768164   -0.73303382    0.00068572    0.03835137    0.00537821    0.02415252
C    0.31202028    1.60332720   -0.06891787    0.02850679    0.00224698   -0.01445291
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C    1.65770999    1.25579749    0.02286602   -0.01994824   -0.00455280    0.00685668
C    1.68295662   -1.28225303    0.06237281   -0.02722577   -0.02337972    0.02391834
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H    2.37733706   -2.12465304    0.06618676    0.00086639   -0.00247565   -0.00444668
C    2.27424664    0.02770720   -0.09161617   -0.00203735    0.01924045   -0.02695328
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   15
   -420.53223907
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O   -1.87790270   -1.28655346   -0.10764287    0.00831418   -0.00890804   -0.00932361
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C    0.31170780    1.60018442   -0.07047710    0.02952610   -0.00122860   -0.01520225
C    0.36526106   -1.56316977    0.05258900   -0.00579532    0.02546667   -0.02060151
C    1.65746791    1.25974063    0.02512394   -0.02321841   -0.00206305    0.00681915
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   15
   -420.53204583
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O   -1.87957603   -1.28524916   -0.10671428    0.00757305   -0.00969913   -0.00955481
C   -0.75667387    0.70342146   -0.04450132   -0.00176105   -0.04714276   -0.01178242
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C    0.31095069    1.59705883   -0.07180672    0.02905667   -0.00356494   -0.01575416
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C    1.65757547    1.26371449    0.02727856   -0.02532932    0.00083646    0.00694779
C    1.68441893   -1.27766248    0.06407003   -0.02646964   -0.01437644    0.02490344
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C    2.27237582    0.02340626   -0.09391000   -0.01153103    0.00790830   -0.02934880
H    3.36505389    0.04533466    0.04774097    0.00763487    0.00085928    0.00640820
   15
   -420.53199536
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C   -0.75992469    0.70276962   -0.04408759   -0.00689050   -0.04737001   -0.01110126
C   -0.74832155   -0.72552516    0.00091882    0.03396733    0.02297202    0.02347478
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C    0.36739701   -1.56894367    0.05055647   -0.00204254    0.01108475   -0.01903484
C    1.65806435    1.26767505    0.02932786   -0.02608186    0.00425973    0.00729810
C    1.68575524   -1.27500656    0.06435693   -0.02444254   -0.00988647    0.02492279
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C    2.27166644    0.02103255   -0.09439980   -0.01514973    0.00171336   -0.03001565
H    3.36994297    0.04143249    0.04514674    0.01077504    0.00066747    0.00667509
   15
   -420.53214046
H   -2.54500446    0.41015517    0.06742788    0.00524786   -0.00763653    0.00006559
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O   -1.88317829   -1.28230389   -0.10453078    0.00738372   -0.01072621   -0.00968920
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C   -0.74960370   -0.72360171    0.00027895    0.03087636    0.02796742    0.02277474
C    0.30815447    1.59098216   -0.07374703    0.02356760   -0.00467848   -0.01622127
C    0.36852503   -1.57213726    0.04997839   -0.00044029    0.00437765   -0.01803880
C    1.65894581    1.27157049    0.03126651   -0.02539305    0.00825690    0.00790071
C    1.68745973   -1.27220088    0.06426739   -0.02130236   -0.00563625    0.02463334
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   15
   -420.53252924
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   15
   -420.53307706
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   15
   -420.53369255
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C    1.66373915    1.28222378    0.03630948   -0.01561994    0.02298906    0.01103460
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   15
   -420.53428969
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C    2.27197708    0.01069068   -0.09006081   -0.01458986   -0.02878418   -0.02752220
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   15
   -420.53477474
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O   -1.89380001   -1.27282622   -0.09719273    0.01199709   -0.00915160   -0.00810784
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C   -0.76184077   -0.72138009   -0.00776143    0.01025504    0.03945245    0.01635633
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C    1.69938700   -1.25795961    0.05846927    0.00491999    0.00947340    0.01939875
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   15
   -420.53518364
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O   -1.89627997   -1.27059118   -0.09542918    0.01335204   -0.00806570   -0.00751424
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C    0.29408313    1.57372391   -0.07378409   -0.01428775    0.00005792   -0.01473212
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C    1.70189459   -1.25538815    0.05635076    0.01030668    0.01148744    0.01779519
H   -0.00219201    2.59613469    0.01310819    0.00115940   -0.01593571    0.00157516
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C    2.27378981    0.00896798   -0.08532161   -0.00773833   -0.03778027   -0.02460150
H    3.35240883    0.01352826   -0.00383432   -0.00583657   -0.00164893    0.00273608
   15
   -420.53559239
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C    1.70424720   -1.25299025    0.05396333    0.01498051    0.01338966    0.01606802
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C    2.27489891    0.00893081   -0.08238267   -0.00459050   -0.04093930   -0.02301290
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   15
   -420.53606439
H   -2.52512685    0.40001265    0.09076589    0.00781276   -0.00518359    0.00186095
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O   -1.90170975   -1.26586206   -0.09165415    0.01605591   -0.00525349   -0.00612274
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C   -0.77157183   -0.72694524   -0.01571555   -0.00218538    0.03474591    0.01075476
C    0.29001791    1.56801188   -0.07196590   -0.02526227   -0.00902543   -0.01438031
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C    1.67532564    1.29209205    0.04112983    0.00765572    0.04133349    0.01590747
C    1.70637451   -1.25079473    0.05133310    0.01866942    0.01523467    0.01423348
H    0.00475162    2.59762344   -0.00009201    0.00147913   -0.01384309    0.00125342
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C    2.27607878    0.00951129   -0.07909580   -0.00252697   -0.04300419   -0.02140729
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   15
   -420.53667716
H   -2.52797268    0.40567541    0.09263429    0.00813007   -0.00295283    0.00206323
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C   -0.77661864    0.72620111   -0.03264627   -0.03174168    0.01385410   -0.00381795
C   -0.77483091   -0.72989338   -0.01873119   -0.00588388    0.03172042    0.00870011
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C    2.27729883    0.01074050   -0.07548528   -0.00209762   -0.04384321   -0.01979023
H    3.34500455    0.00465767   -0.03515826   -0.01535948   -0.00281128    0.00061149
   15
   -420.53743571
H   -2.53227734    0.41187096    0.09413143    0.00811051   -0.00080635    0.00224844
O   -1.96009940    1.22928014    0.08234671    0.04235824   -0.01096652    0.00127926
O   -1.90786673   -1.26089685   -0.08760186    0.01840161   -0.00184863   -0.00457322
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C   -0.77800142   -0.73332050   -0.02187831   -0.00925770    0.02819845    0.00658524
C    0.28746326    1.56287540   -0.06927865   -0.03280558   -0.02380996   -0.01389320
C    0.37727542   -1.60041190    0.05663594    0.00385656   -0.00458327   -0.00510320
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C    1.70974851   -1.24712118    0.04545656    0.02247528    0.01859445    0.01028549
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C    2.27855288    0.01263098   -0.07157559   -0.00355336   -0.04334565   -0.01812670
H    3.34753631    0.00262140   -0.04597349   -0.01470119   -0.00319298    0.00006128
   15
   -420.53828989
H   -2.53803530    0.41821630    0.09522414    0.00763116    0.00103868    0.00241647
O   -1.95967760    1.22738472    0.08060390    0.04294309   -0.01523693    0.00092951
O   -1.91125182   -1.25837298   -0.08549345    0.01928557   -0.00005085   -0.00377170
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C   -0.78103246   -0.73717355   -0.02512495   -0.01223479    0.02432389    0.00442760
C    0.28690330    1.56078877   -0.06761797   -0.03530779   -0.03138335   -0.01345919
C    0.37773404   -1.60268805    0.05813254    0.00234801   -0.00465764   -0.00286630
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H    0.01364654    2.61601650   -0.02156764   -0.00085567    0.00004913    0.00094241
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C    2.27986276    0.01517512   -0.06739197   -0.00674330   -0.04144221   -0.01636065
H    3.35268489    0.00116003   -0.05679960   -0.01199777   -0.00358138   -0.00050263
   15
   -420.53910195
H   -2.54516018    0.42438163    0.09588213    0.00663359    0.00241503    0.00256907
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O   -1.91485542   -1.25584853   -0.08334222    0.01988968    0.00174081   -0.00298404
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C   -0.78387902   -0.74139410   -0.02843852   -0.01476214    0.02023296    0.00224849
C    0.28687621    1.55917538   -0.06575398   -0.03697043   -0.03795103   -0.01286812
C    0.37815740   -1.60489302    0.05967231    0.00063204   -0.00536612   -0.00050338
C    1.68324807    1.28957540    0.04083952    0.01108136    0.02820680    0.01472329
C    1.71178732   -1.24456449    0.03895943    0.02154211    0.02038915    0.00605360
H    0.01670817    2.62335591   -0.02909756   -0.00168244    0.00486758    0.00066251
H    0.12249688   -2.67403766    0.15138203   -0.00158848   -0.01087195    0.00130486
H    2.31346293    2.16478676    0.18055417   -0.00284201    0.00242633    0.00546221
H    2.39751505   -2.08724717    0.09384421   -0.00330606   -0.00133047    0.00084953
C    2.28127610    0.01834413   -0.06296116   -0.01115828   -0.03811630   -0.01444274
H    3.35997076    0.00034366   -0.06753409   -0.00773147   -0.00398322   -0.00114468
   15
   -420.53984456
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   15
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   15
   -420.54108258
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   15
   -420.54161556
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   15
   -420.54210285
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   15
   -420.54260555
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   15
   -420.54302652
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C    2.29930733    0.05154131   -0.02771640   -0.02419216    0.01202785    0.00115854
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   15
   -420.54327701
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   15
   -420.54323415
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   15
   -420.54286300
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   15
   -420.54217626
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C    2.31711019    0.06932442   -0.00714421    0.00100990    0.03771024    0.00638765
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   15
   -420.54135143
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C    1.69354469    1.26606146    0.02042219    0.00759741   -0.02217927    0.01049077
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H    2.46652146   -2.00888774    0.10966369    0.00252612    0.00991872    0.00529636
C    2.32179954    0.07255487   -0.00220329    0.00861078    0.04147515    0.00709660
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   15
   -420.54043861
H   -2.62219467    0.46205397    0.05767785   -0.00474994    0.00620142    0.00190330
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   15
   -420.53959777
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   15
   -420.53895164
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O   -1.98800474   -1.22848339   -0.05151811   -0.01685024    0.01305602    0.00616579
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   15
   -420.53840826
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   15
   -420.53797864
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O   -1.99735450   -1.22713155   -0.04804075   -0.02208470    0.01291622    0.00674402
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   15
   -420.53755146
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   15
   -420.53712099
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   15
   -420.53667169
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   15
   -420.53632286
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   15
   -420.53612950
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   15
   -420.53612542
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O   -2.01887386   -1.22653949   -0.03948808   -0.02766495    0.01175741    0.00699484
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C    1.69950070    1.28029213   -0.01844402   -0.02516568   -0.01311910    0.00587486
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   15
   -420.53630843
H   -2.58071391    0.40291004   -0.01875774   -0.00173581   -0.00627509   -0.00157854
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O   -2.02138596   -1.22692391   -0.03834353   -0.02739871    0.01146327    0.00682323
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C   -0.81383894   -0.82911639   -0.05608796    0.00898195   -0.01701281   -0.02167481
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C    1.70177773    1.28346643   -0.02270015   -0.02269438   -0.00781907    0.00442685
C    1.72528785   -1.20783536   -0.00782024   -0.00906721    0.01551044   -0.01452287
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H    2.39419604    2.12403552   -0.19585447    0.00896802    0.00143383   -0.00732791
H    2.42867019   -2.05724851    0.00018870    0.00372497   -0.00652325    0.00085554
C    2.35936009    0.06438885    0.04487429    0.00428362    0.00140532    0.01682875
H    3.46221770    0.14413325   -0.06761930    0.01517267    0.00983753   -0.00512476
   15
   -420.53661393
H   -2.57481296    0.39866035   -0.02528640   -0.00077063   -0.00666500   -0.00187652
O   -2.00968315    1.23456313    0.02996170   -0.03600191    0.02475131    0.00207171
O   -2.02358747   -1.22743833   -0.03727632   -0.02691134    0.01114546    0.00659200
C   -0.74087486    0.67225603    0.01625516    0.01242033   -0.04056573    0.00289218
C   -0.81625425   -0.82979909   -0.05333980    0.00685770   -0.01655609   -0.02066395
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   15
   -420.53691663
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O   -2.02548388   -1.22807921   -0.03628384   -0.02625110    0.01083694    0.00630476
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C   -0.81877306   -0.83023140   -0.05027941    0.00459379   -0.01614081   -0.01949243
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   15
   -420.53711186
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O   -2.02708264   -1.22884303   -0.03536282   -0.02545520    0.01051353    0.00596282
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C    1.73477682   -1.19834968   -0.00438069    0.00956720    0.02764444   -0.00975684
H    0.08123446    2.63621028   -0.06593419    0.00661707   -0.00807570   -0.00224682
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   15
   -420.53719271
H   -2.55726972    0.39290330   -0.04268489    0.00363114   -0.00503092   -0.00243183
O   -2.00460856    1.23301292    0.02310779   -0.03253320    0.02198143    0.00145730
O   -2.02839275   -1.22972613   -0.03450940   -0.02456027    0.01018671    0.00557182
C   -0.74467843    0.67466670    0.02020183    0.00955989   -0.03415341    0.00285533
C   -0.82398356   -0.83036926   -0.04329496   -0.00008908   -0.01546615   -0.01671272
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C    0.39421292   -1.63174115    0.02077652    0.00873449   -0.02396774    0.00746088
C    1.71365598    1.29640971   -0.04010982   -0.00271440    0.01713939   -0.00371278
C    1.73778170   -1.19595237   -0.00290601    0.01619424    0.03005668   -0.00807146
H    0.07814654    2.63049832   -0.05705368    0.00729917   -0.01130765   -0.00173334
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H    2.39432775   -2.06646242   -0.05049005   -0.00531538   -0.00379778   -0.00278247
C    2.36712289    0.05341881    0.05332291    0.01685726   -0.02350266    0.01555999
H    3.44890977    0.13188638   -0.01274029   -0.00051367    0.00882207   -0.00148119
   15
   -420.53718449
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O   -2.02942433   -1.23072478   -0.03371912   -0.02358820    0.00985427    0.00512710
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C   -0.82660456   -0.83008497   -0.03941291   -0.00240347   -0.01522373   -0.01513205
C    0.33286674    1.59359190    0.02188590   -0.00007643    0.03532314    0.00858800
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C    1.71693977    1.29923464   -0.04440449    0.00280650    0.02239131   -0.00588293
C    1.74054214   -1.19400862   -0.00130928    0.02252637    0.03172772   -0.00639176
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H    2.39269330    2.11974937   -0.22435436   -0.00038585   -0.01042974   -0.00509243
H    2.38703128   -2.06654297   -0.06230576   -0.00764250   -0.00228794   -0.00356993
C    2.36857441    0.05134761    0.05483156    0.02091628   -0.02804641    0.01515295
H    3.44357963    0.12461736    0.00207842   -0.00594876    0.00794892   -0.00060313
   15
   -420.53714835
H   -2.54837155    0.39377538   -0.05214864    0.00656419   -0.00263789   -0.00258605
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O   -2.03018841   -1.23183519   -0.03298695   -0.02256085    0.00951691    0.00463719
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C   -0.82918933   -0.82957043   -0.03530219   -0.00464524   -0.01504352   -0.01344640
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C    0.39243587   -1.62905745    0.01075701    0.00734739   -0.01964123    0.00322162
C    1.72018196    1.30172263   -0.04861043    0.00763063    0.02633683   -0.00787364
C    1.74296267   -1.19254382    0.00038411    0.02828100    0.03277004   -0.00472870
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C    2.36971072    0.04969948    0.05611105    0.02408473   -0.03170598    0.01480531
H    3.43930868    0.11591998    0.01700760   -0.01058618    0.00694151    0.00015567
   15
   -420.53724429
H   -2.54556539    0.39503544   -0.05618862    0.00756749   -0.00150691   -0.00262135
O   -1.99624915    1.22926961    0.01610826   -0.02472050    0.01350399    0.00053073
O   -2.03069660   -1.23305352   -0.03230735   -0.02150100    0.00915803    0.00410718
C   -0.74976768    0.68163957    0.02375929    0.00535836   -0.02026778    0.00287505
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C    0.32724478    1.58771647    0.02637523   -0.00981234    0.02613860    0.00981352
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C    1.72331000    1.30381440   -0.05269764    0.01143803    0.02864685   -0.00960088
C    1.74495666   -1.19157385    0.00214900    0.03316787    0.03329901   -0.00308371
H    0.06112022    2.62594604   -0.02877391    0.00554063   -0.00884864   -0.00094079
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C    2.37048492    0.04852954    0.05716663    0.02559576   -0.03437043    0.01451844
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   15
   -420.53744919
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O   -2.03096091   -1.23437571   -0.03167431   -0.02042785    0.00878246    0.00354107
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C    1.72626651    1.30547520   -0.05664006    0.01408982    0.02917629   -0.01102919
C    1.74645053   -1.19110682    0.00396053    0.03695113    0.03341648   -0.00144708
H    0.05320896    2.62813650   -0.01896112    0.00379707   -0.00455486   -0.00077578
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H    2.37466507   -2.06524226   -0.09338337   -0.01172151    0.00079579   -0.00565356
C    2.37087475    0.04787801    0.05800267    0.02495859   -0.03599214    0.01424320
H    3.43695158    0.09497338    0.04667744   -0.01445395    0.00472660    0.00130544
   15
   -420.53773752
H   -2.54411084    0.39822625   -0.06284485    0.00804900   -0.00015598   -0.00272473
O   -1.98923003    1.22595263    0.01140555   -0.01576602    0.00690264   -0.00001689
O   -2.03099349   -1.23579748   -0.03108140   -0.01936368    0.00836984    0.00294193
C   -0.75359983    0.68793547    0.02591386    0.00184322   -0.00785456    0.00290385
C   -0.83639573   -0.82666881   -0.02185945   -0.01065187   -0.01477191   -0.00789522
C    0.32220194    1.58029317    0.03027217   -0.01668738    0.01048627    0.01084445
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C    1.72901130    1.30669690   -0.06041607    0.01565927    0.02802102   -0.01217444
C    1.74738724   -1.19114459    0.00579396    0.03948703    0.03316584    0.00017253
H    0.04461966    2.63113780   -0.00900946    0.00174893    0.00039887   -0.00055862
H    0.19402493   -2.70877884    0.04772364   -0.00474162   -0.01029484    0.00510622
H    2.38834134    2.14417222   -0.22958611   -0.00069408   -0.00778085   -0.00484445
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C    2.37089000    0.04776926    0.05862342    0.02205034   -0.03645731    0.01391370
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   15
   -420.53803919
H   -2.54554493    0.39991361   -0.06544112    0.00738535   -0.00006875   -0.00282903
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O   -2.03080637   -1.23731423   -0.03052185   -0.01834230    0.00794704    0.00232146
C   -0.75557122    0.69130957    0.02692541   -0.00019945   -0.00109506    0.00290430
C   -0.83851437   -0.82525342   -0.01710158   -0.01233121   -0.01471002   -0.00592680
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C    0.38769800   -1.62035143   -0.00960718    0.00204639   -0.01372831   -0.00510988
C    1.73152039    1.30749664   -0.06400827    0.01636308    0.02546958   -0.01310210
C    1.74772851   -1.19168333    0.00762484    0.04070488    0.03249919    0.00177220
H    0.03571664    2.63406878    0.00104117   -0.00038934    0.00525630   -0.00024692
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H    2.37648659   -2.06470913   -0.10921752   -0.01089510    0.00023423   -0.00697401
C    2.37057420    0.04821024    0.05903395    0.01722784   -0.03568945    0.01345566
H    3.44444151    0.07063884    0.07541207   -0.00926349    0.00222433    0.00237686
   15
   -420.53824211
H   -2.54829957    0.40161903   -0.06752835    0.00617264   -0.00039684   -0.00294611
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O   -2.03041112   -1.23892110   -0.02998861   -0.01738961    0.00747408    0.00168132
C   -0.75753930    0.69470004    0.02789306   -0.00247765    0.00581100    0.00288311
C   -0.84044679   -0.82361572   -0.01225414   -0.01379420   -0.01459724   -0.00392117
C    0.31815814    1.57223532    0.03351634   -0.02150562   -0.00520232    0.01128348
C    0.38637915   -1.61761776   -0.01458141    0.00030249   -0.01363582   -0.00693360
C    1.73378273    1.30791247   -0.06740252    0.01652713    0.02195511   -0.01389958
C    1.74745593   -1.19271280    0.00942896    0.04060415    0.03130057    0.00333767
H    0.02688236    2.63606407    0.01113488   -0.00244706    0.00938526    0.00015535
H    0.20215258   -2.70206335    0.04671557   -0.00300162   -0.00863678    0.00603730
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H    2.38039525   -2.06454606   -0.11531072   -0.00944304   -0.00078237   -0.00762645
C    2.36999939    0.04918929    0.05924126    0.01120498   -0.03365595    0.01282192
H    3.45097971    0.05775643    0.08918620   -0.00419532    0.00078439    0.00303126
   15
   -420.53823458
H   -2.55215822    0.40339924   -0.06908555    0.00450028   -0.00099513   -0.00307168
O   -1.97754953    1.22047378    0.00435688    0.00339142   -0.00214199   -0.00045923
O   -2.02981854   -1.24061267   -0.02947443   -0.01653551    0.00695758    0.00102536
C   -0.75946958    0.69800267    0.02881716   -0.00502468    0.01268845    0.00282962
C   -0.84217098   -0.82175741   -0.00734745   -0.01499829   -0.01442922   -0.00189106
C    0.31660663    1.56826590    0.03488385   -0.02336011   -0.01139579    0.01126746
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C    1.73579544    1.30799694   -0.07058668    0.01646877    0.01795208   -0.01464698
C    1.74657087   -1.19421472    0.01118269    0.03929778    0.02942925    0.00483139
H    0.01848485    2.63638651    0.02119942   -0.00425438    0.01234947    0.00064227
H    0.20711254   -2.69627120    0.04462035   -0.00175154   -0.00637194    0.00632820
H    2.38606604    2.17710603   -0.22428225    0.00492098    0.00326328   -0.00580605
H    2.38599594   -2.06423831   -0.12003176   -0.00746910   -0.00206565   -0.00823442
C    2.36925552    0.05067572    0.05925490    0.00486821   -0.03039476    0.01201119
H    3.45826523    0.04473478    0.10241320    0.00144696   -0.00079739    0.00378412
   15
   -420.53801771
H   -2.55682301    0.40536059   -0.07009011    0.00254744   -0.00175671   -0.00319266
O   -1.97363005    1.21865180    0.00201606    0.01071637   -0.00498323   -0.00052257
O   -2.02903828   -1.24238309   -0.02897186   -0.01581137    0.00639604    0.00035653
C   -0.76132355    0.70111372    0.02969853   -0.00784974    0.01934946    0.00273361
C   -0.84366873   -0.81968106   -0.00241217   -0.01593153   -0.01416166    0.00015278
C    0.31540793    1.56446677    0.03608116   -0.02489670   -0.01595540    0.01112724
C    0.38375425   -1.61152394   -0.02419063   -0.00316496   -0.01481458   -0.01010490
C    1.73755902    1.30781002   -0.07354938    0.01646875    0.01390576   -0.01539521
C    1.74509295   -1.19616063    0.01286353    0.03691158    0.02673904    0.00620158
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   15
   -420.53763111
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O   -2.02807851   -1.24422604   -0.02847333   -0.01524411    0.00579904   -0.00032087
C   -0.76305851    0.70393269    0.03053863   -0.01092651    0.02561048    0.00258830
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   15
   -420.53719612
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O   -2.02694567   -1.24613472   -0.02797115   -0.01485028    0.00515535   -0.00100605
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C    0.31415712    1.55762679    0.03797473   -0.02700853   -0.01952126    0.01062536
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C    1.74033481    1.30685992   -0.07876376    0.01726087    0.00708904   -0.01709439
C    1.74051521   -1.20120744    0.01592661    0.02969768    0.01859518    0.00839254
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   15
   -420.53678155
H   -2.57211315    0.41363643   -0.06960389   -0.00306926   -0.00340421   -0.00330368
O   -1.96293001    1.21365553   -0.00496899    0.03154075   -0.01382372   -0.00066953
O   -2.02564424   -1.24810186   -0.02745756   -0.01463332    0.00448562   -0.00169458
C   -0.76598317    0.70832557    0.03210455   -0.01749257    0.03618582    0.00215168
C   -0.84668554   -0.81219490    0.01225630   -0.01688991   -0.01244807    0.00624056
C    0.31413690    1.55463982    0.03867849   -0.02755449   -0.01851584    0.01033939
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C    1.74133485    1.30619926   -0.08098978    0.01820209    0.00478926   -0.01802697
C    1.73752398   -1.20418524    0.01727572    0.02528047    0.01317543    0.00914294
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H    2.37039492    2.21106698   -0.20283943    0.00697406    0.01189075   -0.00514375
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C    2.36631868    0.06048213    0.05764454   -0.01002817   -0.00857444    0.00793085
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   15
   -420.53647848
H   -2.57652384    0.41751793   -0.06825345   -0.00425824   -0.00332505   -0.00321397
O   -1.95997799    1.21225822   -0.00728299    0.03699639   -0.01696953   -0.00076264
O   -2.02417665   -1.25011983   -0.02692475   -0.01459345    0.00377064   -0.00238422
C   -0.76707395    0.70974000    0.03283696   -0.02069388    0.04015357    0.00186967
C   -0.84718294   -0.80930935    0.01699778   -0.01658614   -0.01147751    0.00820983
C    0.31453282    1.55193083    0.03922591   -0.02772064   -0.01586252    0.01007385
C    0.37923953   -1.59658273   -0.04143084   -0.00743866   -0.01460594   -0.01463729
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C    1.73415086   -1.20736129    0.01848693    0.02055727    0.00697654    0.00961998
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C    2.36587599    0.06348606    0.05690296   -0.00944029   -0.00221902    0.00702339
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   15
   -420.53624289
H   -2.58017596    0.42199181   -0.06632529   -0.00488837   -0.00283445   -0.00305376
O   -1.95744451    1.21105346   -0.00958828    0.04121907   -0.02016861   -0.00090169
O   -2.02254341   -1.25218052   -0.02636488   -0.01470727    0.00302461   -0.00306602
C   -0.76785219    0.71054862    0.03354113   -0.02360027    0.04304088    0.00155928
C   -0.84742986   -0.80625054    0.02161520   -0.01601544   -0.01026740    0.01012735
C    0.31534739    1.54946009    0.03962096   -0.02745934   -0.01191177    0.00984399
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C    1.73046706   -1.21064214    0.01955300    0.01569485    0.00020014    0.00982935
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H    2.35515762    2.21647161   -0.18636508    0.00373892    0.00999658   -0.00380752
H    2.43298270   -2.04809006   -0.11476190    0.00540977   -0.00439938   -0.00903926
C    2.36557381    0.06652374    0.05605500   -0.00701710    0.00396163    0.00627011
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   15
   -420.53611349
H   -2.58295597    0.42696896   -0.06384821   -0.00493860   -0.00190198   -0.00283246
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O   -2.02074322   -1.25427550   -0.02577024   -0.01495603    0.00225233   -0.00374363
C   -0.76827423    0.71070796    0.03422172   -0.02599039    0.04471534    0.00123805
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C    0.31657652    1.54716853    0.03986710   -0.02668052   -0.00720431    0.00965762
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C    1.72654597   -1.21392554    0.02047086    0.01081399   -0.00693990    0.00975927
H   -0.00963064    2.58073288    0.08297265   -0.00550476   -0.00584714    0.00379629
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H    2.34636628    2.21636211   -0.17703602    0.00126541    0.00760557   -0.00301151
H    2.43937445   -2.04232011   -0.10804992    0.00645996   -0.00298298   -0.00851410
C    2.36537566    0.06950202    0.05511201   -0.00287849    0.00972853    0.00570022
H    3.46259022   -0.02557961    0.16826326    0.01084030   -0.01072549    0.00756007
   15
   -420.53597918
H   -2.58485524    0.43228299   -0.06086192   -0.00441673   -0.00058566   -0.00256111
O   -1.95380739    1.20936532   -0.01416598    0.04514326   -0.02622475   -0.00131031
O   -2.01877330   -1.25639600   -0.02513315   -0.01529157    0.00146144   -0.00440292
C   -0.76830416    0.71019279    0.03488360   -0.02767363    0.04509200    0.00092279
C   -0.84721031   -0.79969044    0.03036308   -0.01421281   -0.00704445    0.01373640
C    0.31820826    1.54498586    0.03996721   -0.02525917   -0.00246753    0.00948695
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C    1.74236953    1.30296182   -0.08702317    0.02419049    0.00443216   -0.02168422
C    1.72246127   -1.21710391    0.02124146    0.00600781   -0.01416641    0.00945278
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H    2.33735160    2.21489280   -0.16716531   -0.00153007    0.00456319   -0.00219421
H    2.44460987   -2.03601997   -0.09980770    0.00705419   -0.00110660   -0.00781697
C    2.36521930    0.07233386    0.05408253    0.00269602    0.01491924    0.00534585
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   15
   -420.53580238
H   -2.58596649    0.43769860   -0.05741497   -0.00340999    0.00101323   -0.00225645
O   -1.95274814    1.20895043   -0.01643376    0.04469947   -0.02881211   -0.00157551
O   -2.01662990   -1.25853306   -0.02444615   -0.01566158    0.00066141   -0.00503788
C   -0.76791676    0.70899748    0.03553149   -0.02846727    0.04411635    0.00063262
C   -0.84677097   -0.79623788    0.03443897   -0.01309015   -0.00501391    0.01540640
C    0.32022091    1.54284143    0.03992389   -0.02303589    0.00149223    0.00929184
C    0.37636366   -1.57850015   -0.05517572   -0.00411364    0.00287093   -0.01675546
C    1.74177339    1.30201034   -0.08774464    0.02537768    0.00583875   -0.02234547
C    1.71828561   -1.22006832    0.02186937    0.00132978   -0.02121270    0.00894369
H   -0.00737465    2.56191333    0.09543777   -0.00348740   -0.01506148    0.00403389
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H    2.44858151   -2.02952474   -0.09016018    0.00722274    0.00106820   -0.00698911
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   15
   -420.53564780
H   -2.58646927    0.44293053   -0.05356179   -0.00207007    0.00274444   -0.00194365
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O   -2.01430887   -1.26067760   -0.02370203   -0.01600735   -0.00015376   -0.00564165
C   -0.76710016    0.70713679    0.03616975   -0.02826693    0.04178266    0.00038753
C   -0.84613377   -0.79270987    0.03828209   -0.01191686   -0.00269411    0.01695085
C    0.32258080    1.54067621    0.03974016   -0.01990566    0.00396849    0.00901709
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C    1.74079437    1.30097069   -0.08812845    0.02591754    0.00715911   -0.02282842
C    1.71408971   -1.22271254    0.02236225   -0.00321598   -0.02779892    0.00826726
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H    2.45125828   -2.02322331   -0.07925597    0.00703111    0.00335369   -0.00606916
C    2.36468219    0.07725505    0.05178315    0.01616106    0.02323673    0.00513458
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   15
   -420.53556192
H   -2.58660188    0.44767043   -0.04935857   -0.00062352    0.00439953   -0.00163917
O   -1.95212467    1.20912289   -0.02091225    0.03952884   -0.03217513   -0.00219805
O   -2.01180633   -1.26282043   -0.02289395   -0.01627985   -0.00095276   -0.00620281
C   -0.76585747    0.70464595    0.03680208   -0.02702345    0.03812890    0.00019804
C   -0.84531640   -0.78914145    0.04186906   -0.01074052   -0.00010109    0.01836877
C    0.32524046    1.53845340    0.03942026   -0.01580706    0.00447318    0.00860805
C    0.37536737   -1.56940528   -0.06055572    0.00012008    0.01492240   -0.01642798
C    1.73942469    1.29982344   -0.08816751    0.02552102    0.00793148   -0.02306054
C    1.70994224   -1.22493738    0.02273028   -0.00761770   -0.03362572    0.00746958
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H    0.23069924   -2.65281409   -0.05539223    0.00733520   -0.00300062    0.00509908
H    2.31396002    2.20791382   -0.13572035   -0.00903865   -0.00435539   -0.00012671
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C    2.36409970    0.07921865    0.05051660    0.02251582    0.02639765    0.00514447
H    3.42412033   -0.02940591    0.17822324   -0.01179104   -0.01018241    0.00557518
   15
   -420.53567858
H   -2.58662121    0.45162348   -0.04485977    0.00069429    0.00575322   -0.00135925
O   -1.95250230    1.20974803   -0.02311590    0.03536372   -0.03253871   -0.00254504
O   -2.00911925   -1.26495248   -0.02201555   -0.01640574   -0.00173957   -0.00671479
C   -0.76420743    0.70158010    0.03743133   -0.02476651    0.03324765    0.00007878
C   -0.84433657   -0.78557187    0.04517846   -0.00962719    0.00275894    0.01964319
C    0.32813806    1.53616541    0.03897041   -0.01084339    0.00296164    0.00804149
C    0.37488322   -1.56515062   -0.06287138    0.00253678    0.02013811   -0.01587897
C    1.73767050    1.29855738   -0.08785818    0.02399179    0.00776931   -0.02308733
C    1.70590984   -1.22665508    0.02298543   -0.01191816   -0.03841627    0.00659904
H    0.00064130    2.55398086    0.10862724   -0.00294983   -0.01534327    0.00455820
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H    2.30887406    2.20650238   -0.12504085   -0.01026893   -0.00570967    0.00036631
H    2.45289595   -2.01282573   -0.05434330    0.00612432    0.00750181   -0.00413873
C    2.36317860    0.08078382    0.04917238    0.02736487    0.02899551    0.00507261
H    3.41713652   -0.02558543    0.17792010   -0.01618444   -0.00946478    0.00496535
   15
   -420.53605637
H   -2.58675981    0.45454868   -0.04011601    0.00164470    0.00656984   -0.00110090
O   -1.95328057    1.21074123   -0.02529069    0.03063205   -0.03179081   -0.00290217
O   -2.00624624   -1.26706486   -0.02106104   -0.01634595   -0.00248262   -0.00717232
C   -0.76218405    0.69801288    0.03805929   -0.02159267    0.02726924    0.00003631
C   -0.84321111   -0.78204429    0.04819102   -0.00860823    0.00583719    0.02076288
C    0.33119881    1.53383473    0.03839914   -0.00522458   -0.00025993    0.00732719
C    0.37436066   -1.56119917   -0.06494721    0.00498634    0.02429767   -0.01511042
C    1.73555507    1.29717527   -0.08720002    0.02123275    0.00644548   -0.02291914
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   15
   -420.53671498
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O   -2.00318803   -1.26914911   -0.02002523   -0.01605278   -0.00317390   -0.00756797
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   15
   -420.53751789
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O   -1.99994798   -1.27119738   -0.01890365   -0.01548846   -0.00380898   -0.00789415
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   15
   -420.53829195
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O   -1.99653253   -1.27320252   -0.01769257   -0.01463653   -0.00434873   -0.00815090
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C   -0.83910408   -0.77218960    0.05529230   -0.00640068    0.01576681    0.02301975
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C    1.72754123    1.29261100   -0.08316821    0.00696680   -0.00290417   -0.02167989
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   15
   -420.53890896
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O   -1.99295133   -1.27515839   -0.01638910   -0.01348667   -0.00478709   -0.00833358
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C    1.72455306    1.29110632   -0.08115923    0.00124139   -0.00637529   -0.02114198
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H    2.43844156   -2.01293529    0.01801487    0.00614655    0.00811386    0.00051366
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   15
   -420.53929978
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O   -1.98921739   -1.27706005   -0.01499116   -0.01205016   -0.00511014   -0.00844249
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C    0.36999447   -1.54746186   -0.07220828    0.01240078    0.02439344   -0.00977298
C    1.72154595    1.28969722   -0.07883064   -0.00435416   -0.00918548   -0.02056835
C    1.68760767   -1.22372830    0.02291208   -0.03251657   -0.03697876    0.00101847
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   15
   -420.53942422
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C    1.71860410    1.28842572   -0.07619111   -0.00948529   -0.01095516   -0.01995890
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   15
   -420.53933633
H   -2.59328173    0.44904169   -0.00398541   -0.00364506   -0.00301269    0.00102681
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O   -1.98135962   -1.28068753   -0.01190780   -0.00837917   -0.00537500   -0.00843409
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C   -0.83228363   -0.76258780    0.05990319   -0.00500536    0.02694220    0.02315299
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C    1.68495897   -1.21793049    0.02261385   -0.03355547   -0.02581193   -0.00073601
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H    0.15265351   -2.60155466   -0.21085656    0.00126050    0.00203848   -0.00244364
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   15
   -420.53913846
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C   -0.83037819   -0.76111222    0.06017459   -0.00469974    0.02854977    0.02266124
C    0.35144192    1.52054799    0.03087315    0.02949168   -0.02016351    0.00206514
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C    1.71321392    1.28638238   -0.07001691   -0.01728709   -0.01056788   -0.01858063
C    1.68439391   -1.21440186    0.02247487   -0.03221739   -0.01902992   -0.00151974
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   15
   -420.53887955
H   -2.59236049    0.44713192    0.00561810   -0.00417919   -0.00523944    0.00173955
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C   -0.82840177   -0.76006741    0.06010362   -0.00432230    0.02944008    0.02196770
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C    1.71088310    1.28560457   -0.06650311   -0.01958191   -0.00833716   -0.01778878
C    1.68431435   -1.21058606    0.02235873   -0.02956180   -0.01177726   -0.00219439
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C    2.33666596    0.07012575    0.03305687   -0.01465690    0.01758035   -0.00117054
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   15
   -420.53856955
H   -2.59078295    0.44750350    0.00998232   -0.00360145   -0.00544186    0.00202584
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C   -0.82636014   -0.75946675    0.05970071   -0.00383703    0.02952223    0.02109601
C    0.35297306    1.52003921    0.02853120    0.02928788   -0.01382463    0.00184259
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C    1.70884688    1.28495137   -0.06272045   -0.02066951   -0.00490550   -0.01691449
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H    3.44572892    0.09207031    0.11788919    0.01726715    0.00522740    0.00365151
   15
   -420.53814264
H   -2.58856483    0.44884584    0.01398281   -0.00248992   -0.00501742    0.00224580
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O   -1.96471877   -1.28722794   -0.00460782    0.00129490   -0.00436936   -0.00765147
C   -0.73347756    0.65704542    0.04429508    0.02474366   -0.04912848    0.00347441
C   -0.82426065   -0.75931139    0.05897904   -0.00321270    0.02873246    0.02006098
C    0.35307158    1.52012470    0.02731780    0.02777448   -0.00961102    0.00182162
C    0.35945835   -1.54171899   -0.07615835    0.00088803    0.00418903   -0.00381441
C    1.70712172    1.28437117   -0.05868213   -0.02056524   -0.00052716   -0.01596042
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C    2.33145943    0.06326283    0.02978834   -0.01591962    0.00570773   -0.00104977
H    3.43941108    0.10342713    0.10740127    0.01475122    0.00702851    0.00281533
   15
   -420.53761711
H   -2.58590470    0.45108321    0.01758029   -0.00094812   -0.00402244    0.00238157
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O   -1.96052296   -1.28872876   -0.00255869    0.00397496   -0.00384085   -0.00731357
C   -0.73200497    0.65602002    0.04467262    0.02698838   -0.05147715    0.00391163
C   -0.82211278   -0.75958937    0.05795422   -0.00243200    0.02704795    0.01888580
C    0.35275073    1.52035563    0.02607687    0.02566684   -0.00551344    0.00179335
C    0.35741724   -1.54122411   -0.07652292   -0.00238595    0.00363030   -0.00249112
C    1.70570619    1.28379827   -0.05440260   -0.01938107    0.00440883   -0.01492268
C    1.68649683   -1.19852500    0.02223918   -0.01477062    0.01056577   -0.00335678
H    0.09878768    2.56588202    0.06872807    0.00855114   -0.00692653    0.00298715
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   15
   -420.53686813
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   15
   -420.53596646
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   15
   -420.53503618
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   15
   -420.53417360
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   15
   -420.53358589
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   15
   -420.53335441
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   15
   -420.53354973
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O   -1.93409119   -1.29842581    0.01384271    0.02096345    0.00060588   -0.00413953
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C    1.69454332   -1.18019358    0.02357999    0.02751074    0.04586291   -0.00104304
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H    2.27912279   -2.08146758    0.14752610   -0.01453065   -0.00000380    0.00802614
C    2.31680282    0.03939561    0.01724320   -0.00260097   -0.03097961   -0.00222099
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   15
   -420.53408025
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O   -1.93106821   -1.29978363    0.01641762    0.02255296    0.00102915   -0.00363972
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C   -0.80507586   -0.77195021    0.04123826    0.00802116   -0.00825140    0.00745028
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C    2.31514267    0.03801172    0.01576329   -0.00781150   -0.03152525   -0.00282121
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   15
   -420.53487375
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   15
   -420.53583171
H   -2.58954855    0.47676797    0.02944667    0.00040225   -0.00149094    0.00291420
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O   -1.92580255   -1.30253742    0.02168558    0.02459126    0.00147627   -0.00263803
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C    0.33448296    1.52813457    0.01251225    0.00340494   -0.03354722    0.00089752
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C    1.69351639   -1.18145124    0.02453857    0.03026381    0.04919565    0.00072504
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   15
   -420.53683641
H   -2.59364571    0.47844039    0.02805269   -0.00145384   -0.00283594    0.00300587
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C   -0.80008806   -0.77666366    0.03250046    0.01161666   -0.02058833    0.00359741
C    0.33189038    1.53059735    0.01107488    0.00161821   -0.03452905    0.00087179
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C    1.69225655   -1.18334740    0.02484807    0.02784201    0.04829614    0.00133332
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H    2.28153949   -2.08647854    0.13134812   -0.01347883   -0.00163109    0.00751065
C    2.31127399    0.03664056    0.01161275   -0.02725325   -0.02494483   -0.00437337
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   15
   -420.53794820
H   -2.59748658    0.48061820    0.02611845   -0.00297704   -0.00378206    0.00302719
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O   -1.92164596   -1.30535613    0.02707321    0.02487252    0.00129560   -0.00163512
C   -0.74953217    0.69612103    0.04304701    0.01685200   -0.00252803    0.00715374
C   -0.79875425   -0.77768747    0.02945410    0.01250808   -0.02327985    0.00246132
C    0.32927303    1.53357977    0.00962444   -0.00006772   -0.03349657    0.00074931
C    0.34987079   -1.54494933   -0.08352842   -0.03249256    0.00975279    0.00420484
C    1.70323860    1.26247667    0.00929715   -0.00532435   -0.01256152    0.00146497
C    1.69057771   -1.18597239    0.02513738    0.02380660    0.04625599    0.00197853
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H    2.39376786    2.12230474   -0.00635831    0.01030279    0.00428836    0.00091953
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   15
   -420.53907329
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   15
   -420.54018000
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   15
   -420.54121865
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   15
   -420.54198598
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   15
   -420.54240533
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   15
   -420.54233361
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   15
   -420.54184384
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   15
   -420.54091751
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O   -1.91522233   -1.31662944    0.04890305    0.01143213   -0.00616743    0.00250105
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   15
   -420.53979399
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   15
   -420.53864157
H   -2.60960929    0.52206367   -0.01726798    0.00399068    0.00661982    0.00049454
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   15
   -420.53764100
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C    2.32905383    0.04187173    0.00314610    0.02748185    0.02388245   -0.01178919
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   15
   -420.53692162
H   -2.61459461    0.52321715   -0.02861746    0.00234128    0.00500496    0.00014403
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C   -0.79794504   -0.76354402   -0.00587034    0.00477310    0.00142561   -0.00820843
C    0.30402763    1.58549403   -0.00639742   -0.00793049    0.01082691   -0.00395420
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C    1.67362317   -1.24833878    0.02253678   -0.05436165   -0.02968423    0.01375241
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H    2.42131783   -2.03805236   -0.03731879    0.00586110    0.00700818   -0.00230064
C    2.33058138    0.04072391    0.00335902    0.03046172    0.02282987   -0.01200116
H    3.38606537   -0.07484856   -0.06934163   -0.01769211   -0.01155711   -0.00243596
   15
   -420.53654074
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   15
   -420.53635719
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   15
   -420.53639968
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   15
   -420.53658957
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   15
   -420.53691788
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   15
   -420.53735762
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   15
   -420.53790476
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   15
   -420.53849562
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   15
   -420.53901298
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   15
   -420.53941243
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   15
   -420.53956861
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   15
   -420.53948195
H   -2.62422636    0.51892472   -0.08768048    0.00343833    0.00334673   -0.00215841
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C    2.32677157    0.01311142    0.01837061    0.00246878   -0.02658919   -0.00620123
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   15
   -420.53915406
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   15
   -420.53871666
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O   -1.91937560   -1.31462097    0.08773760    0.00076118   -0.01637743    0.00719210
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C   -0.80319197   -0.75534980   -0.02498706   -0.01699058    0.02321892   -0.01151696
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   15
   -420.53825180
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C   -0.76058674    0.74193176   -0.02095738    0.02620504   -0.01175128    0.00683977
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   15
   -420.53785381
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O   -1.91972553   -1.31048127    0.09051504    0.00185361   -0.01415784    0.00693037
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C    1.76306253   -1.27843464   -0.02959374    0.03904370    0.01767013    0.01380760
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   15
   -420.53753858
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C    1.68375977    1.27765891    0.09111706    0.00228182    0.02835652    0.01208883
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H    2.34257798    2.13199395    0.11166751   -0.00602711   -0.00305926   -0.00177143
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   15
   -420.53731627
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C   -0.79742192   -0.76587072   -0.02410357   -0.01456406    0.00921159   -0.00958042
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C    1.68230939    1.27710310    0.09000501   -0.00066149    0.02579480    0.01055253
C    1.77229224   -1.28196588   -0.04102681    0.04804841    0.01613446    0.00905759
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H    2.34962152    2.13021652    0.12485037   -0.00333668   -0.00095851   -0.00129337
H    2.43141171   -2.14592778   -0.13980894   -0.00462194   -0.00549485   -0.00479274
C    2.31981529    0.01168387    0.03173370    0.01413212   -0.03276076   -0.00148333
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   15
   -420.53711379
H   -2.63501945    0.50641237   -0.09926603   -0.00142571   -0.00256990   -0.00340797
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C   -0.79539356   -0.76899688   -0.02350048   -0.01301805    0.00479180   -0.00898488
C    0.31173573    1.62498366   -0.01495867   -0.00053768    0.00879701   -0.00362662
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C    1.68086965    1.27615842    0.08873358   -0.00412061    0.02227168    0.00886847
C    1.77584985   -1.28410575   -0.04696716    0.05116325    0.01381338    0.00643864
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C    2.31793766    0.01322797    0.03412239    0.01061518   -0.03019447   -0.00039373
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   15
   -420.53693494
H   -2.63761071    0.50419843   -0.09877507   -0.00276977   -0.00392680   -0.00357296
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O   -1.92070005   -1.30039562    0.09514269    0.00235607   -0.00878707    0.00619845
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C   -0.79316884   -0.77219527   -0.02276158   -0.01108208    0.00016800   -0.00835440
C    0.31410334    1.62410263   -0.01468990    0.00456705    0.00409680   -0.00325191
C    0.39344147   -1.64174094   -0.07386178   -0.01758805   -0.02364370   -0.00865225
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C    2.31590135    0.01522758    0.03651703    0.00560582   -0.02677653    0.00069853
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   15
   -420.53679248
H   -2.63971002    0.50268337   -0.09764194   -0.00367326   -0.00472118   -0.00366049
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C    1.78061787   -1.28896362   -0.05909859    0.05399796    0.00724575    0.00094371
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C    2.31378125    0.01763112    0.03890111   -0.00020028   -0.02255696    0.00177350
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   15
   -420.53670668
H   -2.64115621    0.50200905   -0.09585048   -0.00404955   -0.00486041   -0.00367822
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O   -1.92134564   -1.29469200    0.09702597    0.00129032   -0.00597374    0.00576116
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C   -0.78825320   -0.77852785   -0.02091492   -0.00608598   -0.00930923   -0.00700660
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C    1.67713338    1.27155273    0.08422653   -0.01357797    0.01010364    0.00324619
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H    2.43154889   -2.15736938   -0.11245375   -0.00823445   -0.00293332   -0.00139152
C    2.31166415    0.02037477    0.04125840   -0.00604011   -0.01756018    0.00282380
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   15
   -420.53672439
H   -2.64188077    0.50219955   -0.09339780   -0.00388775   -0.00430781   -0.00361601
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O   -1.92169378   -1.29173057    0.09786833    0.00040011   -0.00460133    0.00552163
C   -0.76495078    0.74453354   -0.05644118    0.01922880   -0.00935932   -0.00186559
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C    0.39633753   -1.64050689   -0.06325742   -0.02072158   -0.02478955   -0.00219310
C    1.67624047    1.26963058    0.08258753   -0.01535207    0.00659643    0.00140080
C    1.78214585   -1.29425518   -0.07128632    0.05173625   -0.00027214   -0.00470627
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H    2.43507655   -2.15870819   -0.10461267   -0.00775226   -0.00310626   -0.00058166
C    2.30963763    0.02338307    0.04357301   -0.01130231   -0.01185110    0.00385276
H    3.39776940    0.17788621    0.07977464    0.00502484    0.01424177   -0.00047064
   15
   -420.53682801
H   -2.64191269    0.50315640   -0.09029514   -0.00320051   -0.00313861   -0.00348841
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O   -1.92204626   -1.28871693    0.09864807   -0.00069400   -0.00326676    0.00527216
C   -0.76715270    0.74563635   -0.06094175    0.01557857   -0.00787727   -0.00317213
C   -0.78297553   -0.78429925   -0.01864496    0.00010116   -0.01841338   -0.00556487
C    0.32212118    1.62032637   -0.01316982    0.02347494    0.00036599   -0.00197360
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C    1.67557835    1.26760803    0.08092724   -0.01605480    0.00367006   -0.00032776
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H    2.38557871    2.10918638    0.20455791    0.01071078    0.00715681    0.00288355
H    2.43999103   -2.15948162   -0.09666694   -0.00665547   -0.00369105    0.00023287
C    2.30778068    0.02656986    0.04582935   -0.01549687   -0.00555406    0.00487777
H    3.40123948    0.18224721    0.09072494    0.00850907    0.01488400   -0.00010400
   15
   -420.53700655
H   -2.64137435    0.50467127   -0.08656536   -0.00209938   -0.00149243   -0.00330598
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O   -1.92239073   -1.28566619    0.09936802   -0.00195222   -0.00198719    0.00500829
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   15
   -420.53721807
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   15
   -420.53740497
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O   -1.92299744   -1.27951067    0.10064069   -0.00474082    0.00036506    0.00443551
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   15
   -420.53742656
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O   -1.92322817   -1.27643256    0.10119990   -0.00614284    0.00142894    0.00412442
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C    0.32467435    1.61601140   -0.01119622    0.03226362    0.01709274    0.00032668
C    0.40727457   -1.63132653   -0.04533466   -0.01475393   -0.01250586    0.00775551
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   15
   -420.53738486
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O   -1.92338928   -1.27337057    0.10171235   -0.00746340    0.00239980    0.00379613
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C    1.67551090    1.25718233    0.07310902   -0.00420058   -0.00161143   -0.00566313
C    1.77011444   -1.30827145   -0.10478686    0.01903360   -0.02230496   -0.02083663
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   15
   -420.53717260
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C   -0.76877277   -0.79317339   -0.01019813    0.01803318   -0.03604225   -0.00066680
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C    0.41341659   -1.62595688   -0.03878502   -0.00631180   -0.00076116    0.01110058
C    1.67589212    1.25514461    0.07175484   -0.00037664   -0.00174826   -0.00615099
C    1.76652069   -1.30975564   -0.10949307    0.01179974   -0.02632274   -0.02299608
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C    2.30222441    0.04379146    0.05724838   -0.01059133    0.03460663    0.01170060
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   15
   -420.53690327
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O   -1.92344467   -1.26733811    0.10261204   -0.00961318    0.00408878    0.00308440
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C   -0.76712682   -0.79293405   -0.00868033    0.01972731   -0.03684482    0.00020628
C    0.32162489    1.61038419   -0.00973478    0.03132089    0.02416306    0.00216508
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C    1.67627963    1.25313376    0.07049366    0.00298736   -0.00222732   -0.00663484
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   15
   -420.53662626
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O   -1.92331463   -1.26438679    0.10300737   -0.01034462    0.00480216    0.00269884
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C   -0.76577842   -0.79213849   -0.00716566    0.02081856   -0.03695162    0.00108132
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H    3.37183183    0.12701425    0.17542139   -0.00717627    0.00641191    0.00024115
   15
   -420.53640968
H   -2.63881120    0.50304396   -0.03833579   -0.00097680    0.00272741   -0.00169471
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O   -1.92306751   -1.26148988    0.10337210   -0.01079996    0.00543264    0.00229820
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C    0.31721677    1.60488655   -0.00890541    0.02843899    0.01832726    0.00236229
C    0.42312630   -1.61803891   -0.03027214    0.01006768    0.01577453    0.01530101
C    1.67688466    1.24923237    0.06828185    0.00690540   -0.00522896   -0.00804478
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   15
   -420.53629432
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O   -1.92269815   -1.25865451    0.10371077   -0.01095885    0.00597894    0.00188015
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C    0.31435609    1.60169525   -0.00854412    0.02625087    0.01277078    0.00206248
C    0.42617176   -1.61577361   -0.02787067    0.01561157    0.01934077    0.01638217
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   15
   -420.53625320
H   -2.63914089    0.49584885   -0.02249162   -0.00429939   -0.00050914   -0.00102095
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C   -0.76363456   -0.78645058   -0.00277149    0.02023969   -0.03316747    0.00359647
C    0.31109935    1.59831190   -0.00821375    0.02337468    0.00636376    0.00155513
C    0.42898162   -1.61379900   -0.02571666    0.02079014    0.02149286    0.01726033
C    1.67709409    1.24566147    0.06656128    0.00654483   -0.01094206   -0.01034919
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H    0.14732352   -2.67763957   -0.09359122   -0.00239226   -0.00724631   -0.00490923
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C    2.30195179    0.04535626    0.06209821    0.00509821    0.04680973    0.01558718
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   15
   -420.53620916
H   -2.63829548    0.49224140   -0.01426206   -0.00554095   -0.00180035   -0.00061900
O   -2.02343088    1.27743522   -0.04630174    0.00063994    0.00744920    0.00548920
O   -1.92158913   -1.25319195    0.10432892   -0.01034678    0.00683566    0.00101911
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C   -0.76354411   -0.78351772   -0.00139894    0.01884031   -0.03061572    0.00435633
C    0.30749019    1.59483247   -0.00790674    0.01968553   -0.00015417    0.00093689
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C    1.67704677    1.24410120    0.06592648    0.00528046   -0.01410585   -0.01170506
C    1.74468796   -1.30814316   -0.12963468   -0.02144529   -0.04831948   -0.02885444
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H    2.49892448   -2.08986118   -0.04767096    0.00505337    0.00378057    0.00802370
C    2.30177710    0.04359951    0.06238822    0.00380233    0.04519799    0.01523363
H    3.36385436    0.06249106    0.21584579   -0.01082243   -0.00025753    0.00049925
   15
   -420.53618714
H   -2.63645989    0.48895122   -0.00592109   -0.00627329   -0.00261475   -0.00020201
O   -2.02031259    1.27485128   -0.04692140    0.00524642    0.00657426    0.00522649
O   -1.92085639   -1.25057450    0.10461817   -0.00958984    0.00717605    0.00057185
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C   -0.76373785   -0.78012266   -0.00009220    0.01691334   -0.02747653    0.00506253
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   15
   -420.53616441
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O   -1.92001516   -1.24803834    0.10490092   -0.00854030    0.00744598    0.00012834
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   15
   -420.53614332
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O   -1.91907729   -1.24558660    0.10518221   -0.00722373    0.00766497   -0.00031090
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   15
   -420.53621646
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C    0.43711609   -1.60861950   -0.01901052    0.03526309    0.01058331    0.01856689
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   15
   -420.53631229
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C    0.43725268   -1.60828888   -0.01850947    0.03534623    0.00549401    0.01835849
C    1.67602232    1.24011341    0.06575427    0.00088736   -0.01745223   -0.01560247
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   15
   -420.53647451
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O   -1.91584661   -1.23875993    0.10606669   -0.00190933    0.00805720   -0.00156172
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C   -0.76774546   -0.75814814    0.00512101    0.00235610   -0.00458807    0.00737270
C    0.28244777    1.57657226   -0.00607165   -0.01825889   -0.01744662   -0.00104149
C    0.43685589   -1.60804129   -0.01828590    0.03459060    0.00036405    0.01807897
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   15
   -420.53661876
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C    0.27860797    1.57437665   -0.00571896   -0.02576573   -0.01530711   -0.00071852
C    0.43593697   -1.60779972   -0.01833563    0.03313539   -0.00432904    0.01776346
C    1.67546198    1.24040545    0.06728314    0.00304247   -0.01010916   -0.01446606
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   15
   -420.53668963
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C    1.73209818   -1.26860274   -0.13316876   -0.01846877   -0.01214471   -0.01997102
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   15
   -420.53658388
H   -2.59242093    0.47203040    0.05717133    0.00409582    0.00479681    0.00167747
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O   -1.91243209   -1.23275421    0.10710893    0.00470229    0.00825513   -0.00261599
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C   -0.77095625   -0.74355371    0.00696773   -0.00711731    0.01266487    0.00750501
C    0.27220411    1.57062690   -0.00498895   -0.03948807   -0.00813657    0.00035513
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C    1.73208200   -1.26155755   -0.13199781   -0.01459102   -0.00060831   -0.01768668
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C    2.30362964    0.00634345    0.05714792   -0.01607422   -0.02065532    0.00065195
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   15
   -420.53625523
H   -2.58707096    0.46826962    0.06398984    0.00490116    0.00494394    0.00190164
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O   -1.91136645   -1.23093869    0.10751063    0.00698683    0.00831676   -0.00291025
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C    1.73228552   -1.25450368   -0.13055973   -0.00995183    0.01134841   -0.01516152
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C    2.30489555    0.00188344    0.05616446   -0.01402288   -0.03084838   -0.00065565
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   15
   -420.53575442
H   -2.58259377    0.46362902    0.07046432    0.00502496    0.00440195    0.00223509
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O   -1.91038002   -1.22921752    0.10794532    0.00922062    0.00840329   -0.00317646
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C   -0.77264148   -0.73463449    0.00763330   -0.01229322    0.02427393    0.00701971
C    0.26816939    1.56736921   -0.00428026   -0.04940676   -0.00103371    0.00137992
C    0.42758955   -1.60568462   -0.02116861    0.02309966   -0.01364845    0.01623040
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C    1.73263872   -1.24762120   -0.12889263   -0.00466639    0.02313140   -0.01246248
H    0.04523184    2.60094828    0.15528987    0.00456532   -0.01330151    0.00308128
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H    2.27166364    2.10945460    0.31690388   -0.00728550   -0.00142041    0.00226723
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C    2.30637250   -0.00211075    0.05519062   -0.01120984   -0.04055196   -0.00159700
H    3.37277447   -0.06526276    0.28648635    0.00070099   -0.01043015    0.00653624
   15
   -420.53509622
H   -2.57901471    0.45820698    0.07653520    0.00458042    0.00320545    0.00268504
O   -1.99542253    1.24611482   -0.05724671    0.01591283   -0.00633759    0.00379367
O   -1.90949810   -1.22759161    0.10841598    0.01134988    0.00848071   -0.00340269
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C   -0.77322416   -0.73068157    0.00780480   -0.01430612    0.02979426    0.00662137
C    0.26723724    1.56579006   -0.00395351   -0.05223184    0.00077220    0.00162229
C    0.42452465   -1.60469269   -0.02250648    0.02009762   -0.01387201    0.01563136
C    1.67267501    1.24232452    0.07456041    0.01296545    0.01620310   -0.00731725
C    1.73306186   -1.24108759   -0.12703725    0.00107452    0.03416288   -0.00967069
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H    2.26504399    2.10947105    0.31157907   -0.00966332   -0.00379542    0.00124668
H    2.45397880   -2.07343772   -0.17357942    0.00645917   -0.00417891    0.00123355
C    2.30801805   -0.00549301    0.05424215   -0.00782819   -0.04934152   -0.00255147
H    3.36680692   -0.06720786    0.28636032   -0.00409514   -0.01016527    0.00567457
   15
   -420.53448766
H   -2.57625332    0.45221484    0.08212247    0.00366358    0.00156314    0.00322185
O   -1.99424255    1.24389824   -0.05847573    0.01585218   -0.00421118    0.00336271
O   -1.90874479   -1.22606191    0.10892519    0.01331967    0.00859161   -0.00358543
C   -0.77867138    0.72717476   -0.11977318    0.00135654    0.00659977   -0.01496956
C   -0.77359113   -0.72717871    0.00787633   -0.01583424    0.03495430    0.00612323
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   15
   -420.53405854
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   15
   -420.53389388
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   15
   -420.53411473
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   15
   -420.53460832
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   15
   -420.53536708
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   15
   -420.53623953
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   15
   -420.53722392
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   15
   -420.53820128
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   15
   -420.53912324
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   15
   -420.53989003
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C   -0.76500989   -0.72827571    0.00515372    0.00440405    0.03383372   -0.00074689
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   15
   -420.54047297
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C   -0.76360458   -0.73199707    0.00477026    0.00964052    0.02666931   -0.00139682
C    0.30617106    1.55463112   -0.00126764    0.01075265   -0.00787332    0.00310418
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H    3.42726250    0.02609624    0.21237818    0.01294145   -0.00183740    0.00740744
   15
   -420.54077972
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C   -0.76234527   -0.73612055    0.00440793    0.01508499    0.01856483   -0.00205289
C    0.31097475    1.55494835   -0.00118356    0.01685904   -0.00275355    0.00372589
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   15
   -420.54072973
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   15
   -420.54026967
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C    1.65896229    1.22989451    0.11043310   -0.02917631   -0.01898017    0.00076552
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   15
   -420.53942926
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O   -1.92014310   -1.21665117    0.12143768    0.00900613    0.01480772   -0.00098299
C   -0.75369689    0.69097164   -0.09010837   -0.00177513   -0.02811445   -0.00895306
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   15
   -420.53831270
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C    0.32695431    1.55586216   -0.00146625    0.03144732    0.01374645    0.00438341
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C    1.66227501    1.23087748    0.11588027   -0.02533927   -0.01713717    0.00303480
C    1.69893895   -1.23517348   -0.09585586   -0.02132109   -0.00801859    0.00917351
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   15
   -420.53711962
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C    0.32986500    1.55568860   -0.00170412    0.03293790    0.01363187    0.00402712
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C    1.66452190    1.23176504    0.11854357   -0.02308686   -0.01665625    0.00403094
C    1.69576330   -1.23786687   -0.09488474   -0.02736553   -0.01267131    0.00918935
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   15
   -420.53606969
H   -2.56829144    0.39456711    0.03749826   -0.00199618    0.00087961    0.00308649
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O   -1.92662579   -1.21867012    0.12465125    0.00564891    0.01567857    0.00048170
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C   -0.76228648   -0.76207392    0.00324439    0.04017967   -0.03155546   -0.00617401
C    0.33227855    1.55531184   -0.00200273    0.03370764    0.01113669    0.00354201
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C    1.66711812    1.23290533    0.12114604   -0.02107276   -0.01692439    0.00491839
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   15
   -420.53528402
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C    1.67003345    1.23430254    0.12367428   -0.01949159   -0.01806924    0.00570348
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   15
   -420.53491338
H   -2.57201134    0.38511692    0.01779135   -0.00531729   -0.00184935    0.00258473
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O   -1.93129049   -1.22089928    0.12677563    0.00443798    0.01571252    0.00149760
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C   -0.76658135   -0.76818753    0.00349085    0.04027913   -0.04123905   -0.00742723
C    0.33557954    1.55412918   -0.00275210    0.03284357    0.00052511    0.00241311
C    0.35720775   -1.54637549   -0.07708833   -0.02053480    0.04475106   -0.00605614
C    1.67324407    1.23597392    0.12611640   -0.01838537   -0.02000103    0.00640859
C    1.68898457   -1.24453093   -0.09278249   -0.03786327   -0.02555882    0.00753930
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   15
   -420.53492930
H   -2.57258131    0.38077115    0.00721533   -0.00636738   -0.00281291    0.00217853
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   15
   -420.53529069
H   -2.57201341    0.37692590   -0.00375128   -0.00683622   -0.00336006    0.00167315
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C   -0.77328317   -0.77183759    0.00418501    0.03461891   -0.04485001   -0.00838594
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C    1.68722984   -1.24715304   -0.09196419   -0.03770783   -0.03276272    0.00526140
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   15
   -420.53590342
H   -2.57022416    0.37367938   -0.01501770   -0.00664129   -0.00347130    0.00109328
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O   -1.93866427   -1.22557001    0.12982078    0.00414197    0.01474725    0.00296732
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C   -0.77744354   -0.77265597    0.00471882    0.02981839   -0.04432704   -0.00872871
C    0.33692355    1.55256674   -0.00412713    0.02416872   -0.01861468    0.00059924
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C    1.68449914    1.24294785    0.13282041   -0.01601871   -0.02662567    0.00849232
C    1.68721113   -1.24774765   -0.09168339   -0.03572717   -0.03552081    0.00395208
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H    2.37169826   -2.07318181   -0.28328305    0.00096757    0.00176055   -0.00604617
C    2.35103597    0.07143191    0.04914821    0.02152501    0.05579107    0.00771551
H    3.42699991    0.15768102    0.00495353   -0.00455429    0.01003986   -0.00283080
   15
   -420.53675245
H   -2.56724721    0.37105027   -0.02647988   -0.00584052   -0.00310026    0.00046740
O   -1.98409983    1.18902335   -0.09344599    0.00148949   -0.01122253    0.00161430
O   -1.94121590   -1.22746767    0.13077576    0.00434581    0.01411031    0.00342583
C   -0.74174735    0.71074688   -0.05671579    0.01237686    0.01055022   -0.00252152
C   -0.78205345   -0.77280592    0.00538447    0.02394730   -0.04234403   -0.00896617
C    0.33656912    1.55248520   -0.00461603    0.01931948   -0.02319468   -0.00009901
C    0.35659310   -1.54622425   -0.08612535   -0.01358243    0.04101194   -0.00540127
C    1.68875156    1.24603592    0.13481257   -0.01469600   -0.02750703    0.00927353
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   15
   -420.53773240
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   15
   -420.53881491
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   15
   -420.53989247
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   15
   -420.54093891
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   15
   -420.54181232
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   15
   -420.54240249
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   15
   -420.54256873
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C   -0.81850945   -0.75988208    0.01386223   -0.02377850   -0.00062911   -0.00829190
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   15
   -420.54228453
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C   -0.82305909   -0.75713572    0.01560062   -0.02861350    0.00702020   -0.00796603
C    0.33080267    1.56490633   -0.00732688   -0.02540860   -0.00376363   -0.00829134
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   15
   -420.54152488
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   15
   -420.54038125
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   15
   -420.53907400
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O   -1.97287300   -1.25587470    0.13773450   -0.00001464   -0.00395192    0.00735449
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C   -0.83389933   -0.74997978    0.02151587   -0.03727893    0.02832968   -0.00677631
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C    2.34039270    0.03199389    0.03515585    0.00393614   -0.02902568    0.00322941
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   15
   -420.53775666
H   -2.53004370    0.34434366   -0.14303510    0.00335357   -0.00525769   -0.00470340
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C    0.33426890    1.57499950   -0.00626847   -0.02814666    0.00630069   -0.01027770
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C    1.71633671   -1.21647588   -0.08789335    0.01636507    0.02328821   -0.00615474
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   15
   -420.53652266
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O   -1.97906015   -1.26135796    0.13805912   -0.00429654   -0.00826022    0.00783140
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   15
   -420.53547391
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O   -1.98209321   -1.26397115    0.13808947   -0.00680431   -0.01023579    0.00799393
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C   -0.83976644   -0.74661199    0.02834896   -0.03723010    0.04377900   -0.00521189
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   15
   -420.53457207
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O   -1.98504891   -1.26646841    0.13802919   -0.00950037   -0.01201009    0.00809362
C   -0.75079671    0.71913315    0.00153404   -0.00517843    0.00058561    0.00853763
C   -0.84058444   -0.74672027    0.03079534   -0.03553937    0.04700359   -0.00460098
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H    0.12030455    2.64594278   -0.11565736    0.00588388    0.00373654   -0.00359850
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   15
   -420.53384985
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O   -1.98789672   -1.26882964    0.13787716   -0.01232582   -0.01355102    0.00812170
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C   -0.84086594   -0.74753787    0.03331124   -0.03316202    0.04910472   -0.00394633
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C    1.72370306   -1.20825857   -0.08450291    0.03567247    0.03103435   -0.00682784
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H    2.37238813    2.20535656    0.18964473   -0.00273163    0.00683239    0.00061718
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C    2.33502004    0.02158315    0.02579627   -0.00621964   -0.04847948   -0.00124763
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   15
   -420.53331663
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O   -1.99060466   -1.27103742    0.13763308   -0.01521727   -0.01481838    0.00807633
C   -0.75325265    0.71786608    0.00786869   -0.01033415   -0.00286346    0.00968987
C   -0.84064675   -0.74909647    0.03588676   -0.03020279    0.05002088   -0.00325008
C    0.34727000    1.58625252   -0.00159791   -0.00673839   -0.00349800   -0.00796377
C    0.37393532   -1.59739666   -0.11399582    0.00074402   -0.02166036   -0.00083819
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C    1.72436462   -1.20735604   -0.08339886    0.03877912    0.02948058   -0.00666050
H    0.10606839    2.66022360   -0.11329229    0.00211734    0.01197996   -0.00442360
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H    2.37845423    2.21036403    0.19172796   -0.00044301    0.00998484    0.00101732
H    2.39040097   -2.06384757   -0.04220645   -0.00466627    0.00044362    0.00874106
C    2.33400495    0.02155961    0.02394198   -0.01127905   -0.04803713   -0.00168799
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   15
   -420.53298284
H   -2.54410392    0.35724857   -0.16315756    0.00111618   -0.00625129   -0.00518810
O   -1.98156872    1.19313945   -0.12742499    0.01009984   -0.01211629    0.00096510
O   -1.99313997   -1.27307738    0.13729745   -0.01811446   -0.01578495    0.00795550
C   -0.75426551    0.71728502    0.01082056   -0.01264207   -0.00405775    0.01020972
C   -0.83997147   -0.75140989    0.03851137   -0.02676859    0.04971919   -0.00251949
C    0.35048726    1.58855640   -0.00026901   -0.00101114   -0.00345913   -0.00747890
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C    1.72444145   -1.20689807   -0.08219424    0.04057427    0.02695476   -0.00638176
H    0.09820853    2.66448106   -0.11094942    0.00037582    0.01426589   -0.00462845
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H    2.38460467    2.21358380    0.19362843    0.00154051    0.01244090    0.00139126
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H    3.41568697   -0.06118537   -0.09815340    0.00003412   -0.00949985   -0.00896471
   15
   -420.53293616
H   -2.54713502    0.36398612   -0.16320360    0.00165087   -0.00465660   -0.00499270
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O   -1.99546986   -1.27493856    0.13687165   -0.02095112   -0.01643940    0.00776506
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C    0.35371987    1.59091100    0.00117308    0.00466660   -0.00209815   -0.00708382
C    0.37610468   -1.60108661   -0.11684314    0.00119922   -0.02741890   -0.00197929
C    1.75388369    1.31200210    0.13256325    0.01197460    0.01725505    0.01501972
C    1.72390676   -1.20684691   -0.08089323    0.04077431    0.02381856   -0.00600935
H    0.09027776    2.66619207   -0.10777551   -0.00113787    0.01504095   -0.00465751
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H    2.39482705   -2.04920606   -0.03514095   -0.00703084    0.00556234    0.00879138
C    2.33255648    0.02365647    0.02031723   -0.01990654   -0.04273089   -0.00274140
H    3.42208928   -0.07501153   -0.08819222    0.00440600   -0.01151753   -0.00879121
   15
   -420.53316915
H   -2.55046545    0.37155828   -0.16235124    0.00230438   -0.00279469   -0.00475563
O   -1.98378899    1.19742133   -0.13172574    0.00412374   -0.01291106   -0.00039060
O   -1.99756223   -1.27661355    0.13635783   -0.02365798   -0.01677496    0.00750813
C   -0.75568819    0.71631773    0.01625411   -0.01635011   -0.00527746    0.01112641
C   -0.83746543   -0.75826450    0.04386335   -0.01889404    0.04548285   -0.00098810
C    0.35688226    1.59329570    0.00272241    0.01007762    0.00059771   -0.00679218
C    0.37716422   -1.60233117   -0.11822651    0.00177500   -0.02935783   -0.00265371
C    1.75442467    1.31237725    0.12993928    0.00941628    0.01506287    0.01411327
C    1.72275779   -1.20715560   -0.07950147    0.03916867    0.02044552   -0.00556188
H    0.08254779    2.66521708   -0.10376536   -0.00235149    0.01427723   -0.00451860
H    0.25882188   -2.65925054   -0.32756634    0.01199790    0.00152493   -0.00592235
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H    2.39884272   -2.04316459   -0.03398222   -0.00713038    0.00701769    0.00870735
C    2.33225229    0.02569702    0.01856285   -0.02244285   -0.03819638   -0.00347915
H    3.42770922   -0.08676723   -0.07665214    0.00802269   -0.01333722   -0.00836344
   15
   -420.53374569
H   -2.55421057    0.37963253   -0.16064307    0.00293842   -0.00085905   -0.00449327
O   -1.98498697    1.19977927   -0.13387342    0.00070213   -0.01338244   -0.00114022
O   -1.99938640   -1.27809855    0.13575889   -0.02617364   -0.01679128    0.00719170
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C   -0.83575350   -0.76274176    0.04656759   -0.01466395    0.04163883   -0.00020344
C    0.35989283    1.59566985    0.00437455    0.01503400    0.00454740   -0.00659772
C    0.37819655   -1.60313321   -0.11956984    0.00266094   -0.03017587   -0.00327697
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C    1.72101890   -1.20777348   -0.07802569    0.03569269    0.01713374   -0.00505005
H    0.07523571    2.66169363   -0.09894426   -0.00319210    0.01201158   -0.00421219
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H    2.40412870   -2.03837165   -0.03439042   -0.00629647    0.00746719    0.00857499
C    2.33228547    0.02831393    0.01686126   -0.02336929   -0.03271169   -0.00437162
H    3.43190042   -0.09612639   -0.06361024    0.01055351   -0.01485292   -0.00768425
   15
   -420.53459979
H   -2.55848207    0.38786356   -0.15812607    0.00339365    0.00092769   -0.00422790
O   -1.98619288    1.20228882   -0.13600814   -0.00275751   -0.01363677   -0.00191263
O   -2.00091390   -1.27939337    0.13507843   -0.02843227   -0.01650338    0.00682518
C   -0.75613032    0.71566213    0.02101555   -0.01841291   -0.00501131    0.01187699
C   -0.83381993   -0.76784732    0.04927492   -0.01036707    0.03676173    0.00057525
C    0.36267685    1.59797393    0.00612655    0.01937292    0.00956358   -0.00648518
C    0.37918824   -1.60348077   -0.12086381    0.00388063   -0.02954482   -0.00376524
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C    1.71874249   -1.20865067   -0.07647368    0.03044873    0.01403032   -0.00445030
H    0.06849261    2.65602702   -0.09336693   -0.00364006    0.00840961   -0.00376603
H    0.25675603   -2.65204011   -0.33801144    0.01182219    0.00607566   -0.00532099
H    2.40438304    2.20258726    0.19821573    0.00366131    0.01148650    0.00219031
H    2.41053538   -2.03490912   -0.03634158   -0.00455030    0.00692891    0.00838958
C    2.33266990    0.03142455    0.01522595   -0.02257819   -0.02654366   -0.00539963
H    3.43420972   -0.10281788   -0.04918753    0.01179423   -0.01598636   -0.00679596
   15
   -420.53560818
H   -2.56335964    0.39593269   -0.15484792    0.00350970    0.00235377   -0.00397178
O   -1.98736766    1.20495264   -0.13812117   -0.00605381   -0.01345907   -0.00269040
O   -2.00211916   -1.28050125    0.13432059   -0.03037949   -0.01592560    0.00641015
C   -0.75594068    0.71544968    0.02312964   -0.01871767   -0.00441166    0.01218723
C   -0.83172956   -0.77350758    0.05197352   -0.00609674    0.03096663    0.00135072
C    0.36516883    1.60013252    0.00797661    0.02300018    0.01532286   -0.00641524
C    0.38012081   -1.60338361   -0.12210105    0.00545300   -0.02727369   -0.00406042
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C    1.71600755   -1.20974030   -0.07485450    0.02369933    0.01116105   -0.00374982
H    0.06239885    2.64886044   -0.08711320   -0.00369958    0.00379699   -0.00321686
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H    2.41774983   -2.03268241   -0.03980216   -0.00204011    0.00555892    0.00813910
C    2.33339360    0.03493593    0.01367242   -0.02008026   -0.01995275   -0.00651239
H    3.43441518   -0.10663925   -0.03354328    0.01165542   -0.01666201   -0.00573673
   15
   -420.53659762
H   -2.56886266    0.40358629   -0.15085453    0.00318053    0.00322791   -0.00372911
O   -1.98847410    1.20776861   -0.14020370   -0.00900967   -0.01271300   -0.00346600
O   -2.00298015   -1.28142873    0.13349009   -0.03196553   -0.01507449    0.00595384
C   -0.75546868    0.71530366    0.02505951   -0.01850431   -0.00357996    0.01244689
C   -0.82954688   -0.77963510    0.05465171   -0.00194226    0.02439575    0.00211439
C    0.36731392    1.60205910    0.00992362    0.02589701    0.02136237   -0.00634075
C    0.38097054   -1.60287613   -0.12327720    0.00735280   -0.02335810   -0.00411964
C    1.75538807    1.31174676    0.11745151    0.00621574    0.01368417    0.01038915
C    1.71291557   -1.21099888   -0.07317879    0.01587255    0.00844434   -0.00291117
H    0.05696582    2.64101779   -0.08028098   -0.00343613   -0.00137291   -0.00261515
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   15
   -420.53741632
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O   -2.00347893   -1.28218541    0.13259208   -0.03314162   -0.01397568    0.00545917
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   15
   -420.53799825
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O   -2.00360219   -1.28278373    0.13163217   -0.03387457   -0.01265743    0.00492723
C   -0.75369810    0.71515839    0.02835168   -0.01657235   -0.00148490    0.01281390
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H    2.43938893   -2.03058835   -0.05869315    0.00705932   -0.00036396    0.00673428
C    2.33710936    0.04687195    0.00967149   -0.00419203   -0.00000859   -0.00980152
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   15
   -420.53828413
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O   -2.00334166   -1.28323861    0.13061639   -0.03413021   -0.01114305    0.00436170
C   -0.75242864    0.71512761    0.02970843   -0.01492098   -0.00034453    0.01290891
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C    0.38271839   -1.59958196   -0.12644352    0.01412905   -0.00473519   -0.00338483
C    1.75505610    1.30908800    0.10638726    0.00916614    0.01513842    0.00756702
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H    2.44478899   -2.03024214   -0.06754540    0.00954352   -0.00192268    0.00602095
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   15
   -420.53838228
H   -2.59457433    0.42856702   -0.12861130   -0.00261528    0.00100962   -0.00263809
O   -1.99162805    1.22027367   -0.14805198   -0.01615279   -0.00387383   -0.00664016
O   -2.00269445   -1.28356722    0.12955117   -0.03388509   -0.00946459    0.00376108
C   -0.75093405    0.71510207    0.03087009   -0.01287581    0.00078254    0.01293769
C   -0.82109652   -0.80671191    0.06493383    0.01198912   -0.00631981    0.00499173
C    0.37168980    1.60577002    0.01864295    0.03211423    0.03558707   -0.00510589
C    0.38292039   -1.59820504   -0.12739039    0.01624130    0.00213933   -0.00311371
C    1.75468998    1.30774936    0.10245104    0.00988426    0.01418108    0.00649882
C    1.69942325   -1.21688952   -0.06619806   -0.01645271   -0.00329914    0.00188728
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H    2.44848120   -2.02955810   -0.07748018    0.01132863   -0.00290519    0.00520720
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   15
   -420.53835457
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O   -1.99199742    1.22358475   -0.14984861   -0.01709067   -0.00099095   -0.00746652
O   -2.00166335   -1.28378855    0.12844330   -0.03312102   -0.00765035    0.00312999
C   -0.74924521    0.71506475    0.03183621   -0.01049468    0.00186590    0.01290131
C   -0.81931744   -0.81354202    0.06734227    0.01444432   -0.01426800    0.00567841
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C    0.38287729   -1.59685983   -0.12829001    0.01796801    0.00849770   -0.00298522
C    1.75417510    1.30619785    0.09841674    0.01005244    0.01197208    0.00529655
C    1.69638062   -1.21835439   -0.06447414   -0.02250863   -0.00665207    0.00335301
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C    2.34135006    0.05884245    0.00699054    0.01513489    0.01714873   -0.01199843
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   15
   -420.53829263
H   -2.60586570    0.43929609   -0.11443802   -0.00608301   -0.00143993   -0.00184129
O   -1.99217299    1.22690725   -0.15156053   -0.01796322    0.00171181   -0.00829028
O   -2.00025703   -1.28392318    0.12729996   -0.03182511   -0.00573193    0.00246957
C   -0.74739804    0.71499931    0.03260736   -0.00783594    0.00287576    0.01279448
C   -0.81775609   -0.82015663    0.06966486    0.01634195   -0.02202975    0.00635430
C    0.37104290    1.60457532    0.02348863    0.03359945    0.03042392   -0.00367189
C    0.38256322   -1.59564195   -0.12914424    0.01912297    0.01391242   -0.00306767
C    1.75350907    1.30446688    0.09430246    0.00957755    0.00848736    0.00397217
C    1.69367652   -1.21971858   -0.06280094   -0.02709158   -0.01009176    0.00484092
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C    2.34242947    0.06242374    0.00644678    0.01922939    0.02196582   -0.01251308
H    3.40511174   -0.05380496    0.09372021   -0.01149396   -0.00918681    0.00113752
   15
   -420.53822145
H   -2.61002172    0.44493953   -0.10681695   -0.00724522   -0.00228271   -0.00139077
O   -1.99214474    1.23021069   -0.15317844   -0.01890636    0.00403408   -0.00909189
O   -1.99849020   -1.28399285    0.12612863   -0.02999032   -0.00374221    0.00178526
C   -0.74543265    0.71489050    0.03318513   -0.00496386    0.00380211    0.01262196
C   -0.81644111   -0.82643862    0.07189137    0.01763500   -0.02945409    0.00702697
C    0.36996276    1.60326368    0.02600041    0.03377173    0.02520880   -0.00287343
C    0.38196089   -1.59463293   -0.12995177    0.01955874    0.01809126   -0.00340420
C    1.75269895    1.30260883    0.09012824    0.00855930    0.00394579    0.00253433
C    1.69138003   -1.22093021   -0.06120091   -0.03002156   -0.01351600    0.00630451
H    0.03382473    2.62955469   -0.02410813   -0.00524148   -0.00706481   -0.00040632
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H    2.43969148    2.12626393    0.18901094   -0.00099321   -0.00992330    0.00128284
H    2.44687221   -2.02434386   -0.11226516    0.01144978   -0.00167256    0.00251910
C    2.34322083    0.06567349    0.00609224    0.02111715    0.02627272   -0.01305644
H    3.40415359   -0.03727935    0.11229975   -0.01225644   -0.00724771    0.00197724
   15
   -420.53808455
H   -2.61288184    0.45098731   -0.09894557   -0.00782344   -0.00267463   -0.00093375
O   -1.99190189    1.23346882   -0.15469326   -0.02000874    0.00583649   -0.00984336
O   -1.99638368   -1.28402011    0.12493706   -0.02761526   -0.00171596    0.00108108
C   -0.74339240    0.71472430    0.03357214   -0.00193395    0.00464525    0.01238405
C   -0.81539197   -0.83227583    0.07401163    0.01827357   -0.03643474    0.00769613
C    0.36837283    1.60157202    0.02855564    0.03328067    0.01909617   -0.00208665
C    0.38106385   -1.59389571   -0.13070752    0.01916661    0.02084003   -0.00400826
C    1.75175970    1.30069193    0.08591579    0.00728532   -0.00126348    0.00102710
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C    2.34369579    0.06852683    0.00593526    0.02062250    0.02990961   -0.01373012
H    3.40537410   -0.01944809    0.13052134   -0.01110283   -0.00535279    0.00295594
   15
   -420.53785635
H   -2.61434273    0.45750820   -0.09090572   -0.00775265   -0.00251729   -0.00049739
O   -1.99143188    1.23666129   -0.15609649   -0.02132789    0.00703453   -0.01051638
O   -1.99396439   -1.28402789    0.12373324   -0.02471357    0.00031319    0.00036986
C   -0.74132301    0.71448796    0.03377198    0.00118678    0.00541546    0.01208894
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C    0.36628076    1.59959185    0.03114249    0.03192490    0.01280770   -0.00135382
C    0.37987807   -1.59347178   -0.13140233    0.01791430    0.02209016   -0.00487711
C    1.75071026    1.29879431    0.08168783    0.00604207   -0.00661839   -0.00049956
C    1.68816120   -1.22269182   -0.05830763   -0.03083285   -0.01972923    0.00899364
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C    2.34386162    0.07092880    0.00598604    0.01793900    0.03279879   -0.01457154
H    3.40856733   -0.00065534    0.14820701   -0.00816846   -0.00336401    0.00417235
   15
   -420.53747034
H   -2.61441796    0.46447560   -0.08277538   -0.00700893   -0.00184947   -0.00010517
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O   -1.99126523   -1.28403922    0.12252523   -0.02130651    0.00231853   -0.00034579
C   -0.73927168    0.71416983    0.03378908    0.00437386    0.00611684    0.01175018
C   -0.81411915   -0.84220269    0.07789288    0.01744722   -0.04862512    0.00904184
C    0.36370723    1.59741755    0.03374987    0.02956700    0.00692044   -0.00068425
C    0.37842247   -1.59338002   -0.13202312    0.01582218    0.02185613   -0.00597530
C    1.74956905    1.29699630    0.07746738    0.00513479   -0.01158898   -0.00198300
C    1.68725148   -1.22314829   -0.05705497   -0.02900924   -0.02213711    0.01016569
H    0.03542029    2.64921925    0.00165820   -0.00773468    0.00698728    0.00007973
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C    2.34375815    0.07283600    0.00625735    0.01366617    0.03475116   -0.01558053
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   15
   -420.53690590
H   -2.61324035    0.47177028   -0.07462509   -0.00566879   -0.00072703    0.00022406
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O   -1.98832480   -1.28407681    0.12132113   -0.01743077    0.00426067   -0.00105804
C   -0.73728651    0.71375931    0.03362857    0.00756997    0.00675586    0.01137139
C   -0.81388295   -0.84610824    0.07963353    0.01596670   -0.05365536    0.00973046
C    0.36068797    1.59513758    0.03636767    0.02616083    0.00189172   -0.00007545
C    0.37672857   -1.59361709   -0.13255333    0.01298084    0.02030233   -0.00725820
C    1.74834945    1.29537251    0.07327678    0.00481004   -0.01571798   -0.00337016
C    1.68677907   -1.22327098   -0.05595583   -0.02613193   -0.02375272    0.01121613
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H    2.41904267   -2.01579399   -0.16441797    0.00155223    0.00675367   -0.00034848
C    2.34344904    0.07421919    0.00676428    0.00855657    0.03561320   -0.01666256
H    3.41857717    0.03837663    0.18106599    0.00067294    0.00081283    0.00708768
   15
   -420.53625858
H   -2.61104869    0.47919089   -0.06651390   -0.00388932    0.00074918    0.00047822
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O   -1.98518703   -1.28416263    0.12012902   -0.01314687    0.00609572   -0.00176003
C   -0.73541573    0.71324670    0.03329617    0.01070470    0.00734400    0.01096523
C   -0.81388733   -0.84920355    0.08122704    0.01380883   -0.05785572    0.01043504
C    0.35727453    1.59282769    0.03898668    0.02172225   -0.00199893    0.00047570
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C    1.74705625    1.29398486    0.06913699    0.00519712   -0.01863236   -0.00463157
C    1.68670101   -1.22303582   -0.05502616   -0.02263902   -0.02428862    0.01218208
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H    0.11517576   -2.63950209   -0.29900587   -0.00793233    0.00286590   -0.00104226
H    2.46257624    2.12729531    0.17458497    0.01245951    0.00137535    0.00275044
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   15
   -420.53563568
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O   -1.98190042   -1.28431748    0.11895684   -0.00854135    0.00778970   -0.00244028
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   15
   -420.53513108
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C   -0.73220513    0.71188077    0.03214046    0.01659731    0.00830795    0.01010370
C   -0.81447855   -0.85272336    0.08392971    0.00775980   -0.06347824    0.01190250
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   15
   -420.53483721
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O   -1.97509167   -1.28490887    0.11670270    0.00117098    0.01058114   -0.00369395
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C   -0.81497428   -0.85306302    0.08501670    0.00411715   -0.06476568    0.01265604
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C    0.36854060   -1.59718390   -0.13336537   -0.00223142    0.00727146   -0.01266174
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C    2.34164070    0.07450060    0.01145093   -0.00672783    0.02828011   -0.01930028
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   15
   -420.53476179
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O   -1.98039137    1.25672551   -0.16230490   -0.02871988    0.00640032   -0.01256088
O   -1.97167941   -1.28537697    0.11563497    0.00597388    0.01158648   -0.00425808
C   -0.72999346    0.71001452    0.03037377    0.02152138    0.00883554    0.00921600
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C    0.34120371    1.58415590    0.04931407   -0.00305758   -0.00402666    0.00250630
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C    1.74086249    1.29133665    0.05343285    0.01372837   -0.01522001   -0.00819194
C    1.68927873   -1.21867451   -0.05329159   -0.01000005   -0.01232639    0.01610492
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C    2.34133491    0.07339686    0.01333734   -0.00722684    0.02421616   -0.01901499
H    3.42975935    0.12621781    0.23660019    0.01274990    0.01163259    0.01235295
   15
   -420.53485336
H   -2.59645378    0.50918327   -0.02792003    0.00348904    0.00508893    0.00159738
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O   -1.96833469   -1.28597621    0.11461549    0.01051091    0.01227106   -0.00476902
C   -0.72935765    0.70888278    0.02927805    0.02343085    0.00884161    0.00876717
C   -0.81609388   -0.85080567    0.08660516   -0.00358200   -0.06402861    0.01416062
C    0.33705050    1.58216813    0.05182040   -0.00978789   -0.00157487    0.00305135
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C    1.73889736    1.29133562    0.04978783    0.01698243   -0.01091012   -0.00878038
C    1.69040663   -1.21695521   -0.05342811   -0.00789415   -0.00633032    0.01714854
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H    2.37409925   -2.03857240   -0.23849957   -0.00414395    0.00312569   -0.00513537
C    2.34113647    0.07192763    0.01551065   -0.00614080    0.01961613   -0.01824586
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   15
   -420.53501495
H   -2.59470235    0.51263384   -0.02086754    0.00334198    0.00412087    0.00206220
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O   -1.96510878   -1.28671432    0.11365005    0.01459971    0.01258844   -0.00521990
C   -0.72907549    0.70761762    0.02804978    0.02484908    0.00862851    0.00831116
C   -0.81660183   -0.84821988    0.08708394   -0.00723425   -0.06193422    0.01487623
C    0.33304481    1.58020356    0.05428058   -0.01611551    0.00141136    0.00362284
C    0.36252285   -1.60124471   -0.13205267   -0.01219046    0.00053150   -0.01513711
C    1.73667550    1.29149857    0.04627552    0.02019246   -0.00579453   -0.00931870
C    1.69165418   -1.21514075   -0.05382383   -0.00602006    0.00012653    0.01811858
H    0.08745222    2.63560495    0.06544493    0.00480565   -0.00214736    0.00227365
H    0.09745616   -2.64119916   -0.25062854   -0.00812703    0.00900217    0.00310368
H    2.42583605    2.12871668    0.14224602    0.00558181   -0.00433237    0.00167701
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C    2.34102912    0.07016220    0.01795925   -0.00356318    0.01470058   -0.01699135
H    3.41985520    0.14937249    0.24427285    0.00778484    0.01441717    0.01194270
   15
   -420.53518594
H   -2.59354460    0.51535064   -0.01418811    0.00264533    0.00259655    0.00263732
O   -1.97097031    1.26415375   -0.16286491   -0.02173303    0.01082509   -0.01338492
O   -1.96204792   -1.28759485    0.11274377    0.01806532    0.01250080   -0.00560774
C   -0.72916837    0.70622233    0.02669588    0.02570595    0.00814990    0.00784216
C   -0.81700089   -0.84469908    0.08733785   -0.01048235   -0.05866546    0.01554463
C    0.32928190    1.57821770    0.05668596   -0.02171054    0.00435229    0.00421921
C    0.36082376   -1.60265011   -0.13117117   -0.01465223   -0.00033320   -0.01554315
C    1.73414884    1.29174870    0.04290407    0.02297776   -0.00036032   -0.00985716
C    1.69299279   -1.21332816   -0.05449327   -0.00417855    0.00655115    0.01890710
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H    0.09964989   -2.64764100   -0.24410165   -0.00805809    0.00625002    0.00310796
H    2.41379783    2.12962891    0.13546010    0.00250460   -0.00676764    0.00128101
H    2.36518779   -2.05433761   -0.25763908   -0.00188993   -0.00354702   -0.00740590
C    2.34097411    0.06817457    0.02066423    0.00031386    0.00972289   -0.01530225
H    3.41254030    0.15717438    0.24485527    0.00341188    0.01518049    0.01117307
   15
   -420.53535946
H   -2.59285798    0.51760430   -0.00798494    0.00159461    0.00076618    0.00328271
O   -1.96729292    1.26641164   -0.16275279   -0.01789150    0.01294848   -0.01374140
O   -1.95919129   -1.28861678    0.11190103    0.02075577    0.01197443   -0.00592785
C   -0.72964914    0.70470419    0.02522342    0.02591911    0.00737878    0.00735468
C   -0.81724215   -0.84029270    0.08735682   -0.01314087   -0.05422874    0.01614175
C    0.32584599    1.57616682    0.05902752   -0.02625603    0.00660944    0.00481666
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C    1.73127585    1.29200456    0.03968171    0.02492138    0.00480795   -0.01044723
C    1.69439440   -1.21161403   -0.05544824   -0.00221348    0.01249277    0.01941850
H    0.09985846    2.62385092    0.07812445    0.00886336   -0.00988483    0.00239104
H    0.10329274   -2.65519815   -0.23813240   -0.00787418    0.00284878    0.00298610
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H    2.36134715   -2.06156803   -0.26531158   -0.00101339   -0.00649954   -0.00835967
C    2.34091320    0.06603977    0.02360014    0.00512394    0.00488033   -0.01325398
H    3.40462302    0.16225042    0.24343007   -0.00178306    0.01548434    0.01014408
   15
   -420.53557691
H   -2.59245704    0.51972087   -0.00237310    0.00044129   -0.00111063    0.00394117
O   -1.96341293    1.26852280   -0.16248484   -0.01365874    0.01493836   -0.01405225
O   -1.95656929   -1.28977414    0.11112548    0.02256128    0.01099807   -0.00617480
C   -0.73052096    0.70307488    0.02363981    0.02542207    0.00629223    0.00683880
C   -0.81728558   -0.83506775    0.08713187   -0.01506650   -0.04865166    0.01664104
C    0.32280553    1.57401753    0.06129631   -0.02951586    0.00759111    0.00538394
C    0.35811997   -1.60543915   -0.12870021   -0.01843369   -0.00129330   -0.01586420
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C    1.69582918   -1.21008775   -0.05669640   -0.00001711    0.01759766    0.01958220
H    0.10384494    2.62030997    0.08382237    0.01015246   -0.01172912    0.00241137
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H    2.38887040    2.13543522    0.12125552   -0.00259718   -0.00987586    0.00067616
H    2.35769516   -2.06763768   -0.27148259   -0.00056382   -0.00879763   -0.00907738
C    2.34077438    0.06383082    0.02673618    0.01031535    0.00035371   -0.01097963
H    3.39702997    0.16454541    0.24018028   -0.00723907    0.01537114    0.00899061
   15
   -420.53592850
H   -2.59213718    0.52203338    0.00252964   -0.00059039   -0.00272954    0.00456912
O   -1.95937812    1.27046492   -0.16205760   -0.00927812    0.01650690   -0.01424324
O   -1.95420235   -1.29105585    0.11041990    0.02341584    0.00956791   -0.00634606
C   -0.73177623    0.70135083    0.02195283    0.02416018    0.00488580    0.00629189
C   -0.81710220   -0.82910850    0.08665542   -0.01616122   -0.04198199    0.01703208
C    0.32020960    1.57175543    0.06348375   -0.03132960    0.00697455    0.00590202
C    0.35717259   -1.60680750   -0.12710583   -0.01986547   -0.00201722   -0.01583003
C    1.72439314    1.29223696    0.03372168    0.02489588    0.01208180   -0.01194266
C    1.69726393   -1.20882615   -0.05824009    0.00244489    0.02157936    0.01932511
H    0.10601224    2.61885270    0.08908597    0.01084165   -0.01166968    0.00244265
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H    2.37688997    2.14087875    0.11394492   -0.00400365   -0.00980839    0.00053181
H    2.35415244   -2.07213492   -0.27602335   -0.00063966   -0.01025918   -0.00950687
C    2.34048002    0.06161604    0.03003818    0.01517117   -0.00375119   -0.00865197
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   15
   -420.53652546
H   -2.59171507    0.52483141    0.00661377   -0.00130611   -0.00391604    0.00507008
O   -1.95523805    1.27222033   -0.16146891   -0.00493677    0.01745186   -0.01427610
O   -1.95210015   -1.29244570    0.10978623    0.02331336    0.00770933   -0.00643761
C   -0.73339582    0.69955330    0.02017075    0.02210676    0.00315294    0.00570789
C   -0.81667551   -0.82251572    0.08592162   -0.01639167   -0.03430842    0.01728976
C    0.31808554    1.56938982    0.06558204   -0.03165043    0.00476584    0.00635460
C    0.35652527   -1.60814470   -0.12527223   -0.02104699   -0.00326335   -0.01569820
C    1.72038425    1.29210437    0.03100664    0.02254736    0.01349207   -0.01284667
C    1.69866141   -1.20788925   -0.06007542    0.00514855    0.02426848    0.01862299
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H    2.36561658    2.14806872    0.10653706   -0.00446972   -0.00841838    0.00049773
H    2.35073292   -2.07479939   -0.27885725   -0.00128393   -0.01076170   -0.00961070
C    2.33995767    0.05945737    0.03347113    0.01889200   -0.00736875   -0.00643116
H    3.38661763    0.16093751    0.22902568   -0.01593095    0.01411636    0.00691595
   15
   -420.53732707
H   -2.59106338    0.52832529    0.00978909   -0.00157623   -0.00452908    0.00540542
O   -1.95104181    1.27377845   -0.16071846   -0.00078258    0.01761331   -0.01410432
O   -1.95026158   -1.29392265    0.10922552    0.02230589    0.00546673   -0.00644899
C   -0.73534869    0.69770847    0.01830244    0.01925855    0.00110797    0.00508047
C   -0.81600203   -0.81540527    0.08492660   -0.01577797   -0.02574438    0.01739881
C    0.31643821    1.56695370    0.06758438   -0.03051323    0.00130664    0.00672599
C    0.35619593   -1.60943161   -0.12320139   -0.02199809   -0.00522167   -0.01547245
C    1.71603626    1.29176967    0.02848592    0.01872036    0.01334845   -0.01381068
C    1.69998075   -1.20731757   -0.06219179    0.00805472    0.02556598    0.01746656
H    0.10450564    2.62181263    0.09828180    0.01041335   -0.00623661    0.00259649
H    0.13108534   -2.68418239   -0.21926103   -0.00471974   -0.00943870    0.00215722
H    2.35513536    2.15675622    0.09903892   -0.00407063   -0.00580529    0.00054061
H    2.34755176   -2.07554184   -0.27996608   -0.00245634   -0.01025880   -0.00937385
C    2.33915198    0.05740942    0.03700158    0.02075760   -0.01044029   -0.00443933
H    3.38534152    0.15525692    0.22148977   -0.01765607    0.01316723    0.00626733
   15
   -420.53827356
H   -2.59013478    0.53262444    0.01199417   -0.00132544   -0.00452326    0.00557717
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   15
   -420.53918931
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   15
   -420.53990962
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C   -0.81264778   -0.79231427    0.08036984   -0.00988746    0.00363613    0.01674382
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   15
   -420.54029434
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C   -0.74546587    0.69053259    0.01016616    0.00109022   -0.00927075    0.00215517
C   -0.81118377   -0.78452380    0.07833806   -0.00705900    0.01393946    0.01618430
C    0.31399280    1.55763373    0.07453457   -0.01471461   -0.01337446    0.00773261
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C    1.69663877    1.28869654    0.02062677   -0.00460610    0.00438869   -0.01691708
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   15
   -420.54030053
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C   -0.80961324   -0.77694390    0.07606175   -0.00407192    0.02407170    0.01546234
C    0.31411847    1.55568804    0.07598840   -0.00913462   -0.01482190    0.00794595
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C    1.69172943    1.28766476    0.01927671   -0.01052809    0.00228033   -0.01727336
C    1.70388532   -1.20993516   -0.07616380    0.01978856    0.01480010    0.00638465
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C    2.33103277    0.05012208    0.05517288    0.00215866   -0.01569927    0.00358359
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   15
   -420.53999974
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O   -1.94358635   -1.30299646    0.10733564    0.00471096   -0.01152535   -0.00484213
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C    0.31438212    1.55396484    0.07732206   -0.00344999   -0.01492877    0.00818491
C    0.36142988   -1.61370186   -0.10609401   -0.02165127   -0.02883602   -0.01180805
C    1.68697857    1.28659766    0.01818757   -0.01588362    0.00088363   -0.01743460
C    1.70387581   -1.21132187   -0.07940044    0.01971044    0.01131694    0.00372038
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C    2.32899405    0.04936725    0.05874297   -0.00296332   -0.01447390    0.00559711
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   15
   -420.53946215
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O   -1.94288484   -1.30424175    0.10723792    0.00134171   -0.01409079   -0.00432741
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C   -0.80633258   -0.76302042    0.07082154    0.00179088    0.04270568    0.01357555
C    0.31469810    1.55246578    0.07853199    0.00206652   -0.01369332    0.00842111
C    0.36349755   -1.61327360   -0.10254808   -0.02012312   -0.03238972   -0.01069979
C    1.68246691    1.28551615    0.01736181   -0.02047304    0.00036698   -0.01741644
C    1.70357009   -1.21288030   -0.08269339    0.01816746    0.00831718    0.00111797
H    0.05215215    2.62750563    0.11485035    0.00113119    0.01299602    0.00282460
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H    2.35600443   -2.05080321   -0.24860111   -0.01219869    0.00530884   -0.00302557
C    2.32699877    0.04883048    0.06222812   -0.00697582   -0.01260964    0.00786783
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   15
   -420.53887966
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O   -1.94219877   -1.30532746    0.10718926   -0.00179131   -0.01637042   -0.00376214
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C   -0.80471081   -0.75695791    0.06788613    0.00443178    0.05065363    0.01244227
C    0.31498340    1.55117222    0.07961459    0.00712387   -0.01119780    0.00866959
C    0.36586874   -1.61235710   -0.09884060   -0.01799941   -0.03472014   -0.00940244
C    1.67826370    1.28442794    0.01679919   -0.02416357    0.00079340   -0.01724913
C    1.70299161   -1.21456535   -0.08600339    0.01505066    0.00603278   -0.00137780
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C    2.32510719    0.04848378    0.06559406   -0.00952268   -0.01026345    0.01033629
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   15
   -420.53828838
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O   -1.94149267   -1.30622779    0.10718323   -0.00460546   -0.01829276   -0.00315259
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C   -0.80315567   -0.75165974    0.06476272    0.00675664    0.05734894    0.01120923
C    0.31516192    1.55004670    0.08056610    0.01149131   -0.00767451    0.00891136
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C    1.67442469    1.28332668    0.01649723   -0.02688473    0.00210925   -0.01696559
C    1.70218740   -1.21634248   -0.08929265    0.01044117    0.00447470   -0.00379282
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   15
   -420.53770988
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C   -0.75940626    0.68463131   -0.00275768   -0.02821367   -0.01979764   -0.00264003
C   -0.80170223   -0.74722690    0.06146994    0.00871196    0.06258558    0.00989439
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C    0.37138348   -1.60894455   -0.09102262   -0.01184477   -0.03428759   -0.00619815
C    1.67099101    1.28219260    0.01645168   -0.02863036    0.00418281   -0.01660128
C    1.70122686   -1.21818790   -0.09252459    0.00460762    0.00347487   -0.00616569
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C    2.32176408    0.04821485    0.07181767   -0.00968486   -0.00480518    0.01553611
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   15
   -420.53711559
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O   -1.93989729   -1.30738970    0.10727111   -0.00903739   -0.02091651   -0.00184741
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C   -0.80038003   -0.74373837    0.05802763    0.01025913    0.06620212    0.00852351
C    0.31494871    1.54807763    0.08206162    0.01744903    0.00103204    0.00931937
C    0.37443404   -1.60645539   -0.08696053   -0.00785899   -0.03124693   -0.00431325
C    1.66798912    1.28099467    0.01665708   -0.02948104    0.00674571   -0.01618532
C    1.70019759   -1.22008624   -0.09566335   -0.00200261    0.00277890   -0.00853480
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C    2.32031495    0.04821048    0.07459696   -0.00730571   -0.00201436    0.01806637
H    3.43325385   -0.00372869    0.07352429    0.01673367   -0.00807870   -0.00036190
   15
   -420.53644585
H   -2.60449877    0.58936426   -0.02103466    0.00045684    0.00203849    0.00306146
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C   -0.76135047    0.68486782   -0.00687299   -0.03202343   -0.01824070   -0.00387390
C   -0.79921242   -0.74124869    0.05445651    0.01137686    0.06809527    0.00711406
C    0.31446697    1.54710377    0.08259951    0.01891622    0.00515403    0.00944199
C    0.37760283   -1.60349582   -0.08283341   -0.00338374   -0.02652728   -0.00227779
C    1.66543208    1.27969460    0.01710716   -0.02959840    0.00941634   -0.01574312
C    1.69919888   -1.22202666   -0.09867309   -0.00887660    0.00207634   -0.01091665
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H    2.24944101    2.19183747    0.00448990   -0.01014722    0.00107424   -0.00182029
H    2.41454512   -2.04464601   -0.20502165    0.00280195   -0.00180688   -0.00050721
C    2.31897454    0.04823674    0.07710332   -0.00348001    0.00062041    0.02040933
H    3.42507593   -0.01764569    0.05682387    0.01300058   -0.01000868   -0.00151377
   15
   -420.53573267
H   -2.60966612    0.59177617   -0.02800877   -0.00176836    0.00094141    0.00288631
O   -1.91001564    1.28431933   -0.13970200    0.04551124   -0.00632528   -0.00349054
O   -1.93789881   -1.30760940    0.10744252   -0.01161786   -0.02172458   -0.00047666
C   -0.76160858    0.68540719   -0.00884731   -0.03214851   -0.01631385   -0.00432906
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   15
   -420.53504715
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O   -1.93670850   -1.30735121    0.10754026   -0.01214642   -0.02142037    0.00019433
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   15
   -420.53447654
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C   -0.76068824    0.68718399   -0.01259522   -0.02864126   -0.01050332   -0.00483587
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C    1.66042093    1.27482224    0.01985670   -0.02823388    0.01308790   -0.01421829
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   15
   -420.53416883
H   -2.62192975    0.59857381   -0.05183530   -0.00622270   -0.00066155    0.00180749
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C   -0.79632139   -0.74145197    0.03931406    0.01124575    0.05843197    0.00137288
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C    1.69747965   -1.22992232   -0.10870146   -0.02952857   -0.00431719   -0.02020539
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   15
   -420.53415568
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O   -1.93232067   -1.30516183    0.10779109   -0.01043385   -0.01769415    0.00204483
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C   -0.79604099   -0.74386049    0.03542246    0.01005873    0.05218890   -0.00002036
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C    1.69800961   -1.23180887   -0.11053024   -0.03119556   -0.00695550   -0.02220671
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   15
   -420.53446988
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O   -1.93060735   -1.30400737    0.10783726   -0.00872192   -0.01557488    0.00257363
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C    0.30573491    1.53896677    0.08286154    0.01100980   -0.00392828    0.00829820
C    0.39516641   -1.58075906   -0.05845896    0.02234464    0.01141896    0.00949690
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   15
   -420.53498481
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O   -1.92879561   -1.30267658    0.10785430   -0.00643407   -0.01308163    0.00303703
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C   -0.79591042   -0.75092856    0.02766055    0.00641477    0.03638644   -0.00268800
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C    1.65971836    1.26594522    0.02646861   -0.02710400   -0.00065136   -0.01097993
C    1.70047634   -1.23522180   -0.11315492   -0.02919247   -0.01287948   -0.02542492
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H    2.46608758   -2.02373087   -0.14501644    0.01106050    0.00155774    0.00479064
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H    3.35985083   -0.05311146   -0.04541743   -0.01822894   -0.01448737   -0.00494657
   15
   -420.53555083
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O   -1.92691138   -1.30119774    0.10783698   -0.00360117   -0.01024666    0.00344258
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C   -0.79600523   -0.75534974    0.02383056    0.00403279    0.02728647   -0.00393949
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   15
   -420.53602105
H   -2.62272481    0.60918106   -0.09665202   -0.00101481    0.00518278   -0.00074651
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C   -0.79616068   -0.76018291    0.02006005    0.00136861    0.01771889   -0.00512643
C    0.29875095    1.53498114    0.08124100   -0.00235946   -0.02348256    0.00701229
C    0.40026714   -1.57036685   -0.04781330    0.02513388    0.02011239    0.01297385
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C    1.70467668   -1.23785799   -0.11424865   -0.02093225   -0.01830936   -0.02730768
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   15
   -420.53632997
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O   -1.92305953   -1.29792698    0.10768152    0.00349613   -0.00388502    0.00405570
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C   -0.79633660   -0.76528373    0.01636695   -0.00147400    0.00793782   -0.00623243
C    0.29639533    1.53423432    0.08048002   -0.00803835   -0.02852521    0.00659110
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C    2.29798752    0.04361130    0.08161664   -0.00293954    0.01147066    0.03035692
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   15
   -420.53644461
H   -2.61970309    0.60884975   -0.11426654    0.00200963    0.00746386   -0.00138912
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O   -1.92117224   -1.29620709    0.10753642    0.00755971   -0.00052375    0.00426730
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C   -0.79649016   -0.77050463    0.01276799   -0.00436718   -0.00179236   -0.00725709
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C    0.40179633   -1.56488267   -0.04166657    0.02187902    0.02093006    0.01418146
C    1.66540945    1.25729242    0.03571857   -0.01830312   -0.01788674   -0.00692370
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C    2.29497421    0.04229947    0.07970638   -0.01212737    0.01060394    0.03072892
H    3.37298993   -0.01780639   -0.08484663   -0.00008828   -0.01132243   -0.00839539
   15
   -420.53642684
H   -2.61860670    0.60676728   -0.12272522    0.00264167    0.00757724   -0.00164193
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O   -1.91937085   -1.29448127    0.10734294    0.01178779    0.00283521    0.00443372
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C   -0.79657779   -0.77569883    0.00927864   -0.00717507   -0.01121223   -0.00818934
C    0.29213906    1.53408250    0.07866504   -0.01992133   -0.03389631    0.00582382
C    0.40205043   -1.56261388   -0.03891070    0.01910947    0.02056664    0.01452630
C    1.66763671    1.25566751    0.03833041   -0.01397357   -0.01971937   -0.00603177
C    1.71311559   -1.23971244   -0.11279614   -0.00432616   -0.01968834   -0.02730872
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H    2.31840959    2.14671277   -0.04570206    0.00574479    0.00909255   -0.00557826
H    2.45011498   -2.01557215   -0.12415593   -0.00292956    0.01519481    0.00619899
C    2.29214378    0.04082822    0.07733189   -0.02087695    0.00904346    0.03080019
H    3.37881591   -0.00337519   -0.09135868    0.00522714   -0.00952084   -0.00919450
   15
   -420.53641440
H   -2.61797443    0.60333108   -0.13088850    0.00251538    0.00691158   -0.00189190
O   -1.93322401    1.30005348   -0.11318166    0.01201005   -0.00077445    0.00085774
O   -1.91770317   -1.29278747    0.10709921    0.01599926    0.00607893    0.00456177
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C   -0.79655724   -0.78072417    0.00591301   -0.00972495   -0.02007369   -0.00903550
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   15
   -420.53649035
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   15
   -420.53662137
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   15
   -420.53675972
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   15
   -420.53687872
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   15
   -420.53689679
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   15
   -420.53688052
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O   -1.91289022   -1.28510573    0.10450700    0.03062362    0.01757476    0.00546515
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C    2.28575807    0.02908097    0.04844898   -0.03617057   -0.01278663    0.01944423
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   15
   -420.53692636
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   15
   -420.53708379
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O   -1.91388018   -1.28398079    0.10316980    0.02844050    0.01710386    0.00611196
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C    1.68717125    1.25177272    0.06467308    0.02669711    0.00114093    0.00057090
C    1.73777880   -1.23816677   -0.08839860    0.01256535    0.02826425   -0.01139081
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C    2.28904247    0.02670315    0.03703738   -0.02567331   -0.01688150    0.01372969
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   15
   -420.53743532
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O   -1.91486674   -1.28371154    0.10239913    0.02601466    0.01608828    0.00649838
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C    0.39684289   -1.55871460   -0.02354830   -0.00944713    0.03372907    0.01213746
C    1.68794106    1.25179128    0.06772117    0.02523246    0.00122993    0.00169589
C    1.73980893   -1.23912366   -0.08438015    0.01423860    0.02919279   -0.00902094
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C    2.29130905    0.02588300    0.03099842   -0.02005893   -0.01784506    0.01095849
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   15
   -420.53794289
H   -2.60851838    0.55293841   -0.18378061    0.00151148   -0.00303250   -0.00460903
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C    1.68833153    1.25179257    0.07074356    0.02198434    0.00022255    0.00286822
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C    2.29387993    0.02533188    0.02479357   -0.01528252   -0.01815657    0.00835319
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   15
   -420.53858845
H   -2.60635395    0.55092262   -0.18500839    0.00356498   -0.00148062   -0.00452047
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C   -0.75944278    0.68859030   -0.04172217    0.00577501   -0.02788947   -0.00171564
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C    0.30498238    1.56208127    0.06124100   -0.01288094    0.00343978    0.00449642
C    0.39634807   -1.56322936   -0.02293863   -0.01243499    0.03137540    0.00982483
C    1.68839133    1.25179138    0.07372262    0.01733052   -0.00151307    0.00402032
C    1.74319325   -1.24233873   -0.07596858    0.01826766    0.02522662   -0.00451826
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C    2.29668372    0.02505460    0.01846221   -0.01202853   -0.01792321    0.00593205
H    3.34872959    0.17779086   -0.05158328   -0.01993747    0.01408680   -0.00066348
   15
   -420.53929712
H   -2.60482945    0.54917196   -0.18542220    0.00548049    0.00016829   -0.00441060
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O   -1.91944462   -1.28392586    0.09962573    0.01507187    0.01063488    0.00775038
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   15
   -420.53993855
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   15
   -420.54041899
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   15
   -420.54078095
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   15
   -420.54103285
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   15
   -420.54122754
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   15
   -420.54139554
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   15
   -420.54153012
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   15
   -420.54159123
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   15
   -420.54152883
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   15
   -420.54124697
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   15
   -420.54077945
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   15
   -420.54020722
H   -2.65298651    0.51446207   -0.12868232   -0.00724644   -0.00214314   -0.00372777
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   15
   -420.53959676
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   15
   -420.53900187
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   15
   -420.53841443
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O   -1.94244412   -1.28643092    0.07288806   -0.02046642   -0.01673093    0.00569943
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C   -0.79692520   -0.74538903   -0.01290622    0.00524712    0.03069414   -0.00560565
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C    1.69840067    1.25472248    0.10573178   -0.01443712    0.01341611    0.01162347
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   15
   -420.53781182
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O   -1.94247716   -1.28554411    0.07039737   -0.01905797   -0.01646093    0.00494133
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C   -0.79984248   -0.74445832   -0.01106841    0.00072705    0.02981839   -0.00407910
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   15
   -420.53718925
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C    2.37277531    0.04025154   -0.07808688    0.03888890    0.01482837   -0.02525999
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   15
   -420.53653286
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O   -1.94191855   -1.28321836    0.06525706   -0.01458227   -0.01487457    0.00331558
C   -0.78197732    0.77266256   -0.05734004   -0.00295803    0.03108635   -0.00323107
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C    1.70668407    1.25162408    0.10719126   -0.01315506    0.00123488    0.00923581
C    1.73714772   -1.27588120   -0.01697802   -0.01381910   -0.02145755    0.02354246
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C    2.37550090    0.04016955   -0.08071300    0.03860269    0.01488915   -0.02567025
H    3.43756352   -0.05137929    0.03132065   -0.01182736   -0.01141086    0.00254564
   15
   -420.53581212
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O   -2.02725220    1.25691366   -0.06068882   -0.00582406   -0.02013385    0.00187112
O   -1.94137759   -1.28179739    0.06262585   -0.01159432   -0.01359198    0.00246815
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C   -0.80835789   -0.74426615   -0.00528211   -0.01473035    0.02357708    0.00080297
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C    0.41432762   -1.62860569   -0.02271887    0.01757460   -0.01936737   -0.01091446
C    1.70985673    1.25046706    0.10738047   -0.01151755   -0.00271460    0.00834695
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   15
   -420.53507199
H   -2.64257312    0.48749716   -0.03887844   -0.00206738    0.00830510   -0.00006238
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O   -1.94070549   -1.28022249    0.05996664   -0.00820256   -0.01203373    0.00162241
C   -0.77909416    0.78289257   -0.05796808    0.00718115    0.04382999   -0.00346417
C   -0.81085814   -0.74496410   -0.00334434   -0.02017890    0.02051641    0.00245963
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C    1.73902745   -1.27479360   -0.01701969   -0.00357901   -0.02512741    0.02121189
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   15
   -420.53434857
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O   -1.93994062   -1.27851127    0.05728901   -0.00452150   -0.01026300    0.00078410
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C   -0.81305337   -0.74597182   -0.00144373   -0.02556217    0.01709888    0.00408924
C    0.31749491    1.58911281    0.01076200   -0.01038453   -0.01515696   -0.00821683
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C    1.71668400    1.24832181    0.10739094   -0.00572760   -0.00816465    0.00708566
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C    2.38036618    0.03858161   -0.08624183    0.02680952    0.01405376   -0.02647134
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   15
   -420.53371718
H   -2.63458593    0.46839940   -0.01483723   -0.00391060    0.00484232    0.00088035
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C   -0.77664048    0.79048691   -0.05838603    0.01634282    0.05355516   -0.00381247
C   -0.81486252   -0.74723775    0.00039512   -0.03065985    0.01342069    0.00566218
C    0.31487765    1.58896403    0.00878713   -0.01715940   -0.01694715   -0.00906504
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C    1.72025114    1.24741553    0.10723109   -0.00163466   -0.00926379    0.00687212
C    1.74112823   -1.27220648   -0.01834122    0.00576308   -0.02481868    0.01825186
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H    2.46724175   -2.06349868   -0.02542878   -0.00300742    0.01219191   -0.00164730
C    2.38108066    0.03761916   -0.08728833    0.02147994    0.01321672   -0.02640711
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   15
   -420.53330496
H   -2.62962986    0.45736729   -0.00301082   -0.00499407    0.00239256    0.00145357
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O   -1.93830065   -1.27476194    0.05191623    0.00311270   -0.00631819   -0.00080996
C   -0.77575032    0.79310460   -0.05850992    0.01991298    0.05690092   -0.00402028
C   -0.81620867   -0.74870640    0.00214846   -0.03528112    0.00958469    0.00714898
C    0.31251937    1.58906939    0.00694908   -0.02353164   -0.01701654   -0.00972509
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C    1.72384218    1.24664787    0.10696695    0.00312643   -0.00917314    0.00699212
C    1.74208222   -1.27034647   -0.01942735    0.00882081   -0.02228994    0.01651944
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H    2.30371843    2.15228279    0.37105378   -0.00185711    0.01263752    0.00963412
H    2.46916078   -2.05968217   -0.00708790   -0.00311560    0.01282664   -0.00074138
C    2.38146991    0.03645736   -0.08793586    0.01652591    0.01197457   -0.02609959
H    3.47214346   -0.08167672    0.01570829    0.00800629   -0.01502352    0.00296670
   15
   -420.53309363
H   -2.62377902    0.44590560    0.00855361   -0.00582437   -0.00010681    0.00207179
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O   -1.93751185   -1.27276840    0.04923915    0.00672635   -0.00432322   -0.00154967
C   -0.77516004    0.79486340   -0.05857301    0.02249189    0.05905259   -0.00424344
C   -0.81702221   -0.75031989    0.00379386   -0.03920874    0.00570335    0.00852298
C    0.31051604    1.58943001    0.00525784   -0.02922366   -0.01539253   -0.01018663
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   15
   -420.53308731
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   15
   -420.53323651
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   15
   -420.53346833
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   15
   -420.53376409
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   15
   -420.53415954
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   15
   -420.53465643
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   15
   -420.53525604
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C    2.37853901    0.02342837   -0.08008187    0.01517872   -0.00759247   -0.01611707
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   15
   -420.53592384
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O   -1.93602700   -1.25654064    0.02901749    0.01187155    0.00381954   -0.00526713
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C   -0.80080817   -0.76202947    0.01107216   -0.02653426   -0.01574871    0.01364852
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   15
   -420.53655501
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C    1.74449218    1.24148474    0.09670971    0.03444133   -0.00139360    0.00990841
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   15
   -420.53707513
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O   -1.93719039   -1.25280398    0.02448074    0.00622512    0.00339113   -0.00558698
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   15
   -420.53740159
H   -2.52790477    0.36331736    0.09107134    0.01247463   -0.00019252    0.00544904
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O   -1.93789473   -1.25099480    0.02230660    0.00301988    0.00302254   -0.00566553
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C    1.74281190    1.24025757    0.09272353    0.02758763   -0.00939788    0.00727904
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C    2.37245568    0.01827777   -0.06956833    0.01803973   -0.01251254   -0.01010374
H    3.44482257    0.05720351   -0.05602880   -0.00999142    0.00467693   -0.00215270
   15
   -420.53748692
H   -2.52522261    0.35901618    0.09312372    0.01298340   -0.00011453    0.00559561
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O   -1.93863329   -1.24921989    0.02019667   -0.00022397    0.00263540   -0.00569071
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C   -0.78152097   -0.76327737    0.00997725    0.00611767   -0.01817488    0.01241499
C    0.32774995    1.59601594   -0.00270067   -0.00799526    0.00542962   -0.01107289
C    0.38629750   -1.59516645    0.01072808   -0.01060280   -0.00634635    0.00240421
C    1.74131826    1.23982633    0.09055518    0.02345980   -0.01287258    0.00613147
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   15
   -420.53737098
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   15
   -420.53712780
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O   -1.94006766   -1.24575570    0.01617000   -0.00627129    0.00196692   -0.00557517
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   15
   -420.53687162
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O   -1.94069509   -1.24405887    0.01425193   -0.00887170    0.00175446   -0.00542271
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C    0.33964476    1.59538178   -0.00102742    0.00947861    0.00555938   -0.00978373
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C    1.73495855    1.23983115    0.08353997    0.01161309   -0.01702086    0.00446904
C    1.73736959   -1.24428102   -0.04601380    0.02032144    0.00351406   -0.01309115
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   15
   -420.53670291
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O   -1.94122222   -1.24238206    0.01239530   -0.01110795    0.00166581   -0.00520495
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C   -0.76368987   -0.76020110    0.00591397    0.03777003   -0.01677721    0.00944249
C    0.34343697    1.59501452   -0.00016280    0.01460149    0.00748625   -0.00900593
C    0.38017952   -1.57675211    0.01965585   -0.02291136   -0.00137583    0.00572725
C    1.73241100    1.24033497    0.08105942    0.00840790   -0.01584306    0.00454748
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   15
   -420.53672435
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O   -1.94162372   -1.24072425    0.01059765   -0.01294056    0.00170804   -0.00492020
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C   -0.76038106   -0.75877551    0.00451008    0.04368019   -0.01567202    0.00850267
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   15
   -420.53696573
H   -2.55159634    0.33915180    0.08287025    0.00227281   -0.00689916    0.00660244
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O   -1.94187880   -1.23908596    0.00885576   -0.01436080    0.00189868   -0.00456970
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C   -0.75773123   -0.75711343    0.00297771    0.04840224   -0.01419130    0.00750233
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C    1.72697319    1.24201954    0.07588618    0.00357730   -0.00980404    0.00539392
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C    2.35440416    0.01623074   -0.04602337   -0.00727063   -0.00857022   -0.00143727
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   15
   -420.53734525
H   -2.55999183    0.33880510    0.07709930   -0.00035511   -0.00776659    0.00642911
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O   -1.94197134   -1.23746937    0.00716565   -0.01535711    0.00224028   -0.00415761
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C   -0.75581167   -0.75523726    0.00133197    0.05180588   -0.01231984    0.00645024
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H    2.36497458   -2.09545417    0.12934395   -0.00879471    0.00623104    0.00975136
C    2.35189243    0.01657737   -0.04243404   -0.00779187   -0.00707591   -0.00051569
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   15
   -420.53772918
H   -2.56832702    0.33985018    0.07017335   -0.00272281   -0.00820232    0.00609185
O   -2.03963170    1.21255763   -0.03093065   -0.02194880    0.01658804   -0.00254120
O   -1.94189007   -1.23587834    0.00552265   -0.01592487    0.00274182   -0.00368649
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C   -0.75467363   -0.75317528   -0.00041124    0.05377080   -0.01006368    0.00535143
C    0.35573410    1.59193620    0.00451421    0.03050166    0.02135821   -0.00507288
C    0.37936090   -1.55818245    0.02724141   -0.02360037    0.01148108    0.00698696
C    1.72131024    1.24427899    0.07038483    0.00046103   -0.00033422    0.00660259
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C    2.34949691    0.01703087   -0.03883676   -0.00700246   -0.00546279    0.00027923
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   15
   -420.53814123
H   -2.57617847    0.34236475    0.06215315   -0.00467366   -0.00813162    0.00559277
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O   -1.94162855   -1.23431854    0.00392141   -0.01605933    0.00338577   -0.00316219
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C   -0.75434675   -0.75096158   -0.00223531    0.05422935   -0.00745344    0.00421279
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C    1.71845745    1.24545366    0.06748914   -0.00097694    0.00465754    0.00708219
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H    2.36417745   -2.11645382    0.10431527   -0.00281784   -0.00326450    0.00989435
C    2.34720584    0.01756686   -0.03524354   -0.00504255   -0.00375851    0.00093909
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   15
   -420.53856160
H   -2.58319629    0.34633393    0.05312780   -0.00609598   -0.00746547    0.00496061
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O   -1.94118528   -1.23279725    0.00235601   -0.01574246    0.00415927   -0.00259709
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C   -0.75483790   -0.74863550   -0.00412303    0.05314277   -0.00456320    0.00303481
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C    0.38111325   -1.54971561    0.03041458   -0.01795349    0.02077654    0.00690033
C    1.71561988    1.24655857    0.06448656   -0.00278669    0.00907950    0.00738234
C    1.71923981   -1.24494945   -0.04617424   -0.01341726    0.00471157   -0.01560035
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H    2.44109509    2.03378652    0.16746336    0.00219146   -0.01528448    0.00108196
H    2.36482057   -2.12651121    0.08913189    0.00005451   -0.00777866    0.00953987
C    2.34498990    0.01815969   -0.03166437   -0.00216567   -0.00204675    0.00147323
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   15
   -420.53904460
H   -2.58912518    0.35163822    0.04321127   -0.00691612   -0.00618782    0.00421608
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O   -1.94056388   -1.23132323    0.00082005   -0.01495612    0.00506152   -0.00200061
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C   -0.75613068   -0.74624065   -0.00605660    0.05052438   -0.00148707    0.00182231
C    0.36034639    1.58650284    0.00888632    0.03835240    0.02611415   -0.00251108
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C    1.71282529    1.24752761    0.06137260   -0.00529596    0.01235010    0.00746344
C    1.71670742   -1.24515649   -0.04527257   -0.01905440    0.00559265   -0.01496103
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H    2.43516253    2.03480786    0.14540907    0.00019135   -0.01705578    0.00034463
H    2.36546243   -2.13517905    0.07223592    0.00238353   -0.01150355    0.00883697
C    2.34280612    0.01878355   -0.02810732    0.00121756   -0.00039141    0.00189667
H    3.42639068    0.10656317   -0.08356643   -0.00007866    0.00994051   -0.00303710
   15
   -420.53966429
H   -2.59381900    0.35804795    0.03253631   -0.00708016   -0.00430885    0.00342533
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O   -1.93977328   -1.22990667   -0.00069324   -0.01367318    0.00606619   -0.00138242
C   -0.77105968    0.70466322   -0.03606379   -0.01784366   -0.04390422   -0.00554182
C   -0.75818556   -0.74382342   -0.00801767    0.04642226    0.00166102    0.00057495
C    0.36077291    1.58391453    0.01043540    0.04024870    0.02393326   -0.00186674
C    0.38393663   -1.54249839    0.03317188   -0.00934432    0.02876018    0.00651871
C    1.71011186    1.24831185    0.05814601   -0.00868912    0.01403057    0.00735375
C    1.71446182   -1.24544704   -0.04414517   -0.02361564    0.00562287   -0.01393975
H    0.13707852    2.63035211    0.04671371    0.00590984   -0.01123070   -0.00020453
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   15
   -420.54044457
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   15
   -420.54130281
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C    2.33595189    0.02060329   -0.01762903    0.00888287    0.00348963    0.00291160
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   15
   -420.54213406
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C   -0.76820074   -0.73690410   -0.01387508    0.02632105    0.01013053   -0.00333868
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H    2.36173736   -2.14570436   -0.00909916    0.00359969   -0.01434980    0.00330206
C    2.33343867    0.02112754   -0.01421766    0.00867029    0.00426858    0.00329842
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   15
   -420.54274993
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O   -1.93529971   -1.22506012   -0.00666098   -0.00323973    0.01098545    0.00111417
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C    1.70124003    1.24948497    0.04416114   -0.02619528    0.00496048    0.00665027
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C    2.33079667    0.02158756   -0.01085624    0.00650942    0.00479422    0.00375422
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   15
   -420.54308803
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C   -0.77703512   -0.73298086   -0.01756058    0.00819674    0.01378245   -0.00602394
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C    0.39213869   -1.53247765    0.03841060    0.01441962    0.03130336    0.00521620
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C    2.32805850    0.02197539   -0.00755168    0.00251183    0.00508776    0.00427792
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   15
   -420.54300377
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O   -1.93271075   -1.22332639   -0.00969235    0.00488722    0.01374592    0.00228687
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C   -0.78170826   -0.73131900   -0.01927688   -0.00158940    0.01480439   -0.00735440
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C    1.70938029   -1.24801170   -0.03376158   -0.02102855   -0.01109140   -0.00437169
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C    2.32528406    0.02228653   -0.00431185   -0.00289023    0.00518218    0.00484228
H    3.40294491    0.01750225   -0.06453120   -0.00610544   -0.00212670   -0.00134902
   15
   -420.54253913
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O   -1.93147569   -1.22268554   -0.01124364    0.00937493    0.01510054    0.00284200
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C    1.69839672    1.24944261    0.03260018   -0.02977942   -0.00715374    0.00680154
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H    2.37919971    2.12330457   -0.02573588    0.00842209    0.00943014   -0.00445399
H    2.35053206   -2.11928898   -0.09991335   -0.00623208   -0.00023932   -0.00247870
C    2.32255426    0.02251957   -0.00114524   -0.00907309    0.00506942    0.00541288
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   15
   -420.54176282
H   -2.59812370    0.39891812   -0.06421153   -0.00307933    0.00913213   -0.00137417
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O   -1.93034704   -1.22221591   -0.01282716    0.01392496    0.01636639    0.00337476
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C   -0.79083366   -0.72867256   -0.02235630   -0.02104837    0.01534601   -0.00991112
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C    1.69834613    1.24956777    0.02854220   -0.02757713   -0.00986889    0.00678102
C    1.71060425   -1.24811861   -0.02950529   -0.01150941   -0.01735290   -0.00184888
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C    2.31996177    0.02267623    0.00193958   -0.01535088    0.00472831    0.00595034
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   15
   -420.54077143
H   -2.59624892    0.39771098   -0.07613320   -0.00458541    0.00733650   -0.00197181
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O   -1.92937621   -1.22193179   -0.01444893    0.01831947    0.01747623    0.00388441
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C   -0.79499251   -0.72769637   -0.02368081   -0.03005224    0.01503272   -0.01110508
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H    2.35482426    2.14389118   -0.06310421    0.00643220    0.01323711   -0.00584985
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C    2.31760073    0.02276173    0.00493450   -0.02110730    0.00411098    0.00642441
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   15
   -420.53967286
H   -2.59354583    0.39519111   -0.08769828   -0.00629868    0.00499195   -0.00267323
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C   -0.79869811   -0.72694719   -0.02483752   -0.03812203    0.01449458   -0.01220882
C    0.33383089    1.55304016    0.02614325   -0.00150578   -0.02982416    0.00325752
C    0.39535414   -1.53370957    0.04166783    0.02488303    0.01743172    0.00413363
C    1.69943252    1.25028608    0.02012181   -0.01856980   -0.01187577    0.00623934
C    1.71252898   -1.24720499   -0.02513570   -0.00287848   -0.01797517    0.00038559
H    0.10518379    2.62967639   -0.00241532    0.00205440    0.00842190   -0.00203090
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C    2.31555756    0.02278544    0.00783239   -0.02584371    0.00318749    0.00681295
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   15
   -420.53855038
H   -2.58971082    0.39177489   -0.09878105   -0.00787997    0.00249128   -0.00344601
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O   -1.92810215   -1.22196733   -0.01783008    0.02570955    0.01887490    0.00482639
C   -0.72952511    0.72292238   -0.01045792    0.04177731    0.01515416   -0.00017554
C   -0.80182888   -0.72641708   -0.02580975   -0.04491121    0.01388469   -0.01321346
C    0.32940493    1.55139289    0.02756391   -0.01139530   -0.03015203    0.00363092
C    0.39494332   -1.53491220    0.04211923    0.02492725    0.01570792    0.00392753
C    1.70043393    1.25090934    0.01576772   -0.01229190   -0.01100047    0.00561778
C    1.71358834   -1.24633937   -0.02295122    0.00017060   -0.01553375    0.00165863
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H    2.32602791    2.15525839   -0.09630115    0.00092552    0.01184360   -0.00655958
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C    2.31390353    0.02276141    0.01062738   -0.02924814    0.00191558    0.00711303
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   15
   -420.53744486
H   -2.58446338    0.38790726   -0.10924333   -0.00900398    0.00018647   -0.00423896
O   -1.98000189    1.17607393   -0.00665668    0.00902568   -0.03288522    0.00370542
O   -1.92788233   -1.22230274   -0.01960015    0.02824894    0.01899697    0.00525467
C   -0.72784605    0.72536049   -0.00793033    0.04516183    0.02214180    0.00035874
C   -0.80428254   -0.72609699   -0.02658234   -0.05013144    0.01334572   -0.01409459
C    0.32515092    1.55019991    0.02892971   -0.02099153   -0.02919056    0.00396447
C    0.39415628   -1.53635332    0.04251125    0.02440929    0.01480232    0.00371451
C    1.70162032    1.25169753    0.01132900   -0.00530038   -0.00895930    0.00473259
C    1.71464625   -1.24524085   -0.02079208    0.00229219   -0.01146800    0.00312787
H    0.09311422    2.61363590   -0.00925122    0.00273951    0.00056037   -0.00222674
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H    2.31111079    2.15764850   -0.11115554   -0.00280986    0.00932776   -0.00656097
H    2.36155225   -2.08648458   -0.20269553   -0.00796152    0.00606077   -0.00797373
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   15
   -420.53637029
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   15
   -420.53534060
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   15
   -420.53444111
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C    1.70522326    1.25468301   -0.00234318    0.01543952    0.00087778    0.00082448
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   15
   -420.53373614
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O   -1.93030600   -1.22572678   -0.02731768    0.02749031    0.01461964    0.00651485
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C    2.31242483    0.02273840    0.02294174   -0.02284629   -0.00750571    0.00760692
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   15
   -420.53342284
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O   -1.93172683   -1.22704125   -0.02942425    0.02457650    0.01240405    0.00667088
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   15
   -420.53352529
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C    0.31011380    1.55115695    0.03570083   -0.04767471   -0.01900790    0.00625571
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   15
   -420.53402751
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C    1.70665390    1.25847209   -0.02066154    0.02564232    0.00242384   -0.00356440
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   15
   -420.53480045
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O   -1.93748145   -1.23171128   -0.03619995    0.01173321    0.00439287    0.00662409
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   15
   -420.53568968
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   15
   -420.53652502
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O   -1.94206727   -1.23512610   -0.04109263    0.00200270   -0.00103479    0.00613362
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C    1.72079734   -1.23626292   -0.00529411    0.01504462    0.01084537    0.00881123
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   15
   -420.53722486
H   -2.47210695    0.36376754   -0.15560630    0.01430437    0.00179398   -0.00638046
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O   -1.94442188   -1.23683125   -0.04364481   -0.00261673   -0.00350502    0.00574637
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C    2.32236629    0.02762172    0.03527073   -0.00232661   -0.01046821    0.00942545
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   15
   -420.53771609
H   -2.46840410    0.36130757   -0.15287018    0.01466872    0.00060373   -0.00650029
O   -1.94239273    1.20075454    0.00530101    0.03816558   -0.01758375    0.00595079
O   -1.94674711   -1.23849687   -0.04626209   -0.00688330   -0.00573503    0.00527602
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C    1.70073858    1.26331137   -0.04240167    0.00660256   -0.01549102   -0.00528662
C    1.72008651   -1.23660284   -0.00395067    0.01843215    0.00269741    0.00542063
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H    2.41868946   -2.02767194   -0.24914005   -0.00018480    0.00900760   -0.01153061
C    2.32407150    0.02898967    0.03651131   -0.00337290   -0.00951602    0.01002767
H    3.40668997    0.00981975    0.00300602   -0.00336607   -0.00338299    0.00226549
   15
   -420.53804258
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   15
   -420.53830768
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   15
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   15
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   15
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   15
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   15
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   15
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   15
   -420.53995088
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   15
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   15
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   15
   -420.55043196
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   15
   -420.54866447
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   15
   -420.54623007
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   15
   -420.54356770
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   15
   -420.54103871
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   15
   -420.53881196
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   15
   -420.53688680
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C    1.65722731    1.26201385   -0.01668950   -0.03161433    0.01071495   -0.00651721
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   15
   -420.53513475
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   15
   -420.53348086
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   15
   -420.53206889
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O   -2.00480658   -1.28315795   -0.01643988   -0.05580740   -0.02292201   -0.00757268
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   15
   -420.53102642
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O   -2.00634733   -1.28334707   -0.01775090   -0.05582066   -0.02219806   -0.00814286
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   15
   -420.53072108
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C    2.36740654    0.03750586    0.01234634    0.02443378   -0.02112853    0.00812071
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   15
   -420.53133089
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O   -2.00754469   -1.28298536   -0.02009077   -0.05250300   -0.01920812   -0.00897134
C   -0.73320281    0.66540921    0.04368264    0.05925163   -0.05132926    0.00464409
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C    0.28440911    1.59132350    0.02749995   -0.00869722    0.01074454    0.00626038
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C    1.64891879    1.24963607   -0.02743540   -0.04227861   -0.01047529   -0.00989411
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H    2.38709298   -2.05885001   -0.00839180   -0.01200532    0.01112175    0.00317534
C    2.36880812    0.03938354    0.01277254    0.02365950   -0.01832799    0.00842313
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   15
   -420.53280175
H   -2.62681763    0.54113108   -0.05820839    0.01193907    0.01417570   -0.00026570
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O   -2.00723897   -1.28246846   -0.02111024   -0.04912386   -0.01693954   -0.00919822
C   -0.73617557    0.66676200    0.04671010    0.05666831   -0.04823459    0.00497113
C   -0.80989234   -0.78557796    0.06316666    0.03062518    0.02899385    0.01801584
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C    0.39349857   -1.61356434   -0.00117038    0.00975451   -0.02323131   -0.00607415
C    1.64978561    1.24782452   -0.02874310   -0.03900159   -0.01309187   -0.01021719
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H    2.39150053   -2.05884055   -0.01244228   -0.01131118    0.01078193    0.00321835
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   15
   -420.53475280
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O   -2.00637710   -1.28175985   -0.02202549   -0.04457126   -0.01415930   -0.00928303
C   -0.74000413    0.66884308    0.04966242    0.05325564   -0.04431420    0.00527650
C   -0.81373042   -0.79099088    0.06613492    0.02621100    0.02175242    0.01841246
C    0.28370434    1.59069627    0.03067921   -0.00839758    0.01685497    0.00636629
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C    1.73364697   -1.21782812   -0.03712566    0.01119960    0.01332787   -0.01159740
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   15
   -420.53679102
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O   -2.00501066   -1.28089106   -0.02283556   -0.03887212   -0.01088074   -0.00921292
C   -0.74463682    0.67159328    0.05253499    0.04893167   -0.03967614    0.00555280
C   -0.81796365   -0.79673178    0.06882500    0.02080745    0.01374205    0.01860975
C    0.28354278    1.59002629    0.03212458   -0.00869320    0.02153458    0.00621708
C    0.39324753   -1.61134537   -0.00012961    0.00551578   -0.01745247   -0.00596198
C    1.65321369    1.24482527   -0.03089124   -0.02863669   -0.01685213   -0.01069308
C    1.73536032   -1.21914186   -0.03851250    0.00998976    0.01293949   -0.01195012
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H    2.40601532   -2.06424638   -0.02228486   -0.00631810    0.00585061    0.00322594
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   15
   -420.53846806
H   -2.65124718    0.53721612   -0.06912758   -0.00573719   -0.00383360   -0.00114303
O   -2.00584973    1.29674526   -0.04205127   -0.02541540    0.03116254   -0.00588033
O   -2.00320429   -1.27989928   -0.02354125   -0.03206451   -0.00713522   -0.00898767
C   -0.75000815    0.67494266    0.05532365    0.04362626   -0.03444367    0.00578647
C   -0.82251037   -0.80267987    0.07123406    0.01446236    0.00519247    0.01856834
C    0.28351287    1.58903000    0.03347610   -0.00914837    0.02678646    0.00595218
C    0.39298072   -1.60981688    0.00052658    0.00326367   -0.01381452   -0.00578577
C    1.65561894    1.24369462   -0.03172449   -0.02213525   -0.01814224   -0.01084450
C    1.73692328   -1.22065156   -0.03971877    0.00824234    0.01282449   -0.01220317
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H    2.41523347   -2.06878649   -0.02807757   -0.00271448    0.00211230    0.00314089
C    2.37070274    0.04909714    0.01317754    0.03019134   -0.00176496    0.00883094
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   15
   -420.53957424
H   -2.65881848    0.53579732   -0.07243243   -0.01088256   -0.00873274   -0.00143938
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O   -2.00103513   -1.27882694   -0.02414515   -0.02422949   -0.00297590   -0.00859932
C   -0.75603778    0.67881221    0.05802490    0.03725298   -0.02870418    0.00596393
C   -0.82727468   -0.80870607    0.07336265    0.00723212   -0.00369271    0.01831399
C    0.28362127    1.58762873    0.03473773   -0.00958962    0.03200815    0.00560343
C    0.39266467   -1.60807984    0.00127015    0.00096575   -0.00993951   -0.00552553
C    1.65835839    1.24283806   -0.03239384   -0.01523792   -0.01924189   -0.01094065
C    1.73836170   -1.22235507   -0.04074069    0.00640490    0.01258220   -0.01233554
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H    2.30166517    2.11781558   -0.06078391   -0.00168803   -0.00392032    0.00058533
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C    2.37012467    0.05176299    0.01294612    0.03285877    0.00303760    0.00874678
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   15
   -420.54012044
H   -2.66445325    0.53592699   -0.07547920   -0.01448130   -0.01199801   -0.00166790
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O   -1.99859191   -1.27772127   -0.02465168   -0.01551557    0.00155923   -0.00804805
C   -0.76262928    0.68311522    0.06063605    0.02975310   -0.02253282    0.00607250
C   -0.83214743   -0.81467628    0.07521466   -0.00075526   -0.01269586    0.01782601
C    0.28387437    1.58574441    0.03591469   -0.00980526    0.03646816    0.00521163
C    0.39233415   -1.60619266    0.00209720   -0.00137442   -0.00598226   -0.00519305
C    1.66132824    1.24227243   -0.03289785   -0.00835625   -0.02034858   -0.01096772
C    1.73970289   -1.22424819   -0.04157626    0.00486420    0.01182436   -0.01233660
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H    2.29112246    2.12238297   -0.06549224   -0.00436619   -0.00501766    0.00049859
H    2.43445770   -2.07831707   -0.04132524    0.00454486   -0.00520288    0.00271397
C    2.36905064    0.05438298    0.01258253    0.03482552    0.00779052    0.00859619
H    3.44329182    0.09709475    0.00896663   -0.00691421    0.00017367    0.00101994
   15
   -420.54023259
H   -2.66750754    0.53819007   -0.07822693   -0.01624459   -0.01343032   -0.00180846
O   -1.99395836    1.29907529   -0.04785882   -0.00032800    0.03468024   -0.00529921
O   -1.99597330   -1.27663350   -0.02506704   -0.00612314    0.00633826   -0.00735889
C   -0.76966924    0.68775847    0.06315550    0.02111031   -0.01598904    0.00608858
C   -0.83700811   -0.82045469    0.07679739   -0.00930703   -0.02159552    0.01712835
C    0.28427522    1.58331057    0.03701281   -0.00958971    0.03938823    0.00484638
C    0.39202441   -1.60421489    0.00300269   -0.00369913   -0.00217763   -0.00479208
C    1.66442493    1.24201472   -0.03323612   -0.00186670   -0.02165602   -0.01091903
C    1.74096981   -1.22631916   -0.04222545    0.00389500    0.01030319   -0.01220998
H   -0.01842689    2.60832297   -0.03388866   -0.00204162   -0.01135424    0.00000188
H    0.19190348   -2.67888707   -0.00885555   -0.00076572   -0.00312761    0.00197388
H    2.28135918    2.12784612   -0.07028998   -0.00658441   -0.00559772    0.00038857
H    2.44316908   -2.08200235   -0.04870334    0.00745134   -0.00792775    0.00237558
C    2.36745181    0.05688542    0.01208903    0.03535038    0.01234573    0.00838964
H    3.43622203    0.09606624    0.00884162   -0.01124645   -0.00023804    0.00118372
   15
   -420.54007727
H   -2.66766638    0.54284420   -0.08065054   -0.01599961   -0.01301705   -0.00184534
O   -1.98986761    1.29906235   -0.04967119    0.00627857    0.03131396   -0.00503606
O   -1.99328559   -1.27561772   -0.02539904    0.00366367    0.01123792   -0.00654978
C   -0.77702703    0.69264308    0.06558301    0.01136010   -0.00912512    0.00600338
C   -0.84172771   -0.82590695    0.07812139   -0.01817780   -0.03018537    0.01623924
C    0.28482034    1.58028386    0.03803756   -0.00878003    0.04010978    0.00455335
C    0.39177053   -1.60220381    0.00398058   -0.00595922    0.00131095   -0.00433259
C    1.66755075    1.24208483   -0.03340941    0.00392015   -0.02328835   -0.01078074
C    1.74217692   -1.22854484   -0.04269017    0.00367435    0.00789199   -0.01196898
H   -0.01801770    2.60264494   -0.03356028   -0.00200330   -0.01353042    0.00024379
H    0.20464323   -2.67991946   -0.01326568    0.00063170   -0.00367291    0.00178172
H    2.27277238    2.13430546   -0.07515707   -0.00816997   -0.00543454    0.00023779
H    2.45055076   -2.08427454   -0.05650825    0.00954453   -0.00967800    0.00197749
C    2.36532102    0.05920162    0.01146875    0.03380427    0.01656075    0.00813200
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   15
   -420.53979557
H   -2.66497305    0.54981425   -0.08274337   -0.01376570   -0.01074400   -0.00177836
O   -1.98584715    1.29869626   -0.05142649    0.01185196    0.02567059   -0.00473053
O   -1.99063949   -1.27472933   -0.02565681    0.01349329    0.01607234   -0.00565960
C   -0.78455537    0.69766533    0.06791989    0.00060803   -0.00198857    0.00580765
C   -0.84617248   -0.83090345    0.07920005   -0.02703881   -0.03824855    0.01519726
C    0.28549740    1.57665382    0.03899334   -0.00731778    0.03827726    0.00436488
C    0.39160656   -1.60021206    0.00502395   -0.00806627    0.00436176   -0.00383485
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C    1.74332746   -1.23088869   -0.04297402    0.00429028    0.00455137   -0.01163653
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H    2.26564591    2.14173090   -0.08006617   -0.00903016   -0.00444231    0.00003072
H    2.45622715   -2.08482111   -0.06466860    0.01070264   -0.01032209    0.00154388
C    2.36268202    0.06126798    0.01072557    0.02987632    0.02030967    0.00783241
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   15
   -420.53935792
H   -2.65983011    0.55869407   -0.08451755   -0.00961444   -0.00678226   -0.00160022
O   -1.98196016    1.29804088   -0.05312822    0.01636507    0.01792970   -0.00437349
O   -1.98814606   -1.27402306   -0.02585044    0.02291349    0.02067938   -0.00472546
C   -0.79209196    0.70271742    0.07016909   -0.01093197    0.00534471    0.00550099
C   -0.85020899   -0.83532262    0.08004905   -0.03548070   -0.04555957    0.01405163
C    0.28628441    1.57244814    0.03988298   -0.00528754    0.03391582    0.00429040
C    0.39156446   -1.59828555    0.00612527   -0.01000297    0.00686689   -0.00330918
C    1.67355425    1.24331205   -0.03327076    0.01267319   -0.02738413   -0.01023311
C    1.74441216   -1.23330030   -0.04308201    0.00572930    0.00032800   -0.01123617
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H    2.26013503    2.14994429   -0.08497998   -0.00919107   -0.00265968   -0.00023841
H    2.45999023   -2.08352687   -0.07310701    0.01086956   -0.00981204    0.00110973
C    2.35959407    0.06302795    0.00986401    0.02369218    0.02348089    0.00749720
H    3.42839824    0.09342367    0.00707756   -0.01211003   -0.00079609    0.00162201
   15
   -420.53860101
H   -2.65298041    0.56877303   -0.08600457   -0.00386323   -0.00135985   -0.00133721
O   -1.97825787    1.29718375   -0.05478038    0.01989408    0.00845118   -0.00398558
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C   -0.79946268    0.70768856    0.07233526   -0.02296264    0.01279457    0.00508975
C   -0.85371013   -0.83905408    0.08068562   -0.04306233   -0.05193881    0.01285506
C    0.28715093    1.56773222    0.04070763   -0.00289944    0.02745422    0.00431248
C    0.39167319   -1.59646208    0.00727663   -0.01161922    0.00879351   -0.00276788
C    1.67629969    1.24453054   -0.03296709    0.01555262   -0.02941668   -0.00983143
C    1.74540927   -1.23571592   -0.04302016    0.00793667   -0.00468349   -0.01079592
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H    0.24110722   -2.67898506   -0.02825915    0.00509997   -0.00330877    0.00110353
H    2.25627020    2.15862789   -0.08985004   -0.00876048   -0.00028073   -0.00056441
H    2.46181175   -2.08048113   -0.08174559    0.01002356   -0.00821936    0.00070401
C    2.35614995    0.06443374    0.00888913    0.01582185    0.02596535    0.00713588
H    3.43042511    0.09280211    0.00593895   -0.00835902   -0.00078175    0.00174190
   15
   -420.53741213
H   -2.64545122    0.57908421   -0.08725158    0.00290090    0.00493801   -0.00101335
O   -1.97478057    1.29623185   -0.05638738    0.02270972   -0.00211919   -0.00354236
O   -1.98403309   -1.27335982   -0.02608711    0.03864268    0.02828953   -0.00298392
C   -0.80648610    0.71246624    0.07442457   -0.03507194    0.02024927    0.00460250
C   -0.85656182   -0.84200165    0.08112776   -0.04930693   -0.05717701    0.01166785
C    0.28806123    1.56260295    0.04146702   -0.00045503    0.01956478    0.00438312
C    0.39195700   -1.59477094    0.00846985   -0.01281803    0.01014647   -0.00222998
C    1.67881108    1.24619322   -0.03251486    0.01752057   -0.03097079   -0.00936503
C    1.74628560   -1.23806000   -0.04279511    0.01076047   -0.01029718   -0.01034244
H   -0.01165610    2.60251325   -0.03272920   -0.00539752   -0.00375542   -0.00008886
H    0.25178196   -2.67740345   -0.03370948    0.00658416   -0.00255973    0.00086915
H    2.25397644    2.16735738   -0.09461785   -0.00790554    0.00241191   -0.00093739
H    2.46184189   -2.07597020   -0.09051180    0.00828650   -0.00564006    0.00035738
C    2.35246763    0.06544793    0.00780638    0.00711487    0.02765190    0.00675764
H    3.43394087    0.09232048    0.00448698   -0.00351492   -0.00070290    0.00184514
   15
   -420.53581484
H   -2.63844415    0.58850674   -0.08831621    0.00963979    0.01120968   -0.00068510
O   -1.97156075    1.29530399   -0.05795427    0.02541458   -0.01266315   -0.00303576
O   -1.98259109   -1.27348877   -0.02614979    0.04397878    0.03086875   -0.00227930
C   -0.81297977    0.71693792    0.07644434   -0.04674436    0.02756967    0.00408145
C   -0.85867015   -0.84408637    0.08139335   -0.05379147   -0.06109629    0.01055102
C    0.28897871    1.55717864    0.04216013    0.00173450    0.01102108    0.00445806
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C    1.68105852    1.24832308   -0.03192107    0.01870827   -0.03163834   -0.00886711
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   15
   -420.53402022
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O   -1.98164595   -1.27396692   -0.02618646    0.04710688    0.03241635   -0.00175097
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   15
   -420.53245367
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O   -1.98123296   -1.27481169   -0.02620307    0.04780495    0.03279600   -0.00142905
C   -0.82369010    0.72452608    0.08030613   -0.06645764    0.04108607    0.00316963
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C    1.68469886    1.25400505   -0.03033895    0.01927426   -0.02909311   -0.00787488
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   15
   -420.53145514
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O   -1.98135997   -1.27602736   -0.02620328    0.04602825    0.03196913   -0.00132526
C   -0.82761009    0.72743870    0.08216178   -0.07337059    0.04686586    0.00291251
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C    1.68608292    1.25751819   -0.02936557    0.01890043   -0.02550783   -0.00742634
C    1.74768260   -1.24499230   -0.04039875    0.02218896   -0.03174884   -0.00849961
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   15
   -420.53124024
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O   -1.98200698   -1.27760461   -0.02618827    0.04191345    0.02997999   -0.00142924
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C   -0.85880740   -0.84294750    0.08099739   -0.04975823   -0.06182696    0.00752531
C    0.29219901    1.53505116    0.04425871    0.00370207   -0.01828788    0.00413859
C    0.39636057   -1.58876763    0.01478802   -0.01029812    0.01087157    0.00016645
C    1.68718156    1.26141508   -0.02827985    0.01823219   -0.02035040   -0.00703796
C    1.74728794   -1.24570796   -0.03946043    0.02301904   -0.03435471   -0.00786097
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H    2.25995326    2.19612536   -0.11454400   -0.00320936    0.01033295   -0.00265009
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   15
   -420.53171787
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C   -0.85684406   -0.84027956    0.08059102   -0.04353949   -0.05835248    0.00716077
C    0.29285439    1.52996600    0.04462089    0.00216776   -0.02272524    0.00382823
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C    1.68800479    1.26561791   -0.02708765    0.01733942   -0.01376133   -0.00670872
C    1.74654708   -1.24590662   -0.03840347    0.02232996   -0.03496426   -0.00703043
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H    2.44756286   -2.04918320   -0.14323240   -0.00501392    0.01067667   -0.00073765
C    2.33202466    0.06286969   -0.00062519   -0.02286783    0.01795171    0.00426808
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   15
   -420.53274824
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C   -0.83251455    0.73165952    0.08746100   -0.07781208    0.05759722    0.00362467
C   -0.85422419   -0.83673090    0.08007620   -0.03585978   -0.05363755    0.00691341
C    0.29347786    1.52522269    0.04492532   -0.00004789   -0.02572167    0.00342167
C    0.39932800   -1.58753406    0.01734588   -0.00477542    0.01019592    0.00100466
C    1.68856610    1.27002738   -0.02579398    0.01624879   -0.00601096   -0.00642598
C    1.74547048   -1.24557927   -0.03724050    0.02009127   -0.03344430   -0.00595780
H    0.03758235    2.60121543   -0.02907233   -0.00233508    0.01029831   -0.00077683
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H    2.26745207    2.19591142   -0.11957314   -0.00291771    0.00815684   -0.00288471
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C    2.32960757    0.06122535   -0.00229455   -0.02139693    0.01335063    0.00378305
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   15
   -420.53399293
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O   -1.98649309   -1.28422468   -0.02603053    0.01905020    0.01848290   -0.00266253
C   -0.83178970    0.73138088    0.08912614   -0.07370216    0.05838944    0.00444220
C   -0.85106336   -0.83237254    0.07945680   -0.02717950   -0.04787295    0.00671954
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C    2.32751195    0.05937974   -0.00402107   -0.01825314    0.00826421    0.00325940
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   15
   -420.53523220
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O   -1.98854948   -1.28691618   -0.02592491    0.00947205    0.01348757   -0.00322783
C   -0.82995347    0.73022137    0.09072379   -0.06721626    0.05764248    0.00552325
C   -0.84749221   -0.82729145    0.07873578   -0.01799000   -0.04122100    0.00656186
C    0.29476931    1.51692171    0.04538664   -0.00569838   -0.02762228    0.00237691
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C    1.68897214    1.27898771   -0.02291870    0.01340732    0.01137947   -0.00595922
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C    2.32569072    0.05740951   -0.00579681   -0.01382127    0.00290519    0.00269339
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   15
   -420.53629475
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O   -1.99071315   -1.28976044   -0.02578266   -0.00029836    0.00827352   -0.00380175
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C    0.29552208    1.51339325    0.04555933   -0.00860128   -0.02695057    0.00177153
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C    1.68886002    1.28327682   -0.02134420    0.01151438    0.02002507   -0.00571423
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C    2.32407753    0.05539542   -0.00761322   -0.00864439   -0.00251047    0.00208790
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   15
   -420.53705561
H   -2.66830532    0.56356069   -0.09292466   -0.01677653   -0.01112440   -0.00136536
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O   -1.99287362   -1.29269848   -0.02559733   -0.00984516    0.00300797   -0.00434558
C   -0.82336471    0.72532746    0.09364817   -0.04920906    0.05166757    0.00826709
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C    1.68857440    1.28726405   -0.01968338    0.00916783    0.02793039   -0.00541439
C    1.73873209   -1.23985786   -0.03190478    0.00279848   -0.01287302    0.00023341
H    0.07810873    2.56618690   -0.02419439    0.00750785   -0.00676646    0.00034953
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C    2.32259500    0.05341909   -0.00946117   -0.00343521   -0.00778220    0.00145726
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   15
   -420.53763051
H   -2.66706746    0.56125524   -0.09232003   -0.01642464   -0.01122743   -0.00122096
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O   -1.99492283   -1.29567090   -0.02536280   -0.01887992   -0.00208734   -0.00481977
C   -0.81888297    0.72168317    0.09493358   -0.03884003    0.04660287    0.00979183
C   -0.83569982   -0.80876830    0.07598796    0.00847023   -0.01745968    0.00594946
C    0.29745713    1.50753975    0.04583343   -0.01332623   -0.02464841    0.00059346
C    0.40697883   -1.58704234    0.02336604    0.01507721    0.00735266    0.00303183
C    1.68815089    1.29083047   -0.01794079    0.00626714    0.03461433   -0.00502379
C    1.73676733   -1.23771441   -0.03051712   -0.00110537   -0.00671109    0.00183160
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H    2.44658486   -2.06728344   -0.18837133    0.00677330   -0.00602053   -0.00536617
C    2.32116534    0.05156003   -0.01133116    0.00100470   -0.01272795    0.00082628
H    3.39204321    0.08571684   -0.04148540   -0.01230611    0.00169842    0.00236842
   15
   -420.53804931
H   -2.66290172    0.56094734   -0.09149668   -0.01406305   -0.00969634   -0.00100208
O   -1.97189490    1.30210507   -0.07552316    0.03909951    0.00915953   -0.00501667
O   -1.99675858   -1.29861988   -0.02507366   -0.02712810   -0.00693476   -0.00521943
C   -0.81381418    0.71733574    0.09607096   -0.02829521    0.04031411    0.01131926
C   -0.83185318   -0.80189947    0.07488744    0.01590286   -0.00865066    0.00564235
C    0.29870995    1.50518133    0.04595251   -0.01455732   -0.02417690    0.00009967
C    0.40807440   -1.58732388    0.02445653    0.01895577    0.00599684    0.00338033
C    1.68763334    1.29387545   -0.01612238    0.00277100    0.03971002   -0.00451675
C    1.73481811   -1.23546887   -0.02915695   -0.00404482   -0.00105407    0.00325611
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   15
   -420.53836642
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O   -1.99828748   -1.30149052   -0.02472541   -0.03441648   -0.01142941   -0.00552590
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   15
   -420.53852115
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   15
   -420.53840291
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O   -2.00010686   -1.30679806   -0.02383871   -0.04564428   -0.01907726   -0.00584510
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   15
   -420.53794171
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O   -2.00027007   -1.30914825   -0.02329664   -0.04946388   -0.02215577   -0.00586129
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C    0.30586986    1.49960869    0.04646428   -0.00951431   -0.03347652   -0.00087155
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C    2.31342373    0.04633467   -0.02071299   -0.00469968   -0.02744615   -0.00100586
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   15
   -420.53713237
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O   -1.99987332   -1.31124759   -0.02268816   -0.05204848   -0.02471068   -0.00578584
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C    0.40830394   -1.58944651    0.02906229    0.03130805   -0.00680552    0.00437043
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C    1.72622459   -1.22520922   -0.02337929   -0.00099842    0.01199535    0.00611747
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   15
   -420.53621892
H   -2.61832256    0.56909457   -0.08456210    0.01716464    0.01597637    0.00045716
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O   -1.99888727   -1.31306711   -0.02201413   -0.05340737   -0.02672250   -0.00562404
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C    0.40703797   -1.58974218    0.02979306    0.03195484   -0.00997929    0.00442509
C    1.68591274    1.29874062   -0.00415014   -0.02163163    0.03617575   -0.00004862
C    1.72467077   -1.22362800   -0.02248897    0.00245123    0.01121599    0.00584201
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C    2.31048870    0.04691344   -0.02438564   -0.01508031   -0.02642194   -0.00084968
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   15
   -420.53527738
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C   -0.81590067   -0.75792170    0.06515670    0.03769082    0.05321357    0.00227586
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C    1.68644210    1.29740969   -0.00208457   -0.02359269    0.03191663    0.00057063
C    1.72307957   -1.22221552   -0.02168681    0.00616430    0.00973434    0.00542227
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H    2.39794607   -2.04874460   -0.19719154   -0.00594257    0.00361166   -0.00412024
C    2.30932353    0.04780820   -0.02620187   -0.01944043   -0.02419437   -0.00067238
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   15
   -420.53454937
H   -2.61834441    0.55722952   -0.08252168    0.01419304    0.01156899    0.00057728
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O   -1.99509939   -1.31578210   -0.02047759   -0.05251467   -0.02901190   -0.00506577
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C    0.40305916   -1.58983625    0.03105361    0.03128736   -0.01561068    0.00445832
C    1.68732664    1.29559664   -0.00002748   -0.02427879    0.02729127    0.00106603
C    1.72139544   -1.22094995   -0.02096660    0.00965665    0.00802579    0.00497587
H    0.06430766    2.57579792   -0.01625857    0.00511030    0.00996576   -0.00103108
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   15
   -420.53410725
H   -2.62239891    0.54789410   -0.08165315    0.00928651    0.00580679    0.00059927
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O   -1.99230764   -1.31665165   -0.01962137   -0.05031573   -0.02923820   -0.00470563
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C   -0.81615714   -0.75066695    0.06194717    0.03455311    0.06482334    0.00117161
C    0.31736083    1.50428804    0.04740199    0.00952528   -0.03994919   -0.00159618
C    0.40035638   -1.58955003    0.03158283    0.03002244   -0.01764319    0.00447817
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C    2.30791872    0.05064150   -0.02980665   -0.02441640   -0.01664197   -0.00032237
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   15
   -420.53395265
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C   -0.81708266   -0.74846828    0.06031165    0.03169323    0.06819715    0.00061781
C    0.31946287    1.50705900    0.04765035    0.01288122   -0.03633414   -0.00188660
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C    1.69018246    1.29080587    0.00403362   -0.02163427    0.01759106    0.00162535
C    1.71755022   -1.21876342   -0.01974707    0.01411711    0.00599603    0.00448135
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C    2.30775390    0.05246620   -0.03160043   -0.02466588   -0.01160923   -0.00021649
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   15
   -420.53409937
H   -2.63446352    0.52730069   -0.08024098   -0.00208459   -0.00713336    0.00061004
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O   -1.98505251   -1.31740212   -0.01775369   -0.04259093   -0.02774529   -0.00382031
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C   -0.81848642   -0.74729831    0.05866679    0.02804360    0.06957615    0.00006879
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C    0.39361901   -1.58816103    0.03243747    0.02576372   -0.01930140    0.00457973
C    1.69211380    1.28797462    0.00602912   -0.01840914    0.01270229    0.00170882
C    1.71532245   -1.21781270   -0.01924031    0.01447273    0.00640818    0.00454075
H    0.03060408    2.57710456   -0.01263447   -0.00033453    0.01144362   -0.00125574
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H    2.36050654    2.14933903   -0.08111499    0.00651031    0.00054574   -0.00231845
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C    2.30796020    0.05446573   -0.03339082   -0.02338665   -0.00599384   -0.00019778
H    3.41032798    0.04774503   -0.13473013    0.01151443   -0.00150435   -0.00197768
   15
   -420.53453377
H   -2.64045168    0.51834227   -0.07969921   -0.00676640   -0.01229352    0.00059497
O   -2.01294661    1.30749346   -0.08395708   -0.02996412    0.04180706   -0.01337121
O   -1.98067671   -1.31730007   -0.01675225   -0.03710066   -0.02595566   -0.00331794
C   -0.75488567    0.65637641    0.09150963    0.03709743   -0.06407911    0.01941749
C   -0.82031330   -0.74717762    0.05702090    0.02364353    0.06876033   -0.00048297
C    0.32304257    1.51416157    0.04823772    0.01783101   -0.02404657   -0.00256586
C    0.38964874   -1.58703335    0.03276137    0.02281645   -0.01875670    0.00466307
C    1.69432225    1.28495131    0.00799892   -0.01416234    0.00782224    0.00168817
C    1.71287740   -1.21696011   -0.01880246    0.01354904    0.00783634    0.00481709
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H    2.38269905   -2.03984374   -0.17523487   -0.00981479    0.00847796   -0.00246025
C    2.30851833    0.05655546   -0.03517809   -0.02066248   -0.00002507   -0.00027636
H    3.40529064    0.04440440   -0.14202623    0.00847600   -0.00197590   -0.00207994
   15
   -420.53515859
H   -2.64524149    0.51157319   -0.07926439   -0.01007914   -0.01582344    0.00056488
O   -2.01415768    1.30635923   -0.08374477   -0.02806483    0.04539398   -0.01319901
O   -1.97588105   -1.31690424   -0.01571319   -0.03054141   -0.02344313   -0.00278672
C   -0.75261524    0.65477955    0.08930360    0.03736398   -0.06721495    0.01916878
C   -0.82249678   -0.74809377    0.05538231    0.01851293    0.06565436   -0.00102766
C    0.32444557    1.51830804    0.04858696    0.01928211   -0.01591415   -0.00292497
C    0.38533415   -1.58562321    0.03301476    0.01933167   -0.01728064    0.00475591
C    1.69674398    1.28180971    0.00994330   -0.00919267    0.00292658    0.00159310
C    1.71022875   -1.21622689   -0.01843761    0.01159757    0.01000104    0.00521442
H    0.00785145    2.56791596   -0.00911797   -0.00259320    0.00522727   -0.00101847
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H    2.35485816    2.14223553   -0.06696533    0.00228838   -0.00327011   -0.00147457
H    2.38548168   -2.04311380   -0.16949054   -0.00689361    0.00548586   -0.00279867
C    2.30938739    0.05864540   -0.03696103   -0.01671676    0.00607792   -0.00046390
H    3.39874447    0.04141781   -0.14895000    0.00422019   -0.00234205   -0.00203774
   15
   -420.53589984
H   -2.64823992    0.50762586   -0.07893102   -0.01179417   -0.01749280    0.00051773
O   -2.01504948    1.30471211   -0.08338283   -0.02718568    0.04672899   -0.01291789
O   -1.97073990   -1.31624317   -0.01464255   -0.02292432   -0.02019702   -0.00223313
C   -0.75090910    0.65419664    0.08680789    0.03710313   -0.06844403    0.01879533
C   -0.82495930   -0.74999981    0.05375926    0.01266423    0.06026321   -0.00156160
C    0.32555789    1.52269429    0.04898040    0.02003196   -0.00706033   -0.00326059
C    0.38072793   -1.58395282    0.03319625    0.01531392   -0.01494856    0.00483428
C    1.69930429    1.27862395    0.01186367   -0.00387053   -0.00205691    0.00145221
C    1.70740550   -1.21564522   -0.01815161    0.00901910    0.01245057    0.00562968
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H    0.06430120   -2.61592328   -0.09543443   -0.00903893    0.00397246   -0.00358350
H    2.35121743    2.13938680   -0.05945289    0.00000714   -0.00514950   -0.00106388
H    2.38949586   -2.04736265   -0.16324174   -0.00331660    0.00187637   -0.00317994
C    2.31050817    0.06064356   -0.03873685   -0.01191850    0.01207516   -0.00073505
H    3.39145097    0.03885146   -0.15550845   -0.00087775   -0.00259938   -0.00186587
   15
   -420.53664104
H   -2.64913956    0.50679978   -0.07869069   -0.01181256   -0.01722036    0.00045876
O   -2.01563191    1.30253703   -0.08287446   -0.02741616    0.04572997   -0.01252995
O   -1.96533966   -1.31535365   -0.01354660   -0.01426276   -0.01624210   -0.00166384
C   -0.74976339    0.65464626    0.08402816    0.03638016   -0.06778103    0.01829473
C   -0.82761244   -0.75281436    0.05215978    0.00612007    0.05270358   -0.00207130
C    0.32636778    1.52718714    0.04942310    0.02025779    0.00190913   -0.00354759
C    0.37589075   -1.58205727    0.03330468    0.01080299   -0.01189224    0.00488586
C    1.70192313    1.27546952    0.01376210    0.00143218   -0.00720536    0.00130092
C    1.70444615   -1.21525159   -0.01795060    0.00623014    0.01471790    0.00595603
H   -0.01310630    2.55517894   -0.00487772   -0.00365881   -0.00449008   -0.00062994
H    0.05979197   -2.61627608   -0.08997512   -0.00946214    0.00317130   -0.00359737
H    2.34757229    2.13745941   -0.05174861   -0.00204956   -0.00663956   -0.00069288
H    2.39410462   -2.05194861   -0.15642118    0.00043955   -0.00179733   -0.00350209
C    2.31180870    0.06245952   -0.04050149   -0.00678694    0.01776704   -0.00104629
H    3.38431923    0.03675131   -0.16173152   -0.00621986   -0.00273305   -0.00162135
   15
   -420.53732457
H   -2.64793797    0.50904563   -0.07853282   -0.01010208   -0.01498458    0.00038920
O   -2.01590231    1.29984540   -0.08222405   -0.02879728    0.04235628   -0.01204462
O   -1.95977854   -1.31428048   -0.01243178   -0.00460831   -0.01162813   -0.00109012
C   -0.74916724    0.65611854    0.08097197    0.03525012   -0.06534455    0.01766860
C   -0.83035730   -0.75642344    0.05059158   -0.00106799    0.04321575   -0.00254563
C    0.32687189    1.53165190    0.04991933    0.02005459    0.01023684   -0.00374535
C    0.37089080   -1.57998263    0.03333928    0.00581779   -0.00826912    0.00488375
C    1.70452080    1.27242428    0.01564085    0.00634037   -0.01255798    0.00116063
C    1.70139237   -1.21507975   -0.01783947    0.00361412    0.01637904    0.00613063
H   -0.02263682    2.54956717   -0.00256919   -0.00397960   -0.00933605   -0.00045510
H    0.05698428   -2.61719771   -0.08386854   -0.00972767    0.00224544   -0.00358966
H    2.34428985    2.13671749   -0.04391848   -0.00365565   -0.00747291   -0.00038348
H    2.39863744   -2.05621741   -0.14897224    0.00396637   -0.00504632   -0.00367976
C    2.31321227    0.06400745   -0.04225033   -0.00201165    0.02295857   -0.00133750
H    3.37830024    0.03514161   -0.16766273   -0.01107733   -0.00275270   -0.00137765
   15
   -420.53794252
H   -2.64494090    0.51396031   -0.07844507   -0.00677774   -0.01080670    0.00031448
O   -2.01584505    1.29667536   -0.08143710   -0.03128324    0.03671829   -0.01147211
O   -1.95416596   -1.31307593   -0.01130459    0.00593838   -0.00645251   -0.00052332
C   -0.74910360    0.65857686    0.07764879    0.03376751   -0.06131453    0.01691634
C   -0.83308534   -0.76068397    0.04906179   -0.00879085    0.03213045   -0.00296326
C    0.32707299    1.53596362    0.05047204    0.01967173    0.01714816   -0.00382049
C    0.36580343   -1.57778350    0.03330011    0.00040941   -0.00425143    0.00481384
C    1.70702348    1.26956910    0.01750203    0.01056692   -0.01808252    0.00105109
C    1.69828343   -1.21515447   -0.01782072    0.00143079    0.01714014    0.00610097
H   -0.03144895    2.54562298   -0.00017767   -0.00438729   -0.01327820   -0.00033693
H    0.05592658   -2.61852190   -0.07711680   -0.00981558    0.00127319   -0.00353827
H    2.34165713    2.13730860   -0.03601839   -0.00465498   -0.00748007   -0.00013689
H    2.40246494   -2.05958877   -0.14086314    0.00691099   -0.00752518   -0.00367848
C    2.31464750    0.06520903   -0.04397910    0.00170121    0.02749678   -0.00151256
H    3.37425707    0.03402608   -0.17334444   -0.01467772   -0.00267355   -0.00123231
   15
   -420.53842783
H   -2.64074348    0.52079509   -0.07841384   -0.00206683   -0.00494128    0.00023621
O   -2.01543212    1.29309065   -0.08052008   -0.03465657    0.02906811   -0.01082745
O   -1.94862139   -1.31179855   -0.01017144    0.01719134   -0.00086728    0.00001960
C   -0.74955015    0.66196060    0.07406998    0.03199352   -0.05593233    0.01604822
C   -0.83568003   -0.76542888    0.04757672   -0.01687433    0.01988367   -0.00329931
C    0.32697685    1.54001869    0.05108235    0.01922734    0.02195766   -0.00375793
C    0.36071024   -1.57552027    0.03318827   -0.00533330   -0.00005181    0.00465812
C    1.70936750    1.26698734    0.01934727    0.01393216   -0.02361791    0.00097594
C    1.69515211   -1.21548705   -0.01789401   -0.00014513    0.01681961    0.00587635
H   -0.03946620    2.54404798    0.00227541   -0.00511957   -0.01574207   -0.00030171
H    0.05663302   -2.62007657   -0.06972868   -0.00967057    0.00039081   -0.00343661
H    2.33985273    2.13923351   -0.02809257   -0.00498199   -0.00661049    0.00004507
H    2.40506001   -2.06161984   -0.13209467    0.00906752   -0.00899085   -0.00347965
C    2.31605901    0.06599590   -0.04568522    0.00376113    0.03120675   -0.00150132
H    3.37282860    0.03339131   -0.17880158   -0.01639859   -0.00253994   -0.00126928
   15
   -420.53880537
H   -2.63618601    0.52850240   -0.07842510    0.00350775    0.00204132    0.00015869
O   -2.01462566    1.28917750   -0.07948032   -0.03844735    0.01999514   -0.01011915
O   -1.94327219   -1.31051151   -0.00903851    0.02885054    0.00492897    0.00052705
C   -0.75048012    0.66618868    0.07024865    0.02996365   -0.04943793    0.01506596
C   -0.83801952   -0.77047360    0.04614139   -0.02504374    0.00696175   -0.00352670
C    0.32658980    1.54374486    0.05174929    0.01892759    0.02425412   -0.00354655
C    0.35569782   -1.57325620    0.03300614   -0.01126648    0.00415413    0.00440041
C    1.71150197    1.26476238    0.02117771    0.01638265   -0.02889735    0.00093866
C    1.69202216   -1.21607255   -0.01805593   -0.00105452    0.01534859    0.00547007
H   -0.04655693    2.54527951    0.00478389   -0.00623866   -0.01632776   -0.00036413
H    0.05907559   -2.62170440   -0.06172191   -0.00925644   -0.00032536   -0.00329125
H    2.33893601    2.14233752   -0.02017453   -0.00468079   -0.00496376    0.00019433
H    2.40603602   -2.06204842   -0.12270246    0.01030772   -0.00932164   -0.00309642
C    2.31741597    0.06631207   -0.04736893    0.00392469    0.03397649   -0.00126271
H    3.37432003    0.03321290   -0.18402657   -0.01591234   -0.00236121   -0.00154782
   15
   -420.53903996
H   -2.63225988    0.53583977   -0.07846517    0.00907188    0.00914760    0.00009322
O   -2.01338345    1.28503793   -0.07832580   -0.04179961    0.01049270   -0.00936924
O   -1.93825027   -1.30928035   -0.00791150    0.04049937    0.01066710    0.00096966
C   -0.75186284    0.67116320    0.06619965    0.02770127   -0.04207823    0.01398137
C   -0.83998068   -0.77562340    0.04475923   -0.03293548   -0.00609368   -0.00362997
C    0.32591645    1.54710745    0.05246969    0.01873343    0.02398456   -0.00319961
C    0.35085582   -1.57105481    0.03275759   -0.01728901    0.00823178    0.00405262
C    1.71338983    1.26297358    0.02299392    0.01795204   -0.03354034    0.00093304
C    1.68890734   -1.21688869   -0.01830038   -0.00129635    0.01273350    0.00490864
H   -0.05251896    2.54942256    0.00735890   -0.00775516   -0.01500933   -0.00051240
H    0.06318122   -2.62327667   -0.05312338   -0.00859421   -0.00082246   -0.00308102
H    2.33885478    2.14632679   -0.01229099   -0.00388863   -0.00274269    0.00031294
H    2.40517134   -2.06081510   -0.11275496    0.01054458   -0.00849221   -0.00256105
C    2.31871576    0.06611583   -0.04903381    0.00233390    0.03567419   -0.00081190
H    3.37864544    0.03345807   -0.18896924   -0.01331158   -0.00212140   -0.00207583
   15
   -420.53911652
H   -2.62994961    0.54154732   -0.07852210    0.01343019    0.01505638    0.00003257
O   -2.01166858    1.28077848   -0.07706503   -0.04352038    0.00194159   -0.00858659
O   -1.93368727   -1.30816989   -0.00679538    0.05160607    0.01605634    0.00132352
C   -0.75366414    0.67677315    0.06193938    0.02522448   -0.03407599    0.01280919
C   -0.84144472   -0.78068152    0.04343177   -0.04009491   -0.01874888   -0.00358415
C    0.32495990    1.55011016    0.05323835    0.01849646    0.02145297   -0.00275809
C    0.34627504   -1.56897762    0.03244791   -0.02319270    0.01206910    0.00360326
C    1.71500716    1.26169064    0.02479598    0.01879157   -0.03714841    0.00096239
C    1.68581139   -1.21789602   -0.01861891   -0.00094482    0.00903766    0.00424505
H   -0.05708048    2.55624418    0.01002715   -0.00957008   -0.01207575   -0.00072689
H    0.06883158   -2.62470278   -0.04396992   -0.00771637   -0.00111650   -0.00284053
H    2.33946912    2.15080588   -0.00446369   -0.00278863   -0.00024897    0.00042584
H    2.40242269   -2.05806864   -0.10234796    0.00979016   -0.00655815   -0.00191173
C    2.31998171    0.06538163   -0.05068663   -0.00046383    0.03619453   -0.00020778
H    3.38534428    0.03408439   -0.19353574   -0.00908872   -0.00184467   -0.00278590
   15
   -420.53916643
H   -2.63002209    0.54458184   -0.07858495    0.01538361    0.01841410   -0.00003038
O   -2.00946262    1.27649492   -0.07570691   -0.04241196   -0.00433364   -0.00776284
O   -1.92970857   -1.30724095   -0.00569410    0.06154135    0.02076168    0.00155455
C   -0.75584656    0.68289777    0.05748552    0.02251501   -0.02563101    0.01156205
C   -0.84230411   -0.78545734    0.04215829   -0.04595940   -0.03044605   -0.00336838
C    0.32372403    1.55279054    0.05404865    0.01797964    0.01723498   -0.00226319
C    0.34204460   -1.56708237    0.03208386   -0.02883192    0.01551421    0.00306858
C    1.71634106    1.26096767    0.02658343    0.01906318   -0.03935655    0.00103797
C    1.68272920   -1.21903890   -0.01900156   -0.00015353    0.00443341    0.00352809
H   -0.05991879    2.56522402    0.01282667   -0.01143363   -0.00805678   -0.00097085
H    0.07586724   -2.62593257   -0.03430564   -0.00662012   -0.00112160   -0.00255468
H    2.34058396    2.15533034    0.00328682   -0.00157983    0.00220723    0.00054402
H    2.39792470   -2.05415567   -0.09159719    0.00812198   -0.00365757   -0.00120986
C    2.32125524    0.06410167   -0.05233637   -0.00373424    0.03547385    0.00044331
H    3.39366592    0.03504156   -0.19759920   -0.00394136   -0.00148875   -0.00359530
   15
   -420.53924903
H   -2.63281863    0.54434995   -0.07864210    0.01421634    0.01846966   -0.00011332
O   -2.00677889    1.27225764   -0.07426078   -0.03770769   -0.00754142   -0.00688119
O   -1.92642630   -1.30654664   -0.00461034    0.06966887    0.02448213    0.00167332
C   -0.75836904    0.68940956    0.05285693    0.01951806   -0.01690312    0.01025437
C   -0.84247077   -0.78977468    0.04093553   -0.05000484   -0.04067794   -0.00297063
C    0.32221689    1.55521156    0.05489315    0.01694621    0.01200632   -0.00175617
C    0.33824953   -1.56542115    0.03167350   -0.03399418    0.01852432    0.00246097
C    1.71738719    1.26083771    0.02835511    0.01894893   -0.03988684    0.00116555
C    1.67964903   -1.22024803   -0.01943755    0.00086484   -0.00081776    0.00280911
H   -0.06070192    2.57564750    0.01580096   -0.01309493   -0.00356598   -0.00121397
H    0.08409238   -2.62696360   -0.02418216   -0.00533537   -0.00090082   -0.00224369
H    2.34198439    2.15946211    0.01093931   -0.00044691    0.00434229    0.00066867
H    2.39197506   -2.04959534   -0.08062870    0.00571657   -0.00001781   -0.00049574
C    2.32258489    0.06228689   -0.05399272   -0.00671751    0.03349764    0.00101986
H    3.40269461    0.03626539   -0.20101539    0.00136798   -0.00104377   -0.00439382
   15
   -420.53937579
H   -2.63812988    0.54083861   -0.07867840    0.01001008    0.01541192   -0.00022953
O   -2.00367070    1.26810320   -0.07273665   -0.02945865   -0.00785405   -0.00593915
O   -1.92393214   -1.30612886   -0.00354545    0.07540541    0.02692558    0.00165700
C   -0.76118621    0.69617679    0.04807335    0.01616523   -0.00806930    0.00889736
C   -0.84188423   -0.79347923    0.03975745   -0.05172097   -0.04907396   -0.00239054
C    0.32045443    1.55745147    0.05576423    0.01517917    0.00643491   -0.00127236
C    0.33496767   -1.56403936    0.03122602   -0.03848312    0.02104024    0.00179355
C    1.71814709    1.26130862    0.03010910    0.01861457   -0.03859670    0.00135863
C    1.67655587   -1.22144447   -0.01991608    0.00179840   -0.00632807    0.00214669
H   -0.05913336    2.58671461    0.01899342   -0.01434213    0.00081503   -0.00143023
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   15
   -420.53952469
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   15
   -420.53962178
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O   -1.92153482   -1.30621673   -0.00147001    0.07815795    0.02736816    0.00123989
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   15
   -420.53972537
H   -2.66004733    0.51758903   -0.07842755   -0.01026657   -0.00096674   -0.00071889
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O   -1.92166271   -1.30672737   -0.00045476    0.07498100    0.02533418    0.00087279
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C    1.71876284    1.26599524    0.03522976    0.01751976   -0.02431347    0.00241112
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   15
   -420.53989981
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C   -0.83209857   -0.80012897    0.03528069   -0.03221716   -0.06059387    0.00135703
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C    0.32811805   -1.56195455    0.02927484   -0.04641258    0.02611816   -0.00117796
C    1.71843172    1.26840934    0.03687187    0.01731953   -0.01684280    0.00292420
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   15
   -420.54013446
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O   -1.92439583   -1.30856924    0.00155111    0.06086948    0.01751644   -0.00002948
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C   -0.82816134   -0.79953162    0.03414948   -0.02208262   -0.05819464    0.00246621
C    0.30917513    1.56861474    0.06028868   -0.00477237   -0.01089599    0.00040412
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H    2.35150387   -2.04457198   -0.01651196   -0.00468219    0.01244793    0.00215838
C    2.33299745    0.04297668   -0.06432846    0.00304323    0.00237884   -0.00045749
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   15
   -420.54039548
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C   -0.78089399    0.73484970    0.01729654   -0.01543773    0.03849912    0.00033008
C   -0.82389136   -0.79805651    0.03298100   -0.01104667   -0.05408143    0.00355967
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C    1.71698602    1.27387500    0.04001441    0.01696475   -0.00011057    0.00414086
C    1.65783307   -1.22446078   -0.02323073   -0.01481764   -0.01708716    0.00007953
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H    2.34701813   -2.05112861   -0.00684278   -0.00326996    0.00976893    0.00247061
C    2.33490886    0.03909489   -0.06608250    0.00944230   -0.00400573   -0.00152765
H    3.42601840    0.04383205   -0.19841432    0.00777885    0.00346703   -0.00481425
   15
   -420.54054391
H   -2.66215453    0.48944006   -0.07621680   -0.02010379   -0.00742698   -0.00101635
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C   -0.81945451   -0.79576539    0.03175877    0.00014516   -0.04856842    0.00459286
C    0.30467598    1.57396530    0.06208581   -0.01503571   -0.00931348    0.00085321
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C    1.71587715    1.27667475    0.04149650    0.01654194    0.00820094    0.00480414
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H    0.02172898    2.63517109    0.04965650   -0.00524621    0.00459761   -0.00171839
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H    2.35040740    2.15679787    0.06618380   -0.00212804   -0.00083586    0.00112319
H    2.34311166   -2.05942850    0.00238085   -0.00126531    0.00602994    0.00283942
C    2.33667668    0.03527334   -0.06781331    0.01650076   -0.01013093   -0.00270931
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   15
   -420.54044945
H   -2.65388876    0.48571649   -0.07521618   -0.01738258   -0.00497137   -0.00092786
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O   -1.93334359   -1.31265008    0.00457514    0.02874833    0.00059747   -0.00131456
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C   -0.81501924   -0.79274129    0.03046721    0.01083820   -0.04191829    0.00553720
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H    2.35178211    2.15395140    0.07217918   -0.00281921   -0.00257885    0.00105171
H    2.33943084   -2.06880617    0.01109243    0.00089022    0.00176882    0.00326790
C    2.33819490    0.03160443   -0.06950312    0.02365469   -0.01582547   -0.00391548
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   15
   -420.53999899
H   -2.64252011    0.48286775   -0.07404912   -0.01282951   -0.00113816   -0.00079210
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O   -1.93714778   -1.31411278    0.00560684    0.01750774   -0.00530956   -0.00162541
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C   -0.81074663   -0.78908444    0.02909207    0.02049102   -0.03440836    0.00636705
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H    2.35365864    2.15156089    0.07798525   -0.00312155   -0.00375138    0.00097802
H    2.33559419   -2.07850182    0.01921524    0.00277663   -0.00248129    0.00372731
C    2.33935619    0.02817412   -0.07113380    0.03020278   -0.02096836   -0.00504886
H    3.41177350    0.04020365   -0.18345320   -0.00564377    0.00439380   -0.00270814
   15
   -420.53923898
H   -2.62886298    0.48020955   -0.07273995   -0.00688646    0.00374192   -0.00061290
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O   -1.94115105   -1.31551545    0.00665691    0.00679682   -0.01098984   -0.00185272
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C    2.34006248    0.02506005   -0.07268832    0.03537974   -0.02546628   -0.00602743
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   15
   -420.53829020
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O   -1.94523218   -1.31679380    0.00772791   -0.00306757   -0.01630657   -0.00199363
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C   -0.80324943   -0.78033495    0.02604300    0.03522169   -0.01774402    0.00761046
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C    2.34023631    0.02233016   -0.07415197    0.03852150   -0.02925655   -0.00678942
H    3.40577963    0.03393494   -0.17080219   -0.01148078    0.00422274   -0.00170794
   15
   -420.53735038
H   -2.59903279    0.47190897   -0.06982656    0.00598270    0.01395973   -0.00022667
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O   -1.94927950   -1.31788759    0.00882145   -0.01185335   -0.02117749   -0.00204283
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C   -0.80024708   -0.77549379    0.02435029    0.03992839   -0.00900210    0.00800734
C    0.29845812    1.58904719    0.06628071   -0.03079670    0.00318408    0.00234981
C    0.34408037   -1.57558538    0.02693176   -0.00814026    0.01201987   -0.00646216
C    1.70697250    1.28679906    0.04762561    0.00627910    0.03311681    0.00755805
C    1.64817190   -1.22018447   -0.02653542   -0.04738869    0.00923587   -0.00220311
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H    2.36237383    2.14854211    0.09438160   -0.00096921   -0.00272048    0.00090891
H    2.32036461   -2.10239535    0.03923498    0.00413901   -0.01116194    0.00493548
C    2.33983073    0.02004171   -0.07551325    0.03918597   -0.03229197   -0.00732030
H    3.40564918    0.02964883   -0.16397400   -0.01171117    0.00389689   -0.00146047
   15
   -420.53665358
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   15
   -420.53632196
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O   -1.95688821   -1.31930630    0.01107740   -0.02572480   -0.02939203   -0.00188535
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   15
   -420.53635397
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O   -1.96029233   -1.31953806    0.01223803   -0.03074131   -0.03270237   -0.00169079
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C    0.29993974    1.59791109    0.06841211   -0.03010830    0.00165461    0.00320538
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C    1.70020681    1.28744640    0.05000185   -0.00504636    0.03142831    0.00799359
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   15
   -420.53658936
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O   -1.96334889   -1.31939933    0.01341778   -0.03450590   -0.03548377   -0.00142545
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C   -0.79455962   -0.75607615    0.01634566    0.04159323    0.02439388    0.00807726
C    0.30135839    1.60079298    0.06903081   -0.02851292   -0.00004323    0.00338975
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C    1.69802750    1.28668630    0.05055364   -0.00843997    0.02910779    0.00791954
C    1.65459466   -1.21897191   -0.02817660   -0.03896967    0.01424980   -0.00267999
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C    2.33274904    0.01603033   -0.07981369    0.02116882   -0.03585905   -0.00804041
H    3.42139711    0.00654888   -0.13416805    0.00295685    0.00091029   -0.00118622
   15
   -420.53685125
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C   -0.79474951   -0.75183995    0.01403474    0.03850476    0.03147349    0.00775078
C    0.30320736    1.60367521    0.06959829   -0.02633079   -0.00151857    0.00353916
C    0.36112500   -1.59093814    0.02827103    0.02200696   -0.01049375   -0.00714202
C    1.69597511    1.28548668    0.05098579   -0.01126376    0.02631920    0.00775515
C    1.65781411   -1.21919471   -0.02848625   -0.03298478    0.01324615   -0.00253374
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H    2.28701451   -2.10537557    0.05491790   -0.00950810   -0.00400035    0.00458464
C    2.32995578    0.01638062   -0.08058913    0.01465144   -0.03445864   -0.00816266
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   15
   -420.53699487
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C    0.30545378    1.60657958    0.07011228   -0.02360393   -0.00232518    0.00367418
C    0.36385320   -1.59381302    0.02886300    0.02555456   -0.01477564   -0.00694090
C    1.69409218    1.28388946    0.05130076   -0.01338467    0.02324282    0.00752005
C    1.66153118   -1.21961722   -0.02875768   -0.02610869    0.01177957   -0.00232061
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C    2.32694035    0.01725082   -0.08124112    0.00866631   -0.03215884   -0.00831848
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   15
   -420.53702043
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O   -1.97007069   -1.31647668    0.01703882   -0.03915072   -0.04044353   -0.00035571
C   -0.77446961    0.74628934   -0.04513925   -0.02010919    0.00973111   -0.01223466
C   -0.79681133   -0.74488615    0.00906834    0.02966323    0.04293420    0.00677822
C    0.30805644    1.60951787    0.07057069   -0.02034157   -0.00211419    0.00383265
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C    1.69241068    1.28194100    0.05150211   -0.01471975    0.02001576    0.00722018
C    1.66564249   -1.22021785   -0.02899404   -0.01883587    0.01031480   -0.00208679
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H    2.37546447    2.14276100    0.12602693    0.00596466    0.00618361    0.00147562
H    2.28134658   -2.09835392    0.05515089   -0.01640991    0.00306179    0.00372274
C    2.32379274    0.01860623   -0.08176730    0.00363166   -0.02902082   -0.00850290
H    3.43074834   -0.01287325   -0.10963833    0.01381840   -0.00277410   -0.00034327
   15
   -420.53702492
H   -2.54255231    0.34776268   -0.05637574   -0.00126931   -0.01355947   -0.00105466
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O   -1.97143660   -1.31460450    0.01825964   -0.03882127   -0.04089856    0.00004595
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C   -0.79855011   -0.74234148    0.00642751    0.02435923    0.04702998    0.00616854
C    0.31096613    1.61248672    0.07097113   -0.01659110   -0.00071139    0.00401896
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C    1.69095073    1.27968997    0.05159435   -0.01523175    0.01672437    0.00687230
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H    2.28263910   -2.09534836    0.05422200   -0.01868184    0.00568472    0.00331275
C    2.32058875    0.02039953   -0.08216493   -0.00019293   -0.02513875   -0.00868816
H    3.42960414   -0.01865575   -0.10125597    0.01487505   -0.00407044    0.00009588
   15
   -420.53717073
H   -2.53983310    0.33223983   -0.05418114   -0.00284573   -0.01776727   -0.00116412
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O   -1.97236284   -1.31226900    0.01947995   -0.03773872   -0.04068690    0.00044552
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C   -0.80065677   -0.74050636    0.00369348    0.01872414    0.04988165    0.00550012
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H    3.42580447   -0.02370638   -0.09289132    0.01437910   -0.00530670    0.00056759
   15
   -420.53751001
H   -2.53661584    0.31989590   -0.05177760   -0.00343456   -0.02062196   -0.00121672
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O   -1.97286160   -1.30947261    0.02069521   -0.03599116   -0.03978317    0.00083039
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C    0.31747337    1.61841148    0.07158508   -0.00783216    0.00586994    0.00464899
C    0.37062508   -1.60256086    0.03222920    0.02896662   -0.02575252   -0.00535409
C    1.68871502    1.27447986    0.05147316   -0.01401987    0.00998854    0.00605396
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C    2.31422219    0.02505578   -0.08256377   -0.00380244   -0.01556999   -0.00895627
H    3.41943814   -0.02780316   -0.08462885    0.01235414   -0.00643238    0.00103919
   15
   -420.53799420
H   -2.53279415    0.31124503   -0.04915609   -0.00304266   -0.02214823   -0.00120075
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O   -1.97295264   -1.30622559    0.02190109   -0.03364759   -0.03817508    0.00118894
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C   -0.80563145   -0.73911700   -0.00201321    0.00710907    0.05157540    0.00405772
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C    1.68392526   -1.22412212   -0.02964654    0.00431124    0.01288266   -0.00181187
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H    2.36372328    2.12092381    0.13876295   -0.00056776   -0.00000507    0.00095369
H    2.30699747   -2.09301357    0.04806070   -0.01705637    0.00493640    0.00268137
C    2.31111427    0.02777435   -0.08256100   -0.00365792   -0.01012491   -0.00897995
H    3.41086817   -0.03074436   -0.07655298    0.00891816   -0.00739390    0.00147707
   15
   -420.53859145
H   -2.52843186    0.30655904   -0.04631915   -0.00186182   -0.02228439   -0.00114019
O   -2.00938323    1.21525217   -0.03476791   -0.00054851    0.02465615    0.00489665
O   -1.97266245   -1.30254621    0.02309352   -0.03077744   -0.03584531    0.00150562
C   -0.75119078    0.73411301   -0.06226082    0.01536652   -0.02023283   -0.01525186
C   -0.80832423   -0.73958826   -0.00496410    0.00136434    0.05034582    0.00331499
C    0.32444820    1.62396077    0.07191610    0.00211160    0.01644963    0.00561285
C    0.37139963   -1.60474423    0.03442434    0.02485184   -0.02639471   -0.00425578
C    1.68731668    1.26866891    0.05098676   -0.01075015    0.00256773    0.00505718
C    1.68851739   -1.22552195   -0.02974165    0.00741924    0.01595061   -0.00192022
H    0.14852432    2.70067574    0.17223767    0.00905421    0.00819042    0.00138301
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H    2.36013464    2.11457056    0.14143650   -0.00278478   -0.00223973    0.00072780
H    2.32161934   -2.09431312    0.04500801   -0.01374219    0.00193784    0.00264589
C    2.30806039    0.03064567   -0.08242258   -0.00247043   -0.00440058   -0.00890033
H    3.40070894   -0.03235766   -0.06874215    0.00434619   -0.00814975    0.00185621
   15
   -420.53906518
H   -2.52374584    0.30586481   -0.04327773    0.00014627   -0.02105301   -0.00102710
O   -2.01374512    1.21410105   -0.03360855   -0.00767295    0.02421667    0.00496723
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C   -0.74685160    0.73228307   -0.06502637    0.02004043   -0.02363548   -0.01565193
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   15
   -420.53931715
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O   -1.97107440   -1.29400356    0.02542411   -0.02354668   -0.02917794    0.00201420
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   15
   -420.53929210
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O   -1.96985854   -1.28921573    0.02655650   -0.01921485   -0.02499151    0.00219693
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   15
   -420.53899519
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O   -1.96842515   -1.28414479    0.02766401   -0.01443130   -0.02035972    0.00233160
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   15
   -420.53850270
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O   -1.96682843   -1.27884318    0.02874512   -0.00923687   -0.01541702    0.00241793
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C   -0.82044743   -0.75226267   -0.02025255   -0.02466965    0.02526506   -0.00013594
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C    1.68622218    1.25475790    0.04861218   -0.00449067   -0.02442964    0.00126095
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   15
   -420.53789029
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O   -1.96512722   -1.27336688    0.02979886   -0.00371251   -0.01028079    0.00245917
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C   -0.82205269   -0.75632863   -0.02334393   -0.02919296    0.01738527   -0.00074428
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C    1.68625504    1.25271984    0.04802811   -0.00445253   -0.03071356    0.00032347
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C    2.28969282    0.04616299   -0.07891615   -0.00176749    0.02926445   -0.00690849
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   15
   -420.53726576
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O   -1.96338409   -1.26777400    0.03082472    0.00201339   -0.00510016    0.00246549
C   -0.72884805    0.72938453   -0.07656697    0.03518584   -0.02081649   -0.01544874
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   15
   -420.53675251
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O   -1.96166383   -1.26212317    0.03182265    0.00775289   -0.00001465    0.00244218
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C    1.71901665   -1.24800994   -0.02949168    0.02121177    0.01296001   -0.00031799
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C    2.28358674    0.04866847   -0.07685117   -0.01282966    0.03638260   -0.00657262
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   15
   -420.53638488
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O   -1.96003129   -1.25647196    0.03279289    0.01325544    0.00485397    0.00240000
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C    1.72167850   -1.25216950   -0.02938039    0.02369633    0.00665749    0.00014846
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C    2.28077979    0.04912121   -0.07566856   -0.01920510    0.03815630   -0.00654329
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   15
   -420.53609032
H   -2.54999098    0.36827289   -0.01078077    0.01269533    0.01301703    0.00019581
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O   -1.95854865   -1.25087551    0.03373590    0.01824426    0.00938425    0.00236021
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C   -0.82346665   -0.77394519   -0.03550928   -0.04254423   -0.01610252   -0.00307530
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C    1.68709484    1.24999284    0.04577212   -0.00499384   -0.04632601   -0.00258958
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C    2.27826261    0.04899878   -0.07438695   -0.02510386    0.03849015   -0.00656998
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   15
   -420.53575331
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O   -1.95727224   -1.24538507    0.03465213    0.02243039    0.01344580    0.00233505
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C    0.36183253   -1.59534611    0.04889883   -0.01972842    0.00709646    0.00377145
C    1.68749236    1.25096319    0.04528326   -0.00448428   -0.04599548   -0.00283683
C    1.72588725   -1.26067947   -0.02917112    0.02892225   -0.00810030    0.00098010
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H    2.49188588   -2.03784527   -0.01253735    0.00881952    0.00456690   -0.00125111
C    2.27612359    0.04829628   -0.07300598   -0.02987853    0.03728080   -0.00661428
H    3.37307352    0.04896232   -0.01358017    0.00561609   -0.00207508    0.00452009
   15
   -420.53530633
H   -2.58443900    0.36590313   -0.00336818   -0.00139848    0.00174761    0.00079857
O   -2.03962108    1.19612407   -0.02444751   -0.04156748   -0.00998604    0.00369810
O   -1.95624925   -1.24004669    0.03554182    0.02552316    0.01696451    0.00235676
C   -0.72810979    0.73524740   -0.07982749    0.04232767    0.00216773   -0.01222940
C   -0.82050597   -0.78180709   -0.04134754   -0.04344279   -0.03030840   -0.00441856
C    0.34296623    1.62177205    0.06551144    0.04492234    0.01367567    0.00288391
C    0.36157362   -1.59398943    0.05010594   -0.02230630    0.01093313    0.00452119
C    1.68795711    1.25262648    0.04483700   -0.00349089   -0.04361776   -0.00287265
C    1.72735576   -1.26480796   -0.02908564    0.03112306   -0.01558042    0.00129540
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H    2.38483374    2.09297456    0.16477949    0.00365122    0.00319253    0.00206067
H    2.49775897   -2.02712172   -0.01818785    0.00645079    0.00935828   -0.00166121
C    2.27443442    0.04703193   -0.07152503   -0.03308573    0.03455994   -0.00664765
H    3.37715840    0.06288210   -0.01245639    0.00913094   -0.00004293    0.00467693
   15
   -420.53478901
H   -2.60195668    0.36369971    0.00015190   -0.00881314   -0.00404333    0.00116920
O   -2.03890388    1.19520608   -0.02391054   -0.03554486   -0.00566542    0.00333614
O   -1.95551459   -1.23490021    0.03640471    0.02730709    0.01986753    0.00244967
C   -0.72981110    0.73662258   -0.07988051    0.04262337    0.00716095   -0.01140751
C   -0.81804127   -0.78510293   -0.04417165   -0.04165684   -0.03601315   -0.00519460
C    0.34078928    1.61890438    0.06442313    0.04298131    0.00941100    0.00197857
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   15
   -420.53436677
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O   -1.95508835   -1.22997852    0.03723978    0.02763477    0.02212210    0.00261639
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C    1.72886380   -1.27225891   -0.02897661    0.03257986   -0.02785566    0.00167050
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C    2.27257131    0.04300282   -0.06826184   -0.03400479    0.02511426   -0.00657341
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   15
   -420.53421055
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O   -1.95497421   -1.22530720    0.03804507    0.02646682    0.02373978    0.00288432
C   -0.73513654    0.73897698   -0.07948197    0.04069949    0.01634054   -0.00970970
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C    1.72888233   -1.27539702   -0.02895874    0.03099767   -0.03162762    0.00174516
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C    2.27241131    0.04038029   -0.06648078   -0.03173352    0.01887712   -0.00643246
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   15
   -420.53440801
H   -2.64067595    0.36432764    0.00919735   -0.02350855   -0.01272993    0.00209677
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O   -1.95515902   -1.22090459    0.03881755    0.02389472    0.02474248    0.00325637
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C   -0.80710900   -0.79147448   -0.05211646   -0.02694675   -0.04605150   -0.00817718
C    0.33057896    1.60964073    0.06102234    0.03015382    0.00145660    0.00012320
C    0.36415333   -1.59073868    0.05414500   -0.02620932    0.02340057    0.00724118
C    1.69006728    1.26506429    0.04344010    0.00549064   -0.01685073   -0.00105025
C    1.72843439   -1.27805931   -0.02896720    0.02760024   -0.03344642    0.00177153
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C    2.27272915    0.03747306   -0.06460256   -0.02783843    0.01204916   -0.00620822
H    3.37462647    0.11474459   -0.01634462    0.00909908    0.00830077    0.00418976
   15
   -420.53497583
H   -2.64604360    0.36868150    0.01152280   -0.02463571   -0.01211629    0.00223815
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O   -1.95561375   -1.21678214    0.03955301    0.02008554    0.02519326    0.00373347
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C   -0.80253225   -0.79225769   -0.05453887   -0.01950754   -0.04694249   -0.00937464
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C    0.36577594   -1.59070582    0.05490597   -0.02539305    0.02533583    0.00787379
C    1.69048773    1.26911338    0.04315336    0.00848870   -0.00767717   -0.00033550
C    1.72757120   -1.28021821   -0.02900242    0.02253347   -0.03337291    0.00176625
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H    2.51558662   -2.01072744   -0.04098900    0.00443035    0.01742372   -0.00267332
C    2.27346628    0.03438395   -0.06263057   -0.02261180    0.00496090   -0.00590187
H    3.36928327    0.12487653   -0.01930249    0.00564980    0.00994064    0.00383106
   15
   -420.53577083
H   -2.64700713    0.37519178    0.01344656   -0.02363154   -0.00976260    0.00227085
O   -2.03047616    1.19112967   -0.02171518   -0.01394385   -0.00544951    0.00192777
O   -1.95629542   -1.21294504    0.04024609    0.01528963    0.02517676    0.00425508
C   -0.74759464    0.74053123   -0.07781444    0.02977853    0.02627838   -0.00725829
C   -0.79766144   -0.79233258   -0.05681943   -0.01132992   -0.04664559   -0.01066057
C    0.32138363    1.60328516    0.05872954    0.01784504   -0.00013757   -0.00037388
C    0.36778158   -1.59105524    0.05554789   -0.02382945    0.02661215    0.00850271
C    1.69078005    1.27327853    0.04287171    0.01133508    0.00149583    0.00035929
C    1.72636884   -1.28187449   -0.02906431    0.01621208   -0.03169219    0.00174173
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H    2.51738508   -2.01695510   -0.04420705    0.00708755    0.01472918   -0.00277280
C    2.27454412    0.03121974   -0.06056944   -0.01644324   -0.00205974   -0.00552382
H    3.36293655    0.13322357   -0.02294934    0.00125700    0.01125436    0.00342463
   15
   -420.53662264
H   -2.64374698    0.38343413    0.01496308   -0.02050247   -0.00567986    0.00217837
O   -2.02816645    1.19041388   -0.02135150   -0.01245651   -0.01023921    0.00186036
O   -1.95714995   -1.20939318    0.04089067    0.00983394    0.02477763    0.00485441
C   -0.75273593    0.74031347   -0.07702301    0.02381026    0.02818560   -0.00652325
C   -0.79261974   -0.79170358   -0.05893873   -0.00280328   -0.04521697   -0.01200772
C    0.31633354    1.60010584    0.05759006    0.01139191   -0.00043713   -0.00050560
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C    1.69090150    1.27742170    0.04258473    0.01376238    0.01014175    0.00097150
C    1.72492216   -1.28305301   -0.02915251    0.00922104   -0.02885023    0.00169290
H   -0.01396760    2.61444201    0.24600110   -0.00639145   -0.00711967    0.00249511
H    0.11634750   -2.64716931    0.14916909   -0.00108504    0.00100914   -0.00025481
H    2.39703264    2.08434315    0.16076039    0.00012906   -0.00836421    0.00106617
H    2.51790259   -2.02582195   -0.04692616    0.01008900    0.01117239   -0.00285566
C    2.27587008    0.02808629   -0.05842486   -0.00985432   -0.00875646   -0.00508752
H    3.35637048    0.13954972   -0.02721289   -0.00361618    0.01219185    0.00299636
   15
   -420.53731283
H   -2.63682471    0.39267649    0.01608929   -0.01539100   -0.00004578    0.00196131
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O   -1.95811575   -1.20612214    0.04148017    0.00405514    0.02410062    0.00548429
C   -0.75823597    0.73967057   -0.07613289    0.01679041    0.02926134   -0.00584344
C   -0.78753554   -0.79039219   -0.06087644    0.00563827   -0.04272667   -0.01338488
C    0.31111103    1.59693329    0.05645820    0.00510048   -0.00086694   -0.00063898
C    0.37283620   -1.59296672    0.05643665   -0.01850438    0.02691493    0.00974446
C    1.69081568    1.28141271    0.04228324    0.01552101    0.01781523    0.00144615
C    1.72333611   -1.28379614   -0.02926627    0.00218645   -0.02533019    0.00161179
H   -0.00749507    2.61088236    0.24457811   -0.00435286   -0.00939550    0.00212434
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H    2.39763586    2.08653780    0.15916633    0.00011297   -0.00900868    0.00103542
H    2.51660630   -2.03669432   -0.04913149    0.01292157    0.00721310   -0.00291388
C    2.27734531    0.02508458   -0.05620341   -0.00349676   -0.01491704   -0.00461362
H    3.35045414    0.14368606   -0.03201657   -0.00838672    0.01277097    0.00258508
   15
   -420.53773654
H   -2.62715392    0.40190973    0.01686421   -0.00873438    0.00675199    0.00163249
O   -2.02312700    1.18940439   -0.02068795   -0.01201693   -0.02361118    0.00199226
O   -1.95912752   -1.20312430    0.04200745   -0.00173470    0.02321780    0.00611646
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C   -0.78253607   -0.78843597   -0.06261176    0.01364095   -0.03926009   -0.01476517
C    0.30581091    1.59377443    0.05533608   -0.00079364   -0.00176990   -0.00084511
C    0.37580478   -1.59453327    0.05666470   -0.01482247    0.02585115    0.01036300
C    1.69049619    1.28513593    0.04196009    0.01646405    0.02420600    0.00175877
C    1.72171640   -1.28415657   -0.02940435   -0.00434384   -0.02157866    0.00148578
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H    2.39820995    2.09034151    0.15738419    0.00069856   -0.00877520    0.00119104
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C    2.27887452    0.02230761   -0.05391223    0.00194124   -0.02041777   -0.00410966
H    3.34603665    0.14552803   -0.03728618   -0.01238451    0.01302475    0.00220619
   15
   -420.53786146
H   -2.61592099    0.40992127    0.01734623   -0.00136896    0.01393641    0.00124073
O   -2.02040306    1.18926126   -0.02038956   -0.01216059   -0.03096241    0.00214782
O   -1.96011989   -1.20038974    0.04246538   -0.00722103    0.02221021    0.00672746
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C   -0.77774192   -0.78588723   -0.06412387    0.02087869   -0.03491102   -0.01611491
C    0.30052215    1.59064321    0.05422686   -0.00616819   -0.00339400   -0.00116625
C    0.37899674   -1.59648968    0.05673610   -0.01054043    0.02395847    0.01096893
C    1.68992876    1.28849494    0.04161061    0.01657132    0.02916293    0.00190012
C    1.72016120   -1.28419053   -0.02956482   -0.00993391   -0.01797649    0.00129944
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H    2.39864878    2.09571161    0.15539704    0.00187109   -0.00764963    0.00130860
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C    2.28037631    0.01983846   -0.05155896    0.00578974   -0.02518096   -0.00357397
H    3.34382773    0.14502876   -0.04295331   -0.01494794    0.01301943    0.00185031
   15
   -420.53783450
H   -2.60443541    0.41543644    0.01760468    0.00554244    0.02024862    0.00086190
O   -2.01754199    1.18946841   -0.02011552   -0.01140569   -0.03725726    0.00229029
O   -1.96103081   -1.19790710    0.04284707   -0.01218199    0.02115713    0.00727643
C   -0.77576459    0.73509414   -0.07296818   -0.00868348    0.02727493   -0.00420432
C   -0.77326222   -0.78281167   -0.06539241    0.02709061   -0.02974698   -0.01740080
C    0.29532599    1.58756430    0.05313540   -0.01098664   -0.00582817   -0.00161063
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C    1.68911163    1.29141476    0.04123262    0.01594663    0.03269953    0.00189416
C    1.71875470   -1.28395218   -0.02974486   -0.01429878   -0.01480119    0.00104493
H    0.01531670    2.61100169    0.23811885    0.00058759   -0.00966438    0.00209151
H    0.14569596   -2.65916290    0.12651897    0.00210877    0.00000980   -0.00103065
H    2.39874321    2.10244862    0.15317474    0.00348850   -0.00578978    0.00155672
H    2.49740254   -2.07434885   -0.05260138    0.01655900   -0.00327004   -0.00280243
C    2.28179300    0.01774905   -0.04915170    0.00760719   -0.02914484   -0.00298928
H    3.34428283    0.14218836   -0.04895354   -0.01563687    0.01280613    0.00149905
   15
   -420.53776345
H   -2.59392165    0.41733966    0.01770651    0.01067560    0.02425173    0.00058064
O   -2.01455333    1.19009588   -0.01986736   -0.00871172   -0.04105098    0.00234631
O   -1.96180424   -1.19566441    0.04314627   -0.01639531    0.02007895    0.00776082
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C   -0.76919066   -0.77928721   -0.06639797    0.03208420   -0.02387823   -0.01859103
C    0.29029532    1.58457433    0.05206842   -0.01529495   -0.00893550   -0.00215224
C    0.38578439   -1.60144615    0.05637241   -0.00054695    0.01789736    0.01211587
C    1.68805406    1.29384173    0.04082611    0.01478672    0.03495193    0.00178369
C    1.71756268   -1.28348927   -0.02994061   -0.01726086   -0.01226336    0.00071682
H    0.02306640    2.61469250    0.23524264    0.00167982   -0.00729305    0.00245976
H    0.15244332   -2.66223259    0.12124182    0.00284980    0.00000624   -0.00117115
H    2.39820632    2.11022063    0.15067159    0.00532781   -0.00341826    0.00185377
H    2.48517437   -2.08649012   -0.05273176    0.01549021   -0.00544236   -0.00264630
C    2.28309733    0.01609924   -0.04669932    0.00724089   -0.03223732   -0.00232576
H    3.34752374    0.13704494   -0.05522320   -0.01429746    0.01241262    0.00111349
   15
   -420.53783345
H   -2.58528862    0.41492644    0.01770161    0.01301665    0.02484303    0.00045600
O   -2.01146829    1.19118560   -0.01964566   -0.00339626   -0.04119574    0.00225456
O   -1.96239248   -1.19364948    0.04335751   -0.01974484    0.01900795    0.00816213
C   -0.78701487    0.72996914   -0.07052627   -0.02629931    0.02173602   -0.00348126
C   -0.76560261   -0.77540244   -0.06712258    0.03576850   -0.01740985   -0.01966234
C    0.28549536    1.58171994    0.05103406   -0.01916201   -0.01242972   -0.00274070
C    0.38922933   -1.60435475    0.05592001    0.00489774    0.01390263    0.01264352
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C    1.71662986   -1.28283999   -0.03014711   -0.01875372   -0.01049519    0.00031639
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   15
   -420.53798389
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   15
   -420.53806634
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   15
   -420.53785550
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   15
   -420.53725880
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   15
   -420.53635202
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   15
   -420.53531310
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   15
   -420.53436630
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   15
   -420.53366118
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C    0.40765438   -1.62923708    0.04499220    0.03673249   -0.02153034    0.01373467
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   15
   -420.53331304
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   15
   -420.53337154
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   15
   -420.53360697
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O   -1.95281373   -1.18352196    0.03932544   -0.00758595    0.01397719    0.00690354
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   15
   -420.53410813
H   -2.52904549    0.31363556    0.00513791    0.00106452   -0.01789178    0.00049066
O   -1.99527068    1.21873730   -0.01829952    0.03191833    0.02359932    0.00186747
O   -1.95085295   -1.18354469    0.03841716   -0.00428820    0.01493029    0.00639637
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C   -0.76364869   -0.73828186   -0.05075848    0.01050822    0.04752422   -0.01762154
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   15
   -420.53473732
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O   -1.94884363   -1.18373705    0.03743637   -0.00086454    0.01618954    0.00584810
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   15
   -420.53554561
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O   -1.94682463   -1.18411323    0.03638928    0.00269018    0.01766206    0.00525915
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   15
   -420.53639109
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O   -1.94483627   -1.18468993    0.03528258    0.00637473    0.01929452    0.00463515
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   15
   -420.53732616
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O   -1.94292031   -1.18548556    0.03412331    0.01017851    0.02099158    0.00399253
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C    0.26861828    1.56505279    0.03991020   -0.01452627    0.00762611    0.00228470
C    0.39530572   -1.63597621    0.02140433    0.01629217   -0.02837301    0.00741160
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   15
   -420.53826230
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O   -1.94111985   -1.18651934    0.03291873    0.01404802    0.02267697    0.00335050
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C   -0.77498961   -0.74649390   -0.03167593   -0.00783051    0.02953939   -0.00969437
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   15
   -420.53916550
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C    1.64124508    1.25090323    0.02962790   -0.01980249   -0.01449098    0.00145609
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   15
   -420.53998086
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C    2.32071100    0.05070713   -0.00720096    0.01591018    0.02733602    0.00718819
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   15
   -420.54066367
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O   -1.93684777   -1.19123397    0.02910589    0.02508626    0.02692946    0.00148682
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   15
   -420.54110542
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C    2.32243131    0.05200114   -0.00542928    0.00901686    0.02871956    0.00708445
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   15
   -420.54117611
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C    1.63412750    1.23558300    0.02639635   -0.03392708   -0.03069391    0.00248473
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   15
   -420.54078588
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C   -0.78457702   -0.76904896   -0.00427183   -0.01786725   -0.01541646    0.00078557
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C    2.32359593    0.05157645   -0.00408274    0.00408128    0.02650153    0.00634595
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   15
   -420.54003761
H   -2.60566366    0.41678188   -0.02012673   -0.00805783   -0.00514398   -0.00013655
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C   -0.78529000   -0.77265148    0.00040323   -0.01656430   -0.02180725    0.00232112
C    0.28961691    1.56047055    0.03323987    0.00937615   -0.02397200    0.00375911
C    0.36848988   -1.61772629   -0.00900492   -0.02122427   -0.00488549   -0.00299868
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H    2.45310159   -2.03457155   -0.01550858    0.00176124    0.00957746    0.00090135
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   15
   -420.53906459
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C   -0.74113448    0.71980114   -0.02171298    0.05880502    0.02515309   -0.00559827
C   -0.78575384   -0.77592537    0.00504332   -0.01417806   -0.02730207    0.00376547
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C    1.63391735    1.22866644    0.02359409   -0.03499988   -0.03078985    0.00319409
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C    2.32449104    0.04956633   -0.00311630    0.00356854    0.02086258    0.00488601
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   15
   -420.53811666
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O   -1.93653410   -1.20902398    0.02117474    0.03030895    0.02702055   -0.00132425
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C   -0.78600456   -0.77878769    0.00962658   -0.01078144   -0.03176724    0.00511520
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C    1.63491084    1.22730504    0.02256774   -0.03355677   -0.02904941    0.00334882
C    1.70957774   -1.24499283   -0.01768092    0.00232768   -0.00900954   -0.00177572
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C    2.32485816    0.04806514   -0.00274977    0.00511353    0.01707807    0.00393590
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   15
   -420.53737114
H   -2.65366245    0.43384285   -0.02579819   -0.02328789   -0.01200889   -0.00041872
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O   -1.93771729   -1.21309888    0.01987737    0.02776375    0.02558499   -0.00172223
C   -0.73869263    0.72389411   -0.01594321    0.06347923    0.03288145   -0.00596856
C   -0.78609328   -0.78117108    0.01413261   -0.00654381   -0.03510511    0.00637311
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C    0.36187471   -1.60814948   -0.02021177   -0.02972704    0.00688566   -0.00631893
C    1.63641085    1.22638235    0.02149081   -0.03143202   -0.02688816    0.00346057
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C    2.32514669    0.04630622   -0.00244262    0.00770233    0.01289744    0.00288824
H    3.42817384    0.09376378   -0.05604381    0.01289694    0.00192820   -0.00226184
   15
   -420.53696424
H   -2.66222310    0.44355802   -0.02756256   -0.02425185   -0.01072792   -0.00050888
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O   -1.93921463   -1.21746365    0.01859953    0.02437045    0.02374694   -0.00212319
C   -0.73889761    0.72522142   -0.01292436    0.06279846    0.03457064   -0.00611598
C   -0.78608380   -0.78302511    0.01854239   -0.00169861   -0.03726523    0.00754917
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C    1.63838551    1.22586609    0.02036160   -0.02883943   -0.02465308    0.00354015
C    1.70662558   -1.24275727   -0.01488452   -0.00556056   -0.00773779   -0.00048276
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H    2.25685777    2.11109932   -0.02508870   -0.00802880   -0.00465331   -0.00222617
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C    2.32531780    0.04435254   -0.00217908    0.01108818    0.00853024    0.00178860
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   15
   -420.53691460
H   -2.66645173    0.45517812   -0.02923549   -0.02287285   -0.00759879   -0.00057939
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O   -1.94098778   -1.22209749    0.01734578    0.02030073    0.02157250   -0.00253287
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C   -0.78604906   -0.78431718    0.02283811    0.00348727   -0.03822123    0.00865259
C    0.29955160    1.56666463    0.02735128    0.00745846   -0.00932028    0.00470336
C    0.35963506   -1.60218028   -0.02723395   -0.03232411    0.01264312   -0.00805994
C    1.64079590    1.22572288    0.01917889   -0.02600371   -0.02266942    0.00359867
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C    2.32532072    0.04226990   -0.00194258    0.01490742    0.00416618    0.00068609
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   15
   -420.53713277
H   -2.66659620    0.46814008   -0.03080458   -0.01917373   -0.00267279   -0.00061585
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O   -1.94299080   -1.22697577    0.01612078    0.01577472    0.01911211   -0.00295221
C   -0.74210983    0.72630995   -0.00660803    0.05581427    0.03360037   -0.00623074
C   -0.78606709   -0.78503276    0.02700308    0.00869893   -0.03799268    0.00969360
C    0.30117130    1.56856849    0.02596850    0.00739972   -0.00529819    0.00478416
C    0.35923980   -1.59946177   -0.03056863   -0.03256009    0.01445814   -0.00878586
C    1.64359941    1.22592304    0.01794178   -0.02311595   -0.02119281    0.00365314
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H    2.51390360   -1.97359258   -0.01726274    0.01457100    0.01453968    0.00074327
C    2.32509828    0.04012405   -0.00171649    0.01869161   -0.00002805   -0.00038006
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   15
   -420.53751274
H   -2.66331943    0.48156060   -0.03226325   -0.01338518    0.00379313   -0.00061543
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O   -1.94517253   -1.23207066    0.01492927    0.01101355    0.01644459   -0.00337977
C   -0.74501192    0.72608562   -0.00330886    0.04989466    0.03113692   -0.00615528
C   -0.78621632   -0.78517528    0.03102155    0.01364507   -0.03662167    0.01068087
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C    0.35933591   -1.59696086   -0.03377057   -0.03202649    0.01545662   -0.00942524
C    1.64675251    1.22644442    0.01664942   -0.02031814   -0.02036029    0.00371287
C    1.70299357   -1.23863270   -0.01065952   -0.01762489   -0.00053482    0.00143814
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H    2.51753982   -1.97298292   -0.01806877    0.01665791    0.01325664    0.00066431
C    2.32459391    0.03797827   -0.00148474    0.02190124   -0.00392745   -0.00137457
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   15
   -420.53795535
H   -2.65765354    0.49428379   -0.03361168   -0.00618063    0.01123530   -0.00057479
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O   -1.94747919   -1.23735196    0.01377610    0.00624341    0.01362698   -0.00380776
C   -0.74866686    0.72539184    0.00008323    0.04270339    0.02757103   -0.00596994
C   -0.78657117   -0.78476538    0.03487859    0.01804200   -0.03417388    0.01162341
C    0.30406888    1.57257209    0.02298468    0.00835123   -0.00010176    0.00496814
C    0.35991528   -1.59469263   -0.03683010   -0.03070196    0.01561176   -0.00998947
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C    1.70223960   -1.23718773   -0.00928186   -0.02030240    0.00231300    0.00205261
H    0.00655917    2.60046200   -0.04059211   -0.00395138   -0.01350508   -0.00188518
H    0.09806464   -2.65201645   -0.01062627   -0.00454221    0.00043785    0.00294511
H    2.30299999    2.08673362   -0.04041148   -0.00370222   -0.00720243   -0.00250113
H    2.51818727   -1.97475854   -0.01899418    0.01805132    0.01188516    0.00057024
C    2.32375978    0.03589153   -0.00123232    0.02398444   -0.00750108   -0.00228235
H    3.39136445    0.18587068   -0.00880578   -0.00736553    0.01463186    0.00043524
   15
   -420.53841351
H   -2.65087978    0.50498517   -0.03485688    0.00135413    0.01855933   -0.00051265
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O   -1.94985684   -1.24278773    0.01266612    0.00166290    0.01072093   -0.00422841
C   -0.75296625    0.72428227    0.00356544    0.03453089    0.02311601   -0.00566356
C   -0.78719783   -0.78383998    0.03855995    0.02166222   -0.03073855    0.01252210
C    0.30533266    1.57459361    0.02138086    0.00914261    0.00075098    0.00508190
C    0.36095791   -1.59265943   -0.03973869   -0.02858179    0.01494876   -0.01048738
C    1.65394039    1.22841004    0.01389538   -0.01509587   -0.02050120    0.00382539
C    1.70179128   -1.23577761   -0.00793520   -0.02189851    0.00506253    0.00264314
H    0.01905245    2.60869035   -0.04630256   -0.00310757   -0.01062986   -0.00195339
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H    2.31693650    2.08392539   -0.04315521   -0.00130342   -0.00604734   -0.00260638
H    2.51559767   -1.97867443   -0.02002211    0.01858976    0.01056030    0.00046609
C    2.32256497    0.03391777   -0.00094549    0.02446722   -0.01070823   -0.00310538
H    3.38490201    0.19800558    0.00074838   -0.01031279    0.01638949    0.00077900
   15
   -420.53896422
H   -2.64433028    0.51236527   -0.03600968    0.00768028    0.02428996   -0.00045375
O   -2.00885341    1.23361629   -0.02400566   -0.02900906   -0.02769414    0.00004386
O   -1.95225366   -1.24834506    0.01160407   -0.00256829    0.00778184   -0.00463058
C   -0.75778682    0.72282396    0.00713314    0.02567268    0.01800748   -0.00523151
C   -0.78815086   -0.78245092    0.04205202    0.02434608   -0.02641557    0.01338876
C    0.30645833    1.57660487    0.01970023    0.00984889    0.00067176    0.00518391
C    0.36243182   -1.59085138   -0.04248879   -0.02569990    0.01354667   -0.01093665
C    1.65789613    1.22985598    0.01243201   -0.01255952   -0.02113965    0.00385350
C    1.70167264   -1.23444375   -0.00662848   -0.02230703    0.00756678    0.00320204
H    0.03210730    2.61881487   -0.05165993   -0.00238487   -0.00655378   -0.00210880
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H    2.50967529   -1.98449358   -0.02113389    0.01818999    0.00937891    0.00035694
C    2.32100251    0.03210553   -0.00061179    0.02306549   -0.01357978   -0.00386286
H    3.38027519    0.20719439    0.01016294   -0.01182838    0.01786769    0.00107806
   15
   -420.53967757
H   -2.63912526    0.51541889   -0.03708011    0.01135139    0.02690185   -0.00043784
O   -2.00711221    1.23463100   -0.02445873   -0.02795884   -0.03022206   -0.00020043
O   -1.95462179   -1.25399069    0.01059453   -0.00631499    0.00485231   -0.00500793
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C   -0.78947068   -0.78066334    0.04534174    0.02597095   -0.02135599    0.01420451
C    0.30743540    1.57860668    0.01794119    0.01027353    0.00003833    0.00527069
C    0.36429345   -1.58924740   -0.04507360   -0.02209617    0.01152754   -0.01133471
C    1.66204158    1.23162165    0.01091044   -0.00990830   -0.02182969    0.00383362
C    1.70188983   -1.23322389   -0.00537012   -0.02152559    0.00973521    0.00372485
H    0.04559000    2.63010758   -0.05663752   -0.00161628   -0.00176130   -0.00230421
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H    2.34503372    2.08128814   -0.04721737    0.00392949   -0.00290445   -0.00278382
H    2.50049166   -1.99200381   -0.02230999    0.01686889    0.00838394    0.00024945
C    2.31909376    0.03049803   -0.00021972    0.01970324   -0.01600748   -0.00458518
H    3.37775529    0.21316780    0.01938372   -0.01179567    0.01918588    0.00136115
   15
   -420.54062420
H   -2.63591243    0.51368686   -0.03807085    0.01150044    0.02561536   -0.00048377
O   -2.00505741    1.23598487   -0.02490957   -0.02303935   -0.02876667   -0.00037918
O   -1.95691880   -1.25969139    0.00964176   -0.00949871    0.00195778   -0.00534679
C   -0.76845180    0.71917559    0.01449698    0.00707938    0.00671058   -0.00400413
C   -0.79118186   -0.77855359    0.04841673    0.02651819   -0.01570534    0.01497257
C    0.30825777    1.58060795    0.01610256    0.01021295   -0.00065503    0.00528295
C    0.36648841   -1.58781711   -0.04748709   -0.01785321    0.00903051   -0.01168834
C    1.66633660    1.23371712    0.00933098   -0.00704704   -0.02230810    0.00374381
C    1.70243113   -1.23215071   -0.00416803   -0.01963659    0.01148986    0.00420517
H    0.05936253    2.64171763   -0.06120006   -0.00071176    0.00308988   -0.00253403
H    0.11410322   -2.64541401   -0.04698194   -0.00285230    0.00121081    0.00250981
H    2.35825939    2.08090072   -0.04850452    0.00628174   -0.00143670   -0.00281665
H    2.48828388   -2.00102641   -0.02353109    0.01468647    0.00759150    0.00014823
C    2.31688917    0.02913202    0.00024166    0.01464795   -0.01799718   -0.00529318
H    3.37733825    0.21569167    0.02835926   -0.01033809    0.02019143    0.00165990
   15
   -420.54165763
H   -2.63472204    0.50739642   -0.03897351    0.00838253    0.02068246   -0.00059749
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   15
   -420.54253275
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   15
   -420.54299887
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   15
   -420.54294445
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   15
   -420.54248634
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   15
   -420.54176110
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   15
   -420.54087730
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C    1.69644603    1.25712161   -0.00306008    0.01851864   -0.00782406    0.00062836
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   15
   -420.53995252
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O   -1.96974709   -1.30352760    0.00441885   -0.01685019   -0.01733828   -0.00647763
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   15
   -420.53906974
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C   -0.82125928   -0.75981992    0.06488130    0.00075225    0.03085185    0.01800695
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   15
   -420.53819589
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C   -0.82540281   -0.75924042    0.06536974   -0.00298799    0.03256506    0.01776194
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   15
   -420.53741210
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O   -1.97147763   -1.31740937    0.00364987   -0.01534562   -0.02072488   -0.00629946
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C   -0.82950138   -0.75915201    0.06558979   -0.00655741    0.03323567    0.01738990
C    0.31221611    1.59816287   -0.00802218   -0.00825670    0.03330083   -0.00226675
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   15
   -420.53665440
H   -2.57207430    0.43942108   -0.03843149    0.00742806   -0.00753647   -0.00012467
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O   -1.97169761   -1.32158045    0.00353765   -0.01457147   -0.02122507   -0.00617303
C   -0.80820546    0.70944715    0.05977544   -0.05836102   -0.03015948    0.00810411
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C    0.31285020    1.59801938   -0.01028618   -0.00844067    0.03472807   -0.00304840
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C    1.71711671   -1.23621123    0.00387384    0.01593679    0.01648128    0.00669396
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H    2.40824845    2.10088542   -0.03320405    0.00030576   -0.00824077    0.00011044
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C    2.29905898    0.03309189    0.01455963   -0.02560149    0.00199923   -0.00853420
H    3.38607075    0.00105312    0.09597718   -0.00031763   -0.00489349    0.00360701
   15
   -420.53600852
H   -2.56111572    0.44625854   -0.03764118    0.01388785   -0.00178215    0.00006053
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O   -1.97175246   -1.32551104    0.00349542   -0.01362282   -0.02143696   -0.00600959
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C   -0.83735059   -0.76047325    0.06524921   -0.01314989    0.03146174    0.01625108
C    0.31361124    1.59735348   -0.01250431   -0.00806953    0.03396867   -0.00367210
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C    1.71299109    1.28199698   -0.01410661    0.02117856    0.01258407   -0.00352981
C    1.71760105   -1.23817437    0.00391504    0.01742953    0.01452681    0.00652423
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C    2.29994778    0.03427708    0.01662174   -0.02286190    0.00489133   -0.00799085
H    3.38245040   -0.02514035    0.09724897   -0.00301601   -0.00824875    0.00332005
   15
   -420.53551258
H   -2.55264816    0.45341527   -0.03686117    0.01967528    0.00408632    0.00021055
O   -1.99098668    1.25956061   -0.03016611    0.01839861   -0.00384187   -0.00374035
O   -1.97165297   -1.32919867    0.00352132   -0.01246719   -0.02140963   -0.00580371
C   -0.80453109    0.71341435    0.06635102   -0.05302246   -0.02502915    0.01011607
C   -0.84100149   -0.76185614    0.06470580   -0.01620503    0.02910190    0.01548346
C    0.31449374    1.59617669   -0.01466712   -0.00721738    0.03098684   -0.00414269
C    0.39203003   -1.56653244   -0.06242349    0.03231262   -0.00503875   -0.00703061
C    1.71452554    1.28570461   -0.01582102    0.01793403    0.01364825   -0.00419882
C    1.71782209   -1.24035598    0.00385773    0.01876172    0.01161349    0.00624988
H    0.14605665    2.65534574   -0.08239030    0.01374151   -0.00671933    0.00029278
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H    2.40676639    2.11891013   -0.02849619    0.00161695   -0.00473771    0.00057571
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C    2.30118211    0.03538872    0.01880458   -0.01998940    0.00745974   -0.00736719
H    3.37936804   -0.04985281    0.09792315   -0.00537281   -0.01133907    0.00302491
   15
   -420.53518964
H   -2.54769903    0.45985048   -0.03611783    0.02382830    0.00895801    0.00027852
O   -1.99253884    1.26061694   -0.03035954    0.01161991   -0.00856708   -0.00418581
O   -1.97141227   -1.33264364    0.00361302   -0.01108517   -0.02118453   -0.00555846
C   -0.80146792    0.71598690    0.06941697   -0.04776811   -0.02107707    0.01110530
C   -0.84440755   -0.76367800    0.06392846   -0.01911667    0.02587749    0.01458686
C    0.31548485    1.59453379   -0.01676748   -0.00598392    0.02604982   -0.00447106
C    0.39117352   -1.56428650   -0.06234458    0.03175421   -0.00341997   -0.00600986
C    1.71578941    1.28920640   -0.01747195    0.01413336    0.01422483   -0.00486335
C    1.71775970   -1.24271208    0.00370605    0.01990314    0.00776353    0.00586915
H    0.13576726    2.65624795   -0.08268980    0.01209493   -0.00387431    0.00029120
H    0.18985973   -2.62528554   -0.21576692    0.00597810   -0.00217765   -0.00335906
H    2.40566108    2.12937653   -0.02627692    0.00282789   -0.00218030    0.00080640
H    2.28703193   -2.18112929   -0.03749192   -0.01380067   -0.01596961   -0.00055729
C    2.30271889    0.03638799    0.02109871   -0.01728364    0.00965977   -0.00667497
H    3.37724389   -0.07252915    0.09805285   -0.00710730   -0.01409945    0.00273542
   15
   -420.53518934
H   -2.54700357    0.46470482   -0.03542351    0.02550227    0.01164656    0.00026332
O   -1.99422394    1.26176846   -0.03050551    0.00606043   -0.01113046   -0.00461125
O   -1.97104604   -1.33584845    0.00376772   -0.00948202   -0.02080344   -0.00527128
C   -0.79768453    0.71887709    0.07231503   -0.04085912   -0.01626762    0.01207911
C   -0.84752474   -0.76589020    0.06293072   -0.02188494    0.02190198    0.01356393
C    0.31656615    1.59249872   -0.01880040   -0.00450885    0.01971143   -0.00468421
C    0.38983754   -1.56198917   -0.06217484    0.03064862   -0.00153860   -0.00495797
C    1.71683987    1.29249346   -0.01904935    0.01009182    0.01452861   -0.00553026
C    1.71739668   -1.24518457    0.00346577    0.02078750    0.00309674    0.00538390
H    0.12330479    2.65783399   -0.08304137    0.01000013   -0.00012133    0.00025725
H    0.19000619   -2.62104780   -0.22505600    0.00626102   -0.00137553   -0.00366184
H    2.40404621    2.14023376   -0.02420289    0.00406488    0.00052420    0.00104181
H    2.28830344   -2.18094662   -0.03765955   -0.01374315   -0.01513398   -0.00040871
C    2.30451742    0.03724170    0.02349374   -0.01491989    0.01145762   -0.00595326
H    3.37638780   -0.09267243    0.09768969   -0.00805712   -0.01650676    0.00247153
   15
   -420.53551063
H   -2.55085570    0.46750461   -0.03477557    0.02421096    0.01144648    0.00017415
O   -1.99597950    1.26304358   -0.03059919    0.00235441   -0.01083125   -0.00501482
O   -1.97057241   -1.33881736    0.00398219   -0.00768918   -0.02031330   -0.00494851
C   -0.79328516    0.72201232    0.07503049   -0.03247371   -0.01071078    0.01303139
C   -0.85031130   -0.76843279    0.06172805   -0.02445500    0.01730658    0.01242003
C    0.31771558    1.59016657   -0.02076262   -0.00296258    0.01262392   -0.00481399
C    0.38803881   -1.55966889   -0.06193015    0.02901834    0.00061301   -0.00387938
C    1.71773763    1.29556087   -0.02054314    0.00615566    0.01482659   -0.00618808
C    1.71671979   -1.24770305    0.00314420    0.02132276   -0.00221741    0.00480515
H    0.10904775    2.65943611   -0.08343937    0.00753681    0.00393885    0.00021647
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H    2.40169925    2.15100086   -0.02231655    0.00516701    0.00307343    0.00128117
H    2.29204606   -2.17805101   -0.03775440   -0.01348742   -0.01356133   -0.00022085
C    2.30654209    0.03792271    0.02597872   -0.01298225    0.01279450   -0.00518663
H    3.37696842   -0.10984952    0.09688046   -0.00814829   -0.01856830    0.00223780
   15
   -420.53599418
H   -2.55902542    0.46828512   -0.03415780    0.02010576    0.00841329    0.00000992
O   -1.99776356    1.26443903   -0.03063600    0.00061485   -0.00776983   -0.00539575
O   -1.97001169   -1.34155594    0.00425277   -0.00576696   -0.01973266   -0.00459400
C   -0.78839624    0.72530875    0.07754899   -0.02292005   -0.00453895    0.01394037
C   -0.85272846   -0.77123648    0.06033772   -0.02674403    0.01224001    0.01116948
C    0.31890985    1.58764368   -0.02265211   -0.00148848    0.00544619   -0.00489073
C    0.38580190   -1.55735821   -0.06162684    0.02690987    0.00304023   -0.00278055
C    1.71854183    1.29840382   -0.02194341    0.00260837    0.01534680   -0.00682462
C    1.71572100   -1.25018758    0.00275007    0.02143365   -0.00788979    0.00414963
H    0.09343757    2.66033139   -0.08387655    0.00484248    0.00773411    0.00020089
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H    2.39842775    2.16122002   -0.02066085    0.00587733    0.00526349    0.00151660
H    2.29821399   -2.17272138   -0.03780991   -0.01301407   -0.01145822   -0.00000455
C    2.30876351    0.03841083    0.02854210   -0.01142574    0.01364305   -0.00438559
H    3.37900374   -0.12369080    0.09566793   -0.00744149   -0.02021680    0.00202384
   15
   -420.53651418
H   -2.57078408    0.46758006   -0.03354118    0.01389098    0.00338137   -0.00019652
O   -1.99955601    1.26592084   -0.03061160    0.00041620   -0.00277317   -0.00575515
O   -1.96938559   -1.34407074    0.00457546   -0.00380253   -0.01909147   -0.00422544
C   -0.78316173    0.72867329    0.07985678   -0.01258469    0.00206839    0.01479614
C   -0.85474174   -0.77422486    0.05877862   -0.02862783    0.00685881    0.00982938
C    0.32012689    1.58503781   -0.02446762   -0.00023658   -0.00123747   -0.00494591
C    0.38315873   -1.55509385   -0.06128150    0.02432525    0.00575274   -0.00166782
C    1.71930589    1.30101428   -0.02324052   -0.00034103    0.01624961   -0.00743414
C    1.71439880   -1.25255279    0.00229327    0.02100171   -0.01359215    0.00344136
H    0.07695662    2.65984727   -0.08435051    0.00208257    0.01070464    0.00023424
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H    2.39410550    2.17049992   -0.01927799    0.00608806    0.00687596    0.00173936
H    2.30672021   -2.16533300   -0.03786476   -0.01223116   -0.00906285    0.00022612
C    2.31115798    0.03869338    0.03117178   -0.01010581    0.01391462   -0.00354983
H    3.38237016   -0.13389915    0.09409152   -0.00611533   -0.02143686    0.00181444
   15
   -420.53683976
H   -2.58502781    0.46627746   -0.03288894    0.00659477   -0.00244088   -0.00041862
O   -2.00135393    1.26743342   -0.03052195    0.00104173    0.00296476   -0.00609303
O   -1.96871630   -1.34636901    0.00494606   -0.00190298   -0.01841879   -0.00384319
C   -0.77773734    0.73200628    0.08194096   -0.00191132    0.00891494    0.01557006
C   -0.85632286   -0.77731673    0.05707100   -0.02994841    0.00131064    0.00841650
C    0.32134793    1.58244951   -0.02620836    0.00067306   -0.00698716   -0.00498486
C    0.38014830   -1.55291679   -0.06091098    0.02129608    0.00873302   -0.00053934
C    1.72007423    1.30337845   -0.02442529   -0.00255350    0.01764243   -0.00799937
C    1.71275984   -1.25471286    0.00178447    0.01992163   -0.01897752    0.00270968
H    0.06010073    2.65745281   -0.08486767   -0.00064377    0.01254357    0.00033372
H    0.17922633   -2.60328481   -0.25518832    0.00590779    0.00213890   -0.00451581
H    2.38869578    2.17855151   -0.01820799    0.00571927    0.00780731    0.00194177
H    2.31742220   -2.15631422   -0.03796035   -0.01103902   -0.00662341    0.00045735
C    2.31370531    0.03876627    0.03385503   -0.00885199    0.01355565   -0.00265632
H    3.38683148   -0.14025578    0.09218864   -0.00437870   -0.02218454    0.00160418
   15
   -420.53692566
H   -2.60045837    0.46540949   -0.03216141   -0.00074182   -0.00793555   -0.00063748
O   -2.00316374    1.26891274   -0.03036322    0.00174645    0.00830984   -0.00640649
O   -1.96802529   -1.34845833    0.00536027   -0.00017019   -0.01774452   -0.00346329
C   -0.77228389    0.73520439    0.08378983    0.00866140    0.01580642    0.01625557
C   -0.85745196   -0.78042840    0.05523619   -0.03057973   -0.00424694    0.00694982
C    0.32255902    1.57996537   -0.02787371    0.00127478   -0.01150443   -0.00502082
C    0.37681640   -1.55087204   -0.06053228    0.01784287    0.01193928    0.00059035
C    1.72088024    1.30547526   -0.02548918   -0.00395834    0.01953821   -0.00851272
C    1.71082057   -1.25658686    0.00123469    0.01810933   -0.02368400    0.00197989
H    0.04335323    2.65281916   -0.08544557   -0.00307956    0.01307412    0.00048813
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H    2.38226514    2.18520842   -0.01748713    0.00475529    0.00799287    0.00211488
H    2.33010457   -2.14609940   -0.03813806   -0.00935386   -0.00440563    0.00067263
C    2.31638631    0.03863499    0.03657836   -0.00748583    0.01252135   -0.00171423
H    3.39207869   -0.14262696    0.08999702   -0.00247383   -0.02239984    0.00137080
   15
   -420.53673943
H   -2.61576716    0.46595323   -0.03131942   -0.00728637   -0.01227440   -0.00083755
O   -2.00499288    1.27029891   -0.03013184    0.00193886    0.01245263   -0.00669193
O   -1.96733209   -1.35034634    0.00581376    0.00128688   -0.01710195   -0.00309057
C   -0.76696081    0.73816374    0.08539304    0.01872507    0.02251746    0.01684370
C   -0.85811974   -0.78347605    0.05329633   -0.03038760   -0.00966457    0.00545948
C    0.32375132    1.57765340   -0.02946310    0.00148213   -0.01455658   -0.00507796
C    0.37321522   -1.54900802   -0.06016249    0.01399053    0.01531532    0.00170980
C    1.72174510    1.30727611   -0.02642443   -0.00453962    0.02189315   -0.00896489
C    1.70860846   -1.25810389    0.00065494    0.01550612   -0.02746370    0.00128097
H    0.02715596    2.64585286   -0.08611229   -0.00526158    0.01218069    0.00070388
H    0.16733649   -2.59606852   -0.26551619    0.00482305    0.00308563   -0.00485092
H    2.37498633    2.19043680   -0.01714649    0.00324915    0.00744886    0.00225295
H    2.34446316   -2.13508515   -0.03843646   -0.00712269   -0.00259841    0.00085942
C    2.31918009    0.03831520    0.03932752   -0.00584840    0.01080469   -0.00071906
H    3.39777232   -0.14097451    0.08755868   -0.00061683   -0.02206022    0.00111249
   15
   -420.53640813
H   -2.62978404    0.46868337   -0.03032714   -0.01246126   -0.01500283   -0.00100491
O   -2.00684320    1.27154532   -0.02982459    0.00124369    0.01496206   -0.00693962
O   -1.96665315   -1.35204030    0.00630234    0.00238525   -0.01652404   -0.00273824
C   -0.76191983    0.74078310    0.08674170    0.02793401    0.02884399    0.01733259
C   -0.85832916   -0.78637791    0.05127392   -0.02930090   -0.01479961    0.00397015
C    0.32492150    1.57555964   -0.03097568    0.00140277   -0.01606492   -0.00516028
C    0.36940296   -1.54737566   -0.05981851    0.00978371    0.01875858    0.00280204
C    1.72267768    1.30874554   -0.02722422   -0.00435713    0.02458257   -0.00935013
C    1.70616284   -1.25920698    0.00005575    0.01213347   -0.03017095    0.00063482
H    0.01189701    2.63671331   -0.08690655   -0.00696863    0.00992530    0.00097543
H    0.16003704   -2.59325591   -0.26938500    0.00408226    0.00323911   -0.00501928
H    2.36712908    2.19433316   -0.01721091    0.00129352    0.00627423    0.00235367
H    2.36009597   -2.12359556   -0.03888900   -0.00433457   -0.00129215    0.00100948
C    2.32206185    0.03783287    0.04208752   -0.00385006    0.00840834    0.00030846
H    3.40358032   -0.13535985    0.08492052    0.00101581   -0.02115721    0.00082083
   15
   -420.53598526
H   -2.64158267    0.47408793   -0.02915433   -0.01589483   -0.01590234   -0.00114110
O   -2.00870660    1.27262368   -0.02943865   -0.00057147    0.01562722   -0.00714799
O   -1.96600090   -1.35354672    0.00682199    0.00307740   -0.01604724   -0.00240561
C   -0.75729982    0.74296708    0.08782840    0.03599466    0.03458093    0.01773028
C   -0.85809667   -0.78905651    0.04919147   -0.02730737   -0.01953458    0.00249853
C    0.32607077    1.57370689   -0.03241019    0.00107243   -0.01602282   -0.00528023
C    0.36544315   -1.54602686   -0.05951683    0.00527522    0.02214133    0.00383727
C    1.72367535    1.30984314   -0.02788273   -0.00353360    0.02739804   -0.00966506
C    1.70353455   -1.25985524   -0.00055312    0.00810403   -0.03178161    0.00005749
H   -0.00211368    2.62580499   -0.08787698   -0.00825542    0.00644263    0.00128399
H    0.15200439   -2.59102374   -0.27235032    0.00323544    0.00320472   -0.00517566
H    2.35904322    2.19710683   -0.01769852   -0.00095720    0.00463965    0.00241806
H    2.37650196   -2.11186627   -0.03952261   -0.00106754   -0.00046020    0.00111943
C    2.32500133    0.03722410    0.04484286   -0.00145678    0.00541120    0.00135211
H    3.40921045   -0.12594561    0.08213514    0.00229581   -0.01970703    0.00049981
   15
   -420.53556081
H   -2.65054767    0.48232653   -0.02777664   -0.01737680   -0.01485733   -0.00124257
O   -2.01056233    1.27352650   -0.02897167   -0.00366424    0.01439753   -0.00731175
O   -1.96538317   -1.35487099    0.00736896    0.00334427   -0.01570350   -0.00209925
C   -0.75322239    0.74462919    0.08864711    0.04270432    0.03952673    0.01805256
C   -0.85745235   -0.79144036    0.04707118   -0.02444712   -0.02376157    0.00107307
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   15
   -420.53511657
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O   -1.96480300   -1.35601701    0.00793975    0.00320438   -0.01549387   -0.00181349
C   -0.74978885    0.74569485    0.08919295    0.04793470    0.04350032    0.01831559
C   -0.85643931   -0.79346566    0.04493459   -0.02082068   -0.02738837   -0.00028221
C    0.32832786    1.57070119   -0.03503704    0.00018965   -0.01193895   -0.00564582
C    0.35735673   -1.54438075   -0.05910158   -0.00434596    0.02813458    0.00561654
C    1.72580983    1.31075616   -0.02875791   -0.00067084    0.03225488   -0.01008444
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C    2.33090301    0.03581502    0.05027588    0.00440117   -0.00186265    0.00346042
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   15
   -420.53466292
H   -2.65929652    0.50621160   -0.02433878   -0.01404157   -0.00700444   -0.00137197
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O   -1.96425886   -1.35698713    0.00853113    0.00272241   -0.01545246   -0.00155536
C   -0.74707818    0.74610417    0.08946193    0.05162037    0.04634478    0.01853749
C   -0.85511219   -0.79507766    0.04280217   -0.01659527   -0.03034469   -0.00155046
C    0.32944860    1.56948729   -0.03622387   -0.00002120   -0.00857298   -0.00587592
C    0.35337525   -1.54417368   -0.05901484   -0.00924861    0.03044710    0.00629835
C    1.72690388    1.31049893   -0.02896824    0.00093091    0.03363575   -0.01019080
C    1.69519212   -1.25889566   -0.00235624   -0.00569499   -0.03155049   -0.00120877
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H    2.33747242    2.20174099   -0.02178752   -0.00732171   -0.00039315    0.00242701
H    2.42429230   -2.07646246   -0.04266985    0.00959117    0.00059617    0.00122479
C    2.33377697    0.03512436    0.05292184    0.00765106   -0.00581609    0.00446702
H    3.42311414   -0.07792066    0.07348196    0.00361570   -0.01266934   -0.00053588
   15
   -420.53411429
H   -2.65967823    0.52044854   -0.02225489   -0.00941147   -0.00047698   -0.00141937
O   -2.01565386    1.27542617   -0.02706914   -0.02113116    0.00000798   -0.00748228
O   -1.96374536   -1.35778183    0.00914018    0.00197419   -0.01556008   -0.00131994
C   -0.74514614    0.74581432    0.08945069    0.05377893    0.04792336    0.01872529
C   -0.85353464   -0.79623176    0.04069304   -0.01196627   -0.03255969   -0.00270173
C    0.33056924    1.56840278   -0.03732185    0.00013624   -0.00499825   -0.00611426
C    0.34953350   -1.54442615   -0.05902311   -0.01406604    0.03209851    0.00680237
C    1.72798401    1.30973447   -0.02902458    0.00239686    0.03392192   -0.01022225
C    1.69248991   -1.25761119   -0.00292819   -0.00990525   -0.03045635   -0.00147525
H   -0.04225562    2.57908805   -0.09467149   -0.00943157   -0.01265576    0.00252784
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H    2.33244487    2.20305570   -0.02402780   -0.00858466   -0.00114713    0.00238047
H    2.43762061   -2.06480556   -0.04415581    0.01261619    0.00106911    0.00120662
C    2.33653525    0.03452156    0.05550033    0.01090153   -0.00974536    0.00541754
H    3.42648820   -0.05672587    0.07070516    0.00335040   -0.00967121   -0.00086476
   15
   -420.53352216
H   -2.65838631    0.53475586   -0.01991533   -0.00339378    0.00710819   -0.00146928
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O   -1.96325412   -1.35839990    0.00976421    0.00106337   -0.01580736   -0.00110617
C   -0.74402545    0.74480153    0.08915634    0.05447791    0.04814818    0.01889854
C   -0.85177636   -0.79689452    0.03862461   -0.00717234   -0.03397725   -0.00372217
C    0.33168703    1.56739428   -0.03832743    0.00088342   -0.00177535   -0.00632467
C    0.34590416   -1.54516299   -0.05913397   -0.01865904    0.03297269    0.00710207
C    1.72902823    1.30845870   -0.02892644    0.00360327    0.03292180   -0.01018141
C    1.68993669   -1.25586642   -0.00347790   -0.01347171   -0.02917031   -0.00167608
H   -0.04805669    2.57094579   -0.09737951   -0.00936853   -0.01605206    0.00268580
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H    2.32895282    2.20456501   -0.02669624   -0.00915803   -0.00108560    0.00230735
H    2.44868760   -2.05334521   -0.04585898    0.01499104    0.00183582    0.00117630
C    2.33912898    0.03406593    0.05799702    0.01394949   -0.01349242    0.00628976
H    3.42926169   -0.03379221    0.06808374    0.00289470   -0.00653162   -0.00117408
   15
   -420.53299322
H   -2.65648931    0.54778334   -0.01731122    0.00300473    0.01468942   -0.00152118
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O   -1.96277488   -1.35883856    0.01040082    0.00009451   -0.01617146   -0.00091415
C   -0.74372679    0.74306245    0.08857628    0.05381348    0.04698499    0.01905672
C   -0.84990955   -0.79704460    0.03661228   -0.00245861   -0.03454281   -0.00459303
C    0.33279062    1.56641366   -0.03923747    0.00231884    0.00060682   -0.00646855
C    0.34255648   -1.54639734   -0.05935195   -0.02288227    0.03298699    0.00718561
C    1.73001832    1.30668676   -0.02867446    0.00452370    0.03060378   -0.01005354
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H   -0.05216827    2.56566960   -0.10056921   -0.00950350   -0.01781748    0.00271414
H    0.09764716   -2.58839828   -0.27000707   -0.00256200    0.00213381   -0.00521464
H    2.32709911    2.20625768   -0.02977959   -0.00901680   -0.00018587    0.00220050
H    2.45706746   -2.04222045   -0.04777382    0.01656402    0.00296138    0.00113655
C    2.34151228    0.03381383    0.06039872    0.01661329   -0.01685803    0.00707051
H    3.43151467   -0.00968682    0.06567343    0.00238167   -0.00326074   -0.00145979
   15
   -420.53269045
H   -2.65511872    0.55818753   -0.01443341    0.00839205    0.02079231   -0.00156141
O   -2.01853710    1.27738465   -0.02440687   -0.04286267   -0.01971173   -0.00719105
O   -1.96229675   -1.35909370    0.01104781   -0.00083030   -0.01662184   -0.00074282
C   -0.74424030    0.74061465    0.08770809    0.05191975    0.04444307    0.01919659
C   -0.84800518   -0.79667349    0.03466919    0.00193670   -0.03420880   -0.00529906
C    0.33385833    1.56542524   -0.04004983    0.00444507    0.00186647   -0.00651662
C    0.33955418   -1.54812927   -0.05967831   -0.02660300    0.03206288    0.00704653
C    1.73094029    1.30445357   -0.02827060    0.00522003    0.02708620   -0.00982963
C    1.68547919   -1.25107484   -0.00449948   -0.01794812   -0.02638407   -0.00189134
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H    2.32685918    2.20797355   -0.03325849   -0.00823005    0.00142951    0.00205191
H    2.46247856   -2.03163408   -0.04989325    0.01723513    0.00444808    0.00109334
C    2.34364511    0.03381603    0.06269364    0.01870855   -0.01972914    0.00775266
H    3.43333812    0.01500633    0.06352547    0.00192339   -0.00001924   -0.00171342
   15
   -420.53281180
H   -2.65522292    0.56489090   -0.01127509    0.01132195    0.02397648   -0.00156037
O   -2.01862824    1.27839287   -0.02335440   -0.04601992   -0.02197443   -0.00706000
O   -1.96180933   -1.35916023    0.01170325   -0.00162011   -0.01712641   -0.00059229
C   -0.74553747    0.73749648    0.08654970    0.04892154    0.04059452    0.01930535
C   -0.84612945   -0.79578629    0.03280601    0.00581104   -0.03293468   -0.00582936
C    0.33485812    1.56440999   -0.04076381    0.00714466    0.00198367   -0.00644790
C    0.33695333   -1.55034483   -0.06011094   -0.02969421    0.03020123    0.00668663
C    1.73178345    1.30181202   -0.02771824    0.00582783    0.02261473   -0.00950174
C    1.68364238   -1.24807008   -0.00496807   -0.01868748   -0.02496722   -0.00191961
H   -0.05516931    2.56464120   -0.10838407   -0.01063148   -0.01577392    0.00229194
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H    2.32809384    2.20942501   -0.03710608   -0.00695586    0.00352676    0.00185364
H    2.46480025   -2.02185315   -0.05220947    0.01698522    0.00625163    0.00104737
C    2.34549592    0.03411578    0.06487147    0.02011732   -0.02197550    0.00832976
H    3.43481293    0.03970378    0.06168549    0.00162190    0.00316512   -0.00193368
   15
   -420.53341105
H   -2.65731734    0.56733445   -0.00783701    0.01095489    0.02333546   -0.00147647
O   -2.01820093    1.27964675   -0.02222171   -0.04533604   -0.02032067   -0.00697124
O   -1.96130371   -1.35903248    0.01236543   -0.00221170   -0.01765577   -0.00046421
C   -0.74757320    0.73376601    0.08509948    0.04498198    0.03553290    0.01937045
C   -0.84434072   -0.79440229    0.03103076    0.00899007   -0.03070472   -0.00617953
C    0.33574949    1.56336586   -0.04138045    0.01017535    0.00118820   -0.00625745
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C    1.73253839    1.29882929   -0.02702235    0.00651600    0.01751815   -0.00906710
C    1.68208693   -1.24468788   -0.00540768   -0.01845289   -0.02350256   -0.00190424
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H    2.33057646    2.21023948   -0.04128660   -0.00538237    0.00577626    0.00160287
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C    2.34704348    0.03474692    0.06692348    0.02077742   -0.02351287    0.00880001
H    3.43599290    0.06383324    0.06019316    0.00151969    0.00622117   -0.00212115
   15
   -420.53441052
H   -2.66133694    0.56562907   -0.00413476    0.00737983    0.01912618   -0.00128024
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O   -1.96077322   -1.35870445    0.01303289   -0.00255884   -0.01818072   -0.00035877
C   -0.75028803    0.72949960    0.08335647    0.04022025    0.02939393    0.01937450
C   -0.84268698   -0.79255521    0.02934872    0.01140429   -0.02751089   -0.00634842
C    0.33648701    1.56230438   -0.04190262    0.01322547   -0.00011449   -0.00595678
C    0.33313164   -1.55610053   -0.06127034   -0.03364856    0.02379209    0.00538774
C    1.73319454    1.29558205   -0.02618950    0.00743624    0.01213793   -0.00852820
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H    2.33402663    2.21001639   -0.04575496   -0.00370777    0.00786887    0.00130195
H    2.46050712   -2.00603837   -0.05739841    0.01401086    0.01035241    0.00093904
C    2.34827779    0.03573263    0.06884257    0.02070237   -0.02427936    0.00916408
H    3.43689689    0.08684543    0.05908223    0.00159611    0.00908870   -0.00227617
   15
   -420.53552501
H   -2.66665368    0.56051568   -0.00020369    0.00164977    0.01248506   -0.00096928
O   -2.01586266    1.28277589   -0.01971899   -0.03388952   -0.00704460   -0.00702426
O   -1.96021394   -1.35817022    0.01370444   -0.00264477   -0.01867415   -0.00027849
C   -0.75361014    0.72478987    0.08132061    0.03476471    0.02233557    0.01929791
C   -0.84120471   -0.79029332    0.02776245    0.01301745   -0.02338434   -0.00634328
C    0.33702489    1.56124468   -0.04233483    0.01600477   -0.00146198   -0.00556839
C    0.33197047   -1.55954401   -0.06197754   -0.03442535    0.01942737    0.00449851
C    1.73373783    1.29215124   -0.02522782    0.00870653    0.00678769   -0.00789469
C    1.67979371   -1.23688227   -0.00620157   -0.01562038   -0.02002976   -0.00174655
H   -0.04489296    2.58212973   -0.12292156   -0.01285119   -0.00311249    0.00063552
H    0.06284258   -2.59808531   -0.24284021   -0.00601553    0.00337226   -0.00347727
H    2.33814552    2.20838333   -0.05045715   -0.00211663    0.00951392    0.00096087
H    2.45442298   -2.00073768   -0.06025149    0.01162444    0.01229500    0.00086392
C    2.34919988    0.03708445    0.07062323    0.01997472   -0.02422944    0.00942553
H    3.43751169    0.10822486    0.05838061    0.00179834    0.01171093   -0.00239900
   15
   -420.53652731
H   -2.67225731    0.55316690    0.00390064   -0.00478084    0.00495240   -0.00057071
O   -2.01407919    1.28450310   -0.01834840   -0.02563537    0.00181831   -0.00714019
O   -1.95962492   -1.35742417    0.01437919   -0.00246649   -0.01912646   -0.00022474
C   -0.75745718    0.71974334    0.07899311    0.02872814    0.01452974    0.01912107
C   -0.83991829   -0.78767890    0.02627189    0.01385546   -0.01839226   -0.00617596
C    0.33732143    1.56020663   -0.04268293    0.01826421   -0.00244298   -0.00512464
C    0.33132883   -1.56328051   -0.06275265   -0.03441760    0.01446520    0.00349273
C    1.73414898    1.28861745   -0.02414688    0.01039253    0.00173065   -0.00718281
C    1.67901368   -1.23251179   -0.00655825   -0.01349986   -0.01769220   -0.00159842
H   -0.03699819    2.59020441   -0.12814389   -0.01297460    0.00153466   -0.00005608
H    0.05870308   -2.60163374   -0.23523827   -0.00647492    0.00353588   -0.00304067
H    2.34264872    2.20504711   -0.05533193   -0.00074841    0.01050039    0.00059333
H    2.44624994   -1.99764484   -0.06325957    0.00897263    0.01385386    0.00075521
C    2.34982059    0.03880157    0.07226150    0.01871892   -0.02332747    0.00958688
H    3.43780225    0.12749990    0.05811037    0.00203849    0.01403387   -0.00248718
   15
   -420.53731627
H   -2.67700919    0.54492021    0.00810703   -0.01060875   -0.00215714   -0.00012678
O   -2.01200482    1.28621010   -0.01689681   -0.01747202    0.01025302   -0.00725994
O   -1.95900811   -1.35646127    0.01505650   -0.00206751   -0.01948124   -0.00019506
C   -0.76173797    0.71447779    0.07637664    0.02219689    0.00617498    0.01882948
C   -0.83884051   -0.78478736    0.02487452    0.01399550   -0.01262398   -0.00586268
C    0.33734269    1.55920468   -0.04295357    0.01983054   -0.00274327   -0.00465444
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   15
   -420.53788297
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O   -1.95836804   -1.35527748    0.01573605   -0.00146429   -0.01973101   -0.00018933
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   15
   -420.53838176
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O   -1.95771149   -1.35386999    0.01641777   -0.00070324   -0.01985360   -0.00020741
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   15
   -420.53878881
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O   -1.95704706   -1.35223749    0.01710186    0.00018243   -0.01979680   -0.00024422
C   -0.77616660    0.69864949    0.06684764    0.00045103   -0.01997035    0.01715447
C   -0.83683812   -0.77536488    0.02118544    0.01125863    0.00770855   -0.00427225
C    0.33557655    1.55639086   -0.04337110    0.01990800    0.00190628   -0.00334688
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C    1.73387078    1.27485418   -0.01885629    0.02071648   -0.01249682   -0.00398321
C    1.67762420   -1.21288673   -0.00778027   -0.00672114   -0.00015918   -0.00034966
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   15
   -420.53916734
H   -2.67111968    0.52442004    0.02441155   -0.01594648   -0.01443332    0.00127855
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O   -1.95638477   -1.35038060    0.01778873    0.00116427   -0.01956222   -0.00029942
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C    0.33437665    1.55543889   -0.04340073    0.01851265    0.00527625   -0.00299696
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C    1.73312529    1.27177530   -0.01735245    0.02359314   -0.01434851   -0.00320268
C    1.67758105   -1.20777590   -0.00805819   -0.00615336    0.00644931    0.00013342
H    0.03423644    2.61488238   -0.15199902   -0.00506063    0.01062501   -0.00239806
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C    2.34921138    0.05194707    0.07828102    0.00965249   -0.00677422    0.00905154
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   15
   -420.53940612
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O   -1.95573577   -1.34830199    0.01847902    0.00222412   -0.01912084   -0.00036799
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C   -0.83637799   -0.76949008    0.01906269    0.00781194    0.02159929   -0.00292836
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C    0.33767958   -1.58738308   -0.06792666   -0.02218019   -0.01790263   -0.00315005
C    1.73202342    1.26891271   -0.01580016    0.02619831   -0.01566346   -0.00245345
C    1.67763130   -1.20276323   -0.00833817   -0.00590102    0.01356051    0.00064871
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H    2.37716598   -2.03087185   -0.08268458   -0.00012765    0.00469395   -0.00136234
C    2.34854033    0.05513664    0.07906196    0.00802678   -0.00160684    0.00872777
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   15
   -420.53936935
H   -2.65114994    0.52822159    0.03142145   -0.00678857   -0.00948081    0.00138073
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O   -1.95511206   -1.34600667    0.01917349    0.00335764   -0.01846720   -0.00044755
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C    0.33116801    1.55323248   -0.04332844    0.01429490    0.01372006   -0.00243450
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C    1.73052611    1.26628652   -0.01421076    0.02824848   -0.01661272   -0.00173567
C    1.67777090   -1.19795575   -0.00862797   -0.00576168    0.02075253    0.00116224
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H    0.06525921   -2.64109344   -0.17094595   -0.00755930   -0.00116628   -0.00023556
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H    2.36486313   -2.04245823   -0.08555993   -0.00041370    0.00048589   -0.00191770
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   15
   -420.53895215
H   -2.63887390    0.53295039    0.03455531   -0.00001461   -0.00462124    0.00124431
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O   -1.95452651   -1.34350206    0.01987305    0.00456596   -0.01760053   -0.00053475
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C    0.32922269    1.55185125   -0.04323512    0.01177895    0.01807370   -0.00218089
C    0.34290151   -1.59410728   -0.06944911   -0.01592004   -0.02633060   -0.00510742
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   15
   -420.53815986
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O   -1.95399282   -1.34079801    0.02057868    0.00585973   -0.01652484   -0.00063090
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C   -0.83649292   -0.76333352    0.01618506    0.00159332    0.03772493   -0.00094304
C    0.32709937    1.55019742   -0.04310885    0.00921395    0.02185664   -0.00188724
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C    1.72623505    1.26179885   -0.01096356    0.02960903   -0.01815579   -0.00036674
C    1.67830788   -1.18938323   -0.00926721   -0.00513189    0.03357453    0.00201393
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C    2.34588611    0.06451657    0.08063637    0.00385109    0.01502653    0.00752354
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   15
   -420.53711565
H   -2.61566424    0.54383034    0.04019869    0.01447381    0.00701128    0.00071791
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O   -1.95352568   -1.33790667    0.02129148    0.00724409   -0.01525739   -0.00073197
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C    0.32483665    1.54821446   -0.04295413    0.00672808    0.02449734   -0.00150267
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C    1.72342126    1.25996104   -0.00932651    0.02848290   -0.01903949    0.00032219
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   15
   -420.53610376
H   -2.60730637    0.54791788    0.04280071    0.01995472    0.01165335    0.00046282
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O   -1.95314081   -1.33484238    0.02201259    0.00872872   -0.01383560   -0.00083654
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C   -0.83674180   -0.76193402    0.01435499   -0.00299285    0.04272626    0.00021634
C    0.32247198    1.54586318   -0.04277688    0.00441142    0.02545131   -0.00096161
C    0.35241877   -1.60110650   -0.07112497   -0.00638852   -0.03470162   -0.00743244
C    1.72017847    1.25841121   -0.00769431    0.02601351   -0.02003043    0.00101632
C    1.67914963   -1.18281801   -0.01002595   -0.00343928    0.04181381    0.00240751
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H    2.38864281    2.09940937   -0.10317172    0.00118786   -0.01080514   -0.00246758
H    2.31741514   -2.08264634   -0.09268654   -0.00402905   -0.01264262   -0.00366233
C    2.34379181    0.06977902    0.08110684    0.00114086    0.02523993    0.00666432
H    3.42576118    0.13519920    0.08360075   -0.00259172    0.01132134   -0.00130626
   15
   -420.53547381
H   -2.60250108    0.54994155    0.04531780    0.02270835    0.01394103    0.00032099
O   -1.98604250    1.29070937    0.00406813   -0.00114742   -0.00333319   -0.00237392
O   -1.95285500   -1.33162129    0.02274319    0.01028493   -0.01227750   -0.00094615
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C   -0.83681585   -0.76218697    0.01343934   -0.00537883    0.04311386    0.00073882
C    0.32004037    1.54312960   -0.04258535    0.00227769    0.02435399   -0.00023148
C    0.35584809   -1.60243890   -0.07147335   -0.00319663   -0.03618610   -0.00799650
C    1.71654390    1.25716423   -0.00607751    0.02228521   -0.02102475    0.00172644
C    1.67965554   -1.18045527   -0.01045873   -0.00224241    0.04360930    0.00239336
H    0.15276092    2.59729325   -0.16938436    0.01421262   -0.00699992   -0.00181568
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H    2.30680686   -2.08819319   -0.09298088   -0.00592139   -0.01371579   -0.00383460
C    2.34270847    0.07187578    0.08118769   -0.00027867    0.02955964    0.00625259
H    3.42574124    0.11859653    0.08798165   -0.00214212    0.00889338   -0.00107086
   15
   -420.53527098
H   -2.60173669    0.54950021    0.04777465    0.02216429    0.01319266    0.00034702
O   -1.98368493    1.29035461    0.00628892    0.00257940   -0.00377255   -0.00189779
O   -1.95268591   -1.32826102    0.02348453    0.01188095   -0.01060663   -0.00105891
C   -0.80798475    0.67778623    0.02597022   -0.05119887   -0.05131271    0.00647294
C   -0.83680845   -0.76309002    0.01251256   -0.00779584    0.04207733    0.00122857
C    0.31757413    1.54003047   -0.04239056    0.00030655    0.02107640    0.00070622
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C    1.71257365    1.25623493   -0.00448679    0.01747224   -0.02183082    0.00241263
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   15
   -420.53556981
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   15
   -420.53614519
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   15
   -420.53676159
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O   -1.95305767   -1.31753766    0.02578572    0.01624042   -0.00530416   -0.00139252
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   15
   -420.53729853
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O   -1.95352937   -1.31381583    0.02658271    0.01722437   -0.00353098   -0.00149158
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C   -0.83526221   -0.77260017    0.00855138   -0.01562182    0.02598671    0.00297186
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   15
   -420.53772680
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O   -1.95419608   -1.31005400    0.02739662    0.01780139   -0.00178067   -0.00157846
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C    2.33692366    0.07366522    0.07987676   -0.00413809    0.03686132    0.00442017
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   15
   -420.53816940
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O   -1.95506429   -1.30627187    0.02822839    0.01788789   -0.00010880   -0.00164358
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C    1.68633055    1.25738439    0.00399749   -0.01719630   -0.01223533    0.00468497
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   15
   -420.53867782
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O   -1.95613489   -1.30248839    0.02907879    0.01742257    0.00147409   -0.00168931
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C   -0.83177222   -0.78404566    0.00513316   -0.01605257    0.00673345    0.00407677
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   15
   -420.53930859
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O   -1.95740261   -1.29872151    0.02994835    0.01638536    0.00293951   -0.00171292
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C    0.30012365    1.51247455   -0.04266965   -0.01585500   -0.03518124    0.00844307
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C    1.67874946    1.25967937    0.00629484   -0.02470734   -0.00305921    0.00442607
C    1.68380510   -1.18483043   -0.01533321   -0.00310654    0.01294712   -0.00160084
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   15
   -420.53996010
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C    1.67549265    1.26093209    0.00734200   -0.02709618    0.00191668    0.00416263
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   15
   -420.54044878
H   -2.65273967    0.54353186    0.06151698   -0.01185586   -0.00604990    0.00143529
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O   -1.96047608   -1.29130244    0.03174560    0.01269939    0.00544662   -0.00166613
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C   -0.82617906   -0.79640649    0.00116345   -0.00945199   -0.01270942    0.00488156
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C    1.67264448    1.26215600    0.00832629   -0.02860788    0.00672443    0.00385782
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   15
   -420.54061506
H   -2.64791340    0.55211221    0.06127709   -0.00673752    0.00007791    0.00111802
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O   -1.96224018   -1.28767868    0.03267275    0.01021602    0.00646159   -0.00159477
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C    0.29664080    1.50790434   -0.04453750   -0.02046160   -0.04252889    0.00833584
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C    1.67022788    1.26327892    0.00925225   -0.02933640    0.01098491    0.00355523
C    1.68540820   -1.19218150   -0.01679734   -0.01725307    0.00984642   -0.00264416
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H    2.32150535    2.12690745   -0.07709381    0.00232674   -0.00574505   -0.00472136
H    2.35862358   -2.04601587   -0.05026694   -0.00445703   -0.00022461   -0.00135547
C    2.33248254    0.05706226    0.07609295    0.00850452    0.00981275    0.00396279
H    3.41013716   -0.07202576    0.14299422   -0.00122610   -0.01562023    0.00110340
   15
   -420.54030706
H   -2.64189277    0.56066336    0.06083618   -0.00035485    0.00724229    0.00077851
O   -1.97493629    1.28071662    0.03366213    0.00951904   -0.00801780    0.00395855
O   -1.96411991   -1.28412805    0.03361797    0.00746195    0.00732719   -0.00149198
C   -0.77758762    0.71516272   -0.03734221    0.01793788    0.04742760   -0.01140517
C   -0.82168197   -0.80385445   -0.00184484   -0.00178131   -0.02393724    0.00517264
C    0.29607240    1.50763674   -0.04541555   -0.02097196   -0.04215012    0.00795676
C    0.38974263   -1.57753341   -0.06443907    0.01867267    0.00990109   -0.00509460
C    1.66825408    1.26423685    0.01012442   -0.02944961    0.01434680    0.00328222
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H    2.37861014   -2.04190504   -0.04411254    0.00050382   -0.00188745   -0.00106114
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   15
   -420.53953062
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O   -1.97618250    1.27946644    0.03584110   -0.00023080   -0.01474910    0.00477366
O   -1.96608419   -1.28066041    0.03458008    0.00457872    0.00805714   -0.00136124
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C   -0.81936283   -0.80707712   -0.00346528    0.00255509   -0.02876529    0.00523704
C    0.29582012    1.50800520   -0.04641385   -0.02074159   -0.04072659    0.00750503
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C    1.66672498    1.26497937    0.01094691   -0.02909209    0.01647149    0.00305734
C    1.68765174   -1.19784641   -0.01758175   -0.02650499    0.00979225   -0.00334839
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H    2.39850943   -2.03746043   -0.03776797    0.00525673   -0.00316305   -0.00071188
C    2.33037774    0.04945941    0.07434760    0.01194180   -0.00257924    0.00388471
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   15
   -420.53857481
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O   -1.96810041   -1.27728406    0.03555762    0.00171175    0.00865174   -0.00120058
C   -0.77105701    0.71731696   -0.04644857    0.02861729    0.05584480   -0.01325797
C   -0.81708239   -0.80986564   -0.00516486    0.00695088   -0.03296537    0.00525166
C    0.29588031    1.50898855   -0.04752558   -0.01960966   -0.03858091    0.00701171
C    0.39115288   -1.57136971   -0.06177059    0.01538494    0.02087751   -0.00370102
C    1.66563531    1.26547465    0.01172310   -0.02838589    0.01712138    0.00288882
C    1.68934049   -1.20090090   -0.01790071   -0.02973699    0.00941822   -0.00371519
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   15
   -420.53770725
H   -2.62792221    0.57360686    0.05887548    0.01442593    0.02350051    0.00011665
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O   -1.97013615   -1.27400585    0.03654877   -0.00101747    0.00917095   -0.00102301
C   -0.76840248    0.71715635   -0.05070783    0.03213398    0.05749443   -0.01399679
C   -0.81490687   -0.81215657   -0.00694377    0.01117770   -0.03647826    0.00521033
C    0.29623587    1.51055478   -0.04874334   -0.01752139   -0.03606703    0.00652878
C    0.39149571   -1.56872069   -0.06034711    0.01316450    0.02535410   -0.00299610
C    1.66497450    1.26571290    0.01245562   -0.02738059    0.01623050    0.00274596
C    1.69147723   -1.20409723   -0.01816350   -0.03161773    0.00857467   -0.00407578
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H    2.43474649   -2.02678092   -0.02476784    0.01274752   -0.00362969    0.00010653
C    2.32756803    0.04200770    0.07236816    0.01198038   -0.01403056    0.00363782
H    3.39978605   -0.06903687    0.15678750   -0.00516721   -0.01446398    0.00107353
   15
   -420.53723497
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O   -1.97216058   -1.27083158    0.03755152   -0.00348456    0.00960323   -0.00082625
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C   -0.81289987   -0.81389686   -0.00880142    0.01501834   -0.03924263    0.00512055
C    0.29685517    1.51266622   -0.05005981   -0.01445757   -0.03346635    0.00606592
C    0.39163987   -1.56645405   -0.05887833    0.01067137    0.02900942   -0.00229320
C    1.66472727    1.26570751    0.01314662   -0.02604202    0.01389426    0.00260598
C    1.69409014   -1.20742251   -0.01836470   -0.03194938    0.00716761   -0.00441153
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H    2.44974311   -2.02046482   -0.01825885    0.01500161   -0.00261625    0.00052920
C    2.32588969    0.03855745    0.07129498    0.01046312   -0.01905276    0.00339590
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   15
   -420.53717419
H   -2.62961426    0.56322884    0.05738934    0.00984233    0.01905580    0.00011816
O   -1.98035637    1.27651922    0.04394107   -0.01573668   -0.01502060    0.00698593
O   -1.97414579   -1.26776621    0.03856363   -0.00561554    0.00997726   -0.00061380
C   -0.76457952    0.71423662   -0.05858253    0.03523890    0.05528749   -0.01512747
C   -0.81111929   -0.81504479   -0.01073644    0.01830650   -0.04120346    0.00498111
C    0.29769202    1.51528371   -0.05146796   -0.01049714   -0.03089727    0.00560590
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C    1.66487344    1.26549357    0.01379827   -0.02432991    0.01035550    0.00243172
C    1.69718414   -1.21085542   -0.01849924   -0.03063858    0.00517114   -0.00470475
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H    2.46205594   -2.01368954   -0.01184475    0.01607084   -0.00077141    0.00092553
C    2.32405431    0.03539457    0.07017054    0.00798323   -0.02347233    0.00307687
H    3.39960870   -0.05158756    0.16252318   -0.00360114   -0.01234467    0.00124558
   15
   -420.53733264
H   -2.63341569    0.55259770    0.05661662    0.00374881    0.01266372    0.00013315
O   -1.98097657    1.27630029    0.04578077   -0.01216024   -0.00704580    0.00737744
O   -1.97606765   -1.26481397    0.03958268   -0.00735952    0.01029751   -0.00039276
C   -0.76345810    0.71151084   -0.06218085    0.03488733    0.05144144   -0.01553426
C   -0.80961464   -0.81557074   -0.01274669    0.02089815   -0.04231679    0.00478749
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C    0.39148460   -1.56327515   -0.05584728    0.00535296    0.03363833   -0.00090965
C    1.66538685    1.26512401    0.01441323   -0.02211628    0.00603229    0.00219827
C    1.70073941   -1.21436586   -0.01856273   -0.02768834    0.00262530   -0.00493519
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H    0.26427053   -2.64282611   -0.04775025    0.00955231    0.00136365    0.00163442
H    2.22541064    2.19986589   -0.00329707   -0.00925639    0.00605089   -0.00337409
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C    2.32209917    0.03258578    0.06899966    0.00471824   -0.02724277    0.00269271
H    3.40057986   -0.03942711    0.16506345   -0.00197434   -0.01091516    0.00141166
   15
   -420.53752064
H   -2.63788211    0.53969902    0.05582042   -0.00303194    0.00534156    0.00009888
O   -1.98145970    1.27616031    0.04753677   -0.00759767    0.00203990    0.00779137
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C   -0.80842501   -0.81545799   -0.01482927    0.02272091   -0.04252511    0.00454253
C    0.29976876    1.52188139   -0.05453139   -0.00068161   -0.02561907    0.00462068
C    0.39126535   -1.56243299   -0.05430590    0.00276906    0.03464338   -0.00023628
C    1.66623398    1.26466369    0.01499503   -0.01933901    0.00134584    0.00189439
C    1.70471148   -1.21791543   -0.01855170   -0.02322182   -0.00037581   -0.00508721
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H    2.47808143   -2.00022200    0.00042415    0.01460537    0.00504214    0.00154165
C    2.32007331    0.03018810    0.06778813    0.00092919   -0.03035063    0.00226092
H    3.40190218   -0.02530484    0.16734930   -0.00004276   -0.00924293    0.00159964
   15
   -420.53755432
H   -2.64181220    0.52583355    0.05500752   -0.00916560   -0.00167011   -0.00001359
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O   -1.97964672   -1.25926276    0.04163143   -0.00967744    0.01078373    0.00008629
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C   -0.80757793   -0.81470341   -0.01698046    0.02373189   -0.04180139    0.00423892
C    0.30086098    1.52578129   -0.05617169    0.00458227   -0.02254217    0.00404301
C    0.39100401   -1.56211362   -0.05276094    0.00039008    0.03480364    0.00042215
C    1.66737277    1.26418293    0.01554828   -0.01595252   -0.00328410    0.00152477
C    1.70903310   -1.22145897   -0.01846386   -0.01748043   -0.00366880   -0.00514653
H   -0.07699465    2.54921215   -0.07162028   -0.01371063   -0.00523769   -0.00098675
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H    2.48205467   -1.99457079    0.00616846    0.01230611    0.00862497    0.00172777
C    2.31803363    0.02824849    0.06654246   -0.00306567   -0.03278405    0.00180264
H    3.40323155   -0.00952171    0.16934714    0.00193828   -0.00735651    0.00179095
   15
   -420.53750954
H   -2.64411346    0.51224998    0.05419795   -0.01381077   -0.00746584   -0.00019457
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O   -1.98127757   -1.25666936    0.04265571   -0.01032344    0.01096762    0.00033289
C   -0.76314413    0.69903937   -0.07155015    0.02743015    0.03020227   -0.01615256
C   -0.80708872   -0.81331798   -0.01919567    0.02395819   -0.04010724    0.00387381
C    0.30188417    1.53002133   -0.05787302    0.00963436   -0.01889826    0.00338398
C    0.39073643   -1.56231958   -0.05122235   -0.00168666    0.03421657    0.00106651
C    1.66875204    1.26375125    0.01607853   -0.01197685   -0.00748326    0.00110919
C    1.71361790   -1.22494701   -0.01829833   -0.01084511   -0.00699271   -0.00511594
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H    0.24364039   -2.63800452   -0.05248431    0.00774200    0.00261051    0.00045467
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H    2.48382284   -1.99047305    0.01160292    0.00931936    0.01225838    0.00182479
C    2.31604013    0.02680368    0.06526954   -0.00696130   -0.03453340    0.00135227
H    3.40421480    0.00758314    0.17102267    0.00372503   -0.00530836    0.00196347
   15
   -420.53745997
H   -2.64395622    0.49998711    0.05342428   -0.01651788   -0.01165882   -0.00043816
O   -1.98257290    1.27521655    0.05225360    0.00199568    0.02472333    0.00919746
O   -1.98279155   -1.25420034    0.04367621   -0.01070560    0.01111951    0.00058247
C   -0.76393137    0.69380720   -0.07418767    0.02328262    0.02055074   -0.01614492
C   -0.80696084   -0.81132734   -0.02146937    0.02343028   -0.03742958    0.00344582
C    0.30276239    1.53454629   -0.05962543    0.01412213   -0.01457201    0.00264595
C    0.39049393   -1.56304204   -0.04969986   -0.00338647    0.03296587    0.00169655
C    1.67031176    1.26343183    0.01659203   -0.00748186   -0.01097104    0.00067720
C    1.71836626   -1.22832972   -0.01805554   -0.00384533   -0.00999579   -0.00500564
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H    0.23380532   -2.63724980   -0.05432147    0.00679647    0.00275414    0.00006105
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H    2.48391757   -1.98857698    0.01670990    0.00606480    0.01553126    0.00184745
C    2.31415133    0.02588015    0.06397613   -0.01046287   -0.03558011    0.00093594
H    3.40453304    0.02564180    0.17234515    0.00510419   -0.00312833    0.00209302
   15
   -420.53761429
H   -2.64085378    0.48979680    0.05272941   -0.01718930   -0.01407891   -0.00071001
O   -1.98295213    1.27444234    0.05362451    0.00253520    0.02898155    0.00964623
O   -1.98418426   -1.25185739    0.04469009   -0.01090150    0.01121193    0.00083958
C   -0.76506991    0.68826535   -0.07658122    0.01854024    0.01003737   -0.01602032
C   -0.80718643   -0.80877197   -0.02379508    0.02223685   -0.03377241    0.00295091
C    0.30342809    1.53929068   -0.06141775    0.01778117   -0.00951437    0.00184210
C    0.39030210   -1.56426225   -0.04820300   -0.00464576    0.03115643    0.00231547
C    1.67198410    1.26327717    0.01709526   -0.00258119   -0.01355393    0.00026345
C    1.72317303   -1.23156221   -0.01773713    0.00293460   -0.01225733   -0.00484036
H   -0.10537347    2.56390905   -0.04254609   -0.01843328    0.00182955    0.00030120
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H    2.20131121    2.22926880    0.06760027   -0.01150234    0.01607116   -0.00082622
H    2.48291696   -1.98946494    0.02148495    0.00305329    0.01797193    0.00182335
C    2.31241997    0.02549371    0.06266849   -0.01336290   -0.03590524    0.00056908
H    3.40394093    0.04426291    0.17329174    0.00588599   -0.00088540    0.00214985
   15
   -420.53798830
H   -2.63468677    0.48211632    0.05216252   -0.01582235   -0.01476514   -0.00100277
O   -1.98335892    1.27334130    0.05488605    0.00173654    0.03127947    0.01004759
O   -1.98545343   -1.24964159    0.04569444   -0.01096953    0.01127328    0.00110144
C   -0.76648827    0.68257244   -0.07873270    0.01338068   -0.00105968   -0.01577518
C   -0.80774751   -0.80570712   -0.02616533    0.02045535   -0.02917836    0.00238983
C    0.30382621    1.54417808   -0.06323787    0.02040422   -0.00377074    0.00099261
C    0.39017990   -1.56595289   -0.04674112   -0.00541792    0.02885001    0.00292034
C    1.67369519    1.26332621    0.01759447    0.00256833   -0.01512529   -0.00010260
C    1.72793641   -1.23461075   -0.01734557    0.00890689   -0.01337255   -0.00465668
H   -0.10848951    2.56865317   -0.03285085   -0.01872369    0.00298047    0.00080465
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   15
   -420.53859885
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O   -1.98659824   -1.24755362    0.04668629   -0.01096868    0.01128947    0.00136392
C   -0.76810863    0.67689593   -0.08064579    0.00797036   -0.01245717   -0.01541137
C   -0.80861730   -0.80220218   -0.02857163    0.01819165   -0.02371466    0.00176343
C    0.30391722    1.54912181   -0.06507297    0.02187713    0.00253049    0.00012097
C    0.39013920   -1.56807925   -0.04532336   -0.00577034    0.02613869    0.00351154
C    1.67536734    1.26360270    0.01809511    0.00778717   -0.01567534   -0.00038487
C    1.73256667   -1.23745889   -0.01688357    0.01362377   -0.01304013   -0.00449132
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H    2.47963707   -2.00109424    0.03005593   -0.00038697    0.01867154    0.00178935
C    2.30959300    0.02634030    0.06003138   -0.01676552   -0.03431483    0.00008226
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   15
   -420.53931062
H   -2.61446612    0.47447154    0.05162287   -0.00773299   -0.01106428   -0.00157644
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O   -1.98761866   -1.24559364    0.04766267   -0.01093378    0.01126406    0.00163154
C   -0.76984942    0.67140777   -0.08232601    0.00249609   -0.02385821   -0.01493294
C   -0.80976167   -0.79833959   -0.03100453    0.01554258   -0.01751046    0.00107866
C    0.30367893    1.55402686   -0.06690988    0.02215235    0.00920052   -0.00075137
C    0.39018523   -1.57060040   -0.04395867   -0.00568441    0.02306241    0.00408449
C    1.67692191    1.26411509    0.01860147    0.01286071   -0.01530618   -0.00057900
C    1.73699267   -1.24011166   -0.01635361    0.01691546   -0.01121065   -0.00436916
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H    2.47797046   -2.01195542    0.03385699   -0.00034163    0.01651037    0.00184614
C    2.30854861    0.02754931    0.05870926   -0.01714363   -0.03238673   -0.00002191
H    3.39592688    0.09951056    0.17384720    0.00406342    0.00541420    0.00182395
   15
   -420.53989241
H   -2.60186036    0.47384359    0.05175303   -0.00154922   -0.00692668   -0.00182753
O   -1.98458826    1.26792501    0.05797334   -0.00723609    0.02670513    0.01076238
O   -1.98851507   -1.24376141    0.04862056   -0.01087638    0.01120543    0.00189711
C   -0.77162813    0.66628001   -0.08378058   -0.00283729   -0.03497072   -0.01435370
C   -0.81114071   -0.79421295   -0.03345365    0.01259541   -0.01073117    0.00034118
C    0.30310714    1.55879266   -0.06873544    0.02126995    0.01598164   -0.00159928
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C    1.67828246    1.26485803    0.01911648    0.01754821   -0.01421056   -0.00068933
C    1.74116454   -1.24259649   -0.01575752    0.01887407   -0.00808127   -0.00430004
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H    2.21895252    2.20585083    0.12763661   -0.01371867    0.00883904    0.00123276
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C    2.30776239    0.02924711    0.05738740   -0.01666850   -0.02972012   -0.00005125
H    3.39153987    0.11646257    0.17333603    0.00217354    0.00714496    0.00154944
   15
   -420.54011138
H   -2.58898654    0.47444663    0.05221186    0.00538163   -0.00169662   -0.00204426
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O   -1.98928814   -1.24205625    0.04955693   -0.01079106    0.01109327    0.00216682
C   -0.77336435    0.66168025   -0.08501822   -0.00782607   -0.04547289   -0.01370099
C   -0.81270992   -0.78992450   -0.03590790    0.00942687   -0.00357784   -0.00042944
C    0.30221497    1.56331705   -0.07053688    0.01935879    0.02255879   -0.00241181
C    0.39052687   -1.57663657   -0.04142290   -0.00447144    0.01602293    0.00515954
C    1.67937842    1.26581529    0.01964185    0.02158888   -0.01265790   -0.00074090
C    1.74505229   -1.24496014   -0.01509638    0.01983301   -0.00410004   -0.00426002
H   -0.08880275    2.58253165    0.00365818   -0.01293136   -0.00029820    0.00239014
H    0.15685602   -2.64147127   -0.06325659   -0.00135936    0.00007654   -0.00196529
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H    2.47458378   -2.04187030    0.04043781    0.00254107    0.00802223    0.00214069
C    2.30722734    0.03139342    0.05606619   -0.01547601   -0.02633082    0.00000572
H    3.38676594    0.13213212    0.17254580   -0.00010296    0.00864160    0.00122535
   15
   -420.53988235
H   -2.57708154    0.47535000    0.05303826    0.01226761    0.00390872   -0.00221967
O   -1.98505765    1.26277276    0.05942621   -0.01569140    0.01621324    0.01076177
O   -1.98993883   -1.24047695    0.05046876   -0.01066153    0.01094665    0.00242745
C   -0.77498294    0.65776689   -0.08604883   -0.01225033   -0.05504149   -0.01298726
C   -0.81442137   -0.78558205   -0.03835564    0.00606674    0.00369017   -0.00121879
C    0.30103114    1.56750111   -0.07230188    0.01660619    0.02852441   -0.00319145
C    0.39080421   -1.58004539   -0.04026808   -0.00345441    0.01218650    0.00565751
C    1.68014908    1.26696374    0.02017841    0.02470128   -0.01096071   -0.00078056
C    1.74864085   -1.24726216   -0.01437083    0.02022569    0.00016157   -0.00422244
H   -0.07714912    2.58546628    0.01186042   -0.01023875   -0.00240685    0.00261654
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H    2.24216480    2.18290409    0.15666901   -0.01302108    0.00304543    0.00205624
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C    2.30692567    0.03393706    0.05474485   -0.01374656   -0.02227929    0.00010855
H    3.38201277    0.14625140    0.17153497   -0.00257047    0.00984421    0.00086352
   15
   -420.53926671
H   -2.56736988    0.47555895    0.05426366    0.01807642    0.00889200   -0.00235002
O   -1.98504980    1.25988896    0.05996939   -0.01883189    0.01080714    0.01063921
O   -1.99046863   -1.23902177    0.05135305   -0.01046710    0.01071865    0.00268878
C   -0.77641726    0.65468422   -0.08688311   -0.01590121   -0.06334818   -0.01225575
C   -0.81622437   -0.78129520   -0.04078497    0.00258247    0.01081098   -0.00201091
C    0.29959696    1.57125520   -0.07401863    0.01325358    0.03342645   -0.00395965
C    0.39113359   -1.58363819   -0.03919874   -0.00227573    0.00815356    0.00610372
C    1.68054772    1.26827810    0.02072683    0.02661507   -0.00941556   -0.00086903
C    1.75192379   -1.24956628   -0.01358147    0.02047992    0.00412790   -0.00415175
H   -0.06365414    2.58883297    0.01959569   -0.00740312   -0.00442293    0.00274420
H    0.13033283   -2.64413812   -0.06400803   -0.00419142   -0.00090079   -0.00240079
H    2.25732972    2.17034665    0.17066637   -0.01166131    0.00068473    0.00254664
H    2.46931647   -2.07743207    0.04547435    0.00632096   -0.00267884    0.00249889
C    2.30683155    0.03681685    0.05342183   -0.01173853   -0.01764645    0.00024758
H    3.37771987    0.15860204    0.17036824   -0.00491842    0.01078344    0.00051477
   15
   -420.53842059
H   -2.56088455    0.47419522    0.05591177    0.02183139    0.01206848   -0.00243785
O   -1.98483010    1.25688144    0.06039195   -0.02010319    0.00673267    0.01044978
O   -1.99087979   -1.23768822    0.05220686   -0.01018672    0.01044932    0.00294333
C   -0.77761225    0.65255745   -0.08753208   -0.01861679   -0.07007298   -0.01153397
C   -0.81806617   -0.77717140   -0.04318390   -0.00101970    0.01752781   -0.00278743
C    0.29796279    1.57450574   -0.07567551    0.00956429    0.03679841   -0.00473949
C    0.39149729   -1.58735411   -0.03822163   -0.00099412    0.00400715    0.00649670
C    1.68054567    1.26973526    0.02128852    0.02713526   -0.00821830   -0.00107302
C    1.75489685   -1.25193182   -0.01272942    0.02092969    0.00730153   -0.00401388
H   -0.04882538    2.59298991    0.02683729   -0.00462218   -0.00595967    0.00287903
H    0.11807943   -2.64526763   -0.06375463   -0.00545765   -0.00107774   -0.00256083
H    2.27458233    2.15765572    0.18420325   -0.00946696   -0.00099791    0.00315607
H    2.46514627   -2.09497855    0.04733441    0.00755310   -0.00750031    0.00261296
C    2.30691490    0.03996289    0.05209506   -0.00971341   -0.01255063    0.00039123
H    3.37430662    0.16901529    0.16910832   -0.00689055    0.01145903    0.00020339
   15
   -420.53765495
H   -2.55828871    0.47069752    0.05799793    0.02276203    0.01262650   -0.00246432
O   -1.98438462    1.25379550    0.06069604   -0.01892604    0.00487418    0.01019020
O   -1.99117547   -1.23647314    0.05302729   -0.00982607    0.01010016    0.00319205
C   -0.77852704    0.65148788   -0.08800662   -0.02028651   -0.07492085   -0.01084248
C   -0.81989252   -0.77331179   -0.04554072   -0.00466023    0.02355185   -0.00353256
C    0.29618413    1.57720226   -0.07726065    0.00577010    0.03823859   -0.00557935
C    0.39187596   -1.59113055   -0.03734267    0.00035423   -0.00017800    0.00682993
C    1.68013516    1.27131719    0.02186662    0.02616754   -0.00741203   -0.00143420
C    1.75755298   -1.25440637   -0.01181678    0.02178266    0.00931549   -0.00378308
H   -0.03316164    2.59820687    0.03356013   -0.00205666   -0.00661550    0.00304799
H    0.10680578   -2.64620680   -0.06304100   -0.00652421   -0.00102161   -0.00267037
H    2.29352727    2.14513366    0.19716929   -0.00642981   -0.00195053    0.00392225
H    2.45962689   -2.11118770    0.04872525    0.00801621   -0.01143358    0.00265069
C    2.30714543    0.04329828    0.05076244   -0.00793372   -0.00712331    0.00050166
H    3.37212406    0.17736856    0.16781076   -0.00821107    0.01192319   -0.00003001
   15
   -420.53707432
H   -2.55974681    0.46496658    0.06052716    0.02072273    0.01039397   -0.00241430
O   -1.98372679    1.25065209    0.06088463   -0.01519990    0.00538534    0.00984453
O   -1.99135977   -1.23537254    0.05381151   -0.00940045    0.00969025    0.00343367
C   -0.77913640    0.65154854   -0.08831716   -0.02088301   -0.07766179   -0.01019909
C   -0.82164844   -0.76980714   -0.04784418   -0.00827996    0.02865396   -0.00424116
C    0.29431815    1.57932324   -0.07876134    0.00202052    0.03751513   -0.00649166
C    0.39224927   -1.59490433   -0.03656691    0.00170184   -0.00432529    0.00709568
C    1.67933079    1.27301155    0.02246660    0.02375890   -0.00689181   -0.00195465
C    1.75987911   -1.25702005   -0.01084707    0.02315327    0.00991934   -0.00344643
H   -0.01712283    2.60459897    0.03973310    0.00015609   -0.00618067    0.00329862
H    0.09670552   -2.64696540   -0.06184688   -0.00744278   -0.00072344   -0.00274642
H    2.31361910    2.13295307    0.20942712   -0.00264728   -0.00226580    0.00484000
H    2.45267704   -2.12535569    0.04964014    0.00759020   -0.01420868    0.00259764
C    2.30749645    0.04674120    0.04942231   -0.00658242   -0.00154120    0.00055105
H    3.37140803    0.18357825    0.16651747   -0.00871602    0.01219048   -0.00017144
   15
   -420.53665428
H   -2.56489806    0.45739537    0.06348927    0.01617647    0.00596228   -0.00224408
O   -1.98289842    1.24744587    0.06096165   -0.00938786    0.00770662    0.00939736
O   -1.99143748   -1.23438179    0.05455679   -0.00894716    0.00923739    0.00366688
C   -0.77943126    0.65278064   -0.08847344   -0.02046227   -0.07812630   -0.00960319
C   -0.82327935   -0.76673435   -0.05008357   -0.01178232    0.03264760   -0.00490870
C    0.29242134    1.58087957   -0.08016373   -0.00154471    0.03463802   -0.00751994
C    0.39259690   -1.59861286   -0.03589833    0.00301328   -0.00833667    0.00728715
C    1.67816869    1.27481017    0.02309629    0.02011538   -0.00641319   -0.00260067
C    1.76185450   -1.25978187   -0.00982540    0.02507552    0.00901924   -0.00299637
H   -0.00110702    2.61208690    0.04531063    0.00202868   -0.00457705    0.00365512
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H    2.33418015    2.12117482    0.22081217    0.00166331   -0.00219656    0.00586432
H    2.44437382   -2.13698474    0.05008872    0.00627471   -0.01567637    0.00244728
C    2.30794764    0.05020742    0.04807394   -0.00575639    0.00403726    0.00052426
H    3.37224797    0.18759588    0.16525353   -0.00832455    0.01227590   -0.00020552
   15
   -420.53627569
H   -2.57293878    0.44876740    0.06685301    0.01003835    0.00039544   -0.00193437
O   -1.98196472    1.24415155    0.06093216   -0.00231201    0.01077102    0.00883468
O   -1.99141367   -1.23349579    0.05526048   -0.00851986    0.00874415    0.00389582
C   -0.77941782    0.65519117   -0.08848447   -0.01915743   -0.07626360   -0.00905162
C   -0.82473239   -0.76415370   -0.05224878   -0.01505154    0.03541371   -0.00553713
C    0.29054772    1.58191456   -0.08145235   -0.00496586    0.02981933   -0.00861797
C    0.39289910   -1.60219568   -0.03533986    0.00424078   -0.01209806    0.00740645
C    1.67670363    1.27670546    0.02376538    0.01551603   -0.00569147   -0.00330314
C    1.76345014   -1.26267823   -0.00875854    0.02751192    0.00660547   -0.00243692
H    0.01454819    2.62038557    0.05022838    0.00357419   -0.00201696    0.00410934
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H    2.35443963    2.10978975    0.23114111    0.00615643   -0.00198935    0.00691704
H    2.43495329   -2.14581116    0.05009829    0.00411354   -0.01578250    0.00219836
C    2.30848648    0.05361280    0.04671774   -0.00542963    0.00945770    0.00041685
H    3.37457420    0.18940602    0.16402511   -0.00708557    0.01218399   -0.00013644
   15
   -420.53575680
H   -2.58277896    0.44006825    0.07056335    0.00332301   -0.00517471   -0.00151399
O   -1.98100511    1.24073543    0.06080257    0.00512108    0.01345960    0.00814859
O   -1.99129314   -1.23270895    0.05591999   -0.00817872    0.00823278    0.00412272
C   -0.77911556    0.65875200   -0.08835860   -0.01715973   -0.07210914   -0.00853376
C   -0.82595827   -0.76210694   -0.05433032   -0.01797772    0.03689320   -0.00613105
C    0.28874899    1.58250049   -0.08261064   -0.00823939    0.02352486   -0.00974286
C    0.39313732   -1.60559601   -0.03489327    0.00535248   -0.01549756    0.00744696
C    1.67500466    1.27868616    0.02448432    0.01034832   -0.00444286   -0.00395990
C    1.76462927   -1.26567272   -0.00765497    0.03038661    0.00275986   -0.00177431
H    0.02956245    2.62903793    0.05440478    0.00489189    0.00117009    0.00463353
H    0.07489795   -2.64886400   -0.05529058   -0.00896525    0.00116234   -0.00270093
H    2.37359301    2.09876514    0.24022570    0.01050499   -0.00194340    0.00790231
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C    2.30910788    0.05687555    0.04535535   -0.00547948    0.01457423    0.00022566
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   15
   -420.53509011
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   15
   -420.53432226
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   15
   -420.53359752
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   15
   -420.53308628
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O   -1.98988969   -1.23043935    0.05806393   -0.00888036    0.00635596    0.00508942
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   15
   -420.53289183
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O   -1.98929859   -1.23006474    0.05846270   -0.00970734    0.00596788    0.00536003
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C    0.39286302   -1.61835953   -0.03431978    0.00852564   -0.02319859    0.00651370
C    1.66572600    1.28880208    0.02908338   -0.01245548    0.01325814   -0.00412270
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   15
   -420.53310761
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O   -1.98859717   -1.22975785    0.05880066   -0.01075956    0.00561522    0.00563899
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C    1.66419908    1.29049197    0.03020784   -0.01484802    0.01857650   -0.00331552
C    1.76049539   -1.28152706   -0.00088507    0.04221563   -0.02958922    0.00281992
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C    2.31456773    0.06962758    0.03724653   -0.00166645    0.03418177   -0.00134753
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   15
   -420.53362607
H   -2.61921086    0.43342001    0.09879775   -0.01217066   -0.00539552    0.00158821
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O   -1.98777356   -1.22951471    0.05907465   -0.01196235    0.00531114    0.00591934
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C    1.66289557    1.29190089    0.03138217   -0.01636427    0.02395443   -0.00229607
C    1.75764521   -1.28303408    0.00015859    0.03990850   -0.03147277    0.00337567
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C    2.31568209    0.07015293    0.03594359    0.00093278    0.03515534   -0.00157386
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   15
   -420.53429946
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O   -1.98681421   -1.22933181    0.05928150   -0.01322833    0.00503827    0.00618964
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C    1.66183858    1.29294791    0.03259105   -0.01714890    0.02904324   -0.00114727
C    1.75419375   -1.28406749    0.00115133    0.03584402   -0.03154119    0.00382810
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   15
   -420.53492857
H   -2.60910676    0.44704596    0.10523699   -0.00205903    0.00836018    0.00138218
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O   -1.98570484   -1.22920611    0.05941816   -0.01445209    0.00481200    0.00643917
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C    1.66104027    1.29355671    0.03381725   -0.01745498    0.03337897    0.00001743
C    1.75020217   -1.28462578    0.00208631    0.03026147   -0.03014816    0.00419297
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C    2.31781951    0.06960700    0.03341216    0.00754402    0.03509909   -0.00199194
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   15
   -420.53543539
H   -2.60300499    0.45225677    0.10806872    0.00371979    0.01573097    0.00109837
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O   -1.98443168   -1.22913503    0.05948180   -0.01552612    0.00462515    0.00665794
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C   -0.82008783   -0.76835121   -0.06866032   -0.01651786    0.00807137   -0.01150852
C    0.28473391    1.58532235   -0.08428660   -0.02841437   -0.01960123   -0.01140730
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C    1.66050568    1.29366233    0.03504333   -0.01761310    0.03646576    0.00107778
C    1.74575437   -1.28472936    0.00295797    0.02359413   -0.02784380    0.00449186
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C    2.31874308    0.06853646    0.03219005    0.01116351    0.03415713   -0.00221135
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   15
   -420.53586290
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O   -1.98298260   -1.22911650    0.05946997   -0.01636494    0.00452162    0.00682076
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C    0.28643505    1.58680399   -0.08340697   -0.02735126   -0.01817208   -0.01054795
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C    1.66023769    1.29321877    0.03625338   -0.01797339    0.03779818    0.00192310
C    1.74095051   -1.28441231    0.00376176    0.01635936   -0.02523795    0.00474493
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C    2.31949799    0.06695012    0.03100144    0.01465532    0.03269072   -0.00246247
H    3.40320003    0.08127709    0.14298141    0.00138213   -0.00195786    0.00038830
   15
   -420.53645307
H   -2.59358501    0.45316775    0.11318856    0.01072301    0.02515085    0.00069242
O   -1.98650577    1.19629107    0.05439442    0.00663811   -0.05316325    0.00331023
O   -1.98134820   -1.22914925    0.05938079   -0.01687093    0.00445790    0.00693597
C   -0.76643578    0.74575592   -0.07905975    0.00817134    0.04787119   -0.00263969
C   -0.81519918   -0.77296783   -0.06968885   -0.01134694    0.00019379   -0.01227353
C    0.28854862    1.58856011   -0.08236786   -0.02538925   -0.01653069   -0.00969254
C    0.38723359   -1.62308215   -0.03736185    0.00752317   -0.00761458    0.00257309
C    1.66024197    1.29220631    0.03743469   -0.01875047    0.03701891    0.00250253
C    1.73589939   -1.28371343    0.00449386    0.00904664   -0.02284374    0.00496187
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H    2.37776513    2.06670732    0.22984291    0.00321527   -0.01904245    0.00396716
H    2.41905120   -2.14837538    0.03799204    0.00202650   -0.01080579   -0.00066989
C    2.32003180    0.06487005    0.02985010    0.01774105    0.03077305   -0.00275441
H    3.40107645    0.06827905    0.14040177   -0.00045985   -0.00314221    0.00023072
   15
   -420.53729810
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   15
   -420.53839917
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   15
   -420.53951216
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   15
   -420.54039776
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   15
   -420.54088922
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   15
   -420.54085276
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   15
   -420.54042508
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   15
   -420.53971544
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   15
   -420.53890809
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   15
   -420.53809958
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   15
   -420.53739153
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C    1.68105696    1.26396921    0.04685029   -0.00178506   -0.02557012    0.01026673
C    1.68663145   -1.25425666    0.00712428   -0.00957560   -0.02361153    0.00552684
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H    2.43356001   -2.01770792    0.04157745   -0.00291880    0.01799211   -0.00126186
C    2.30729500    0.02116238    0.02136081    0.00141405   -0.01214341   -0.00711009
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   15
   -420.53676134
H   -2.52525281    0.29726520    0.10938558   -0.00317092   -0.01224185    0.00325691
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C    0.32428755    1.62527438   -0.06145124    0.02929230    0.01154829   -0.00184258
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C    1.68333428   -1.24940706    0.00684647   -0.00843082   -0.01893793    0.00520846
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H    2.42970422   -2.01014202    0.04305423   -0.00397059    0.01971581   -0.00117607
C    2.30512762    0.01681470    0.02113647   -0.00106296   -0.01825496   -0.00713717
H    3.39643421   -0.01511310    0.10465750    0.00503396   -0.00420668    0.00126735
   15
   -420.53621446
H   -2.50809561    0.29373760    0.10462247    0.00264473   -0.00952328    0.00255659
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O   -1.94635961   -1.23439946    0.05159174    0.00240814    0.00489006    0.00408885
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C   -0.77848403   -0.78764320   -0.05803377    0.01142375   -0.02338232   -0.00995907
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   15
   -420.53565826
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   15
   -420.53507541
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   15
   -420.53453342
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O   -1.93720269   -1.23693684    0.04842373    0.00709185    0.00487233    0.00340143
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   15
   -420.53419510
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   15
   -420.53426157
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   15
   -420.53482174
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H    2.40627704   -2.03578388    0.05632857    0.01032057   -0.00290515    0.00145268
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   15
   -420.53585422
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   15
   -420.53712671
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   15
   -420.53836611
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   15
   -420.53934036
H   -2.48980062    0.27976072    0.04786837    0.01148335   -0.00916302   -0.00021869
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C   -0.76548694   -0.76511963   -0.03156965    0.01053757   -0.00199958   -0.00377874
C    0.32092117    1.63396219   -0.03719440    0.00354348    0.02768607    0.00196880
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C    1.65877831   -1.20761136    0.00074793   -0.01299350    0.06008909   -0.00207280
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C    2.28608194    0.00443827    0.02499988   -0.00875624   -0.04409017   -0.00316674
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   15
   -420.53985193
H   -2.50714994    0.28008431    0.04233062    0.00592981   -0.01268136   -0.00019362
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C   -0.76519755   -0.76206380   -0.02845074    0.01008322    0.00052007   -0.00316394
C    0.31932004    1.63119038   -0.03502099    0.00034277    0.01974090    0.00270809
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C    2.28501315    0.00755997    0.02578068   -0.00928135   -0.03858385   -0.00257817
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   15
   -420.53995045
H   -2.52556808    0.28267996    0.03682843    0.00045274   -0.01544449   -0.00021766
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O   -1.91574808   -1.24728905    0.03708712    0.01681641    0.00241032    0.00168844
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C   -0.76506091   -0.75901568   -0.02528396    0.00987176    0.00291323   -0.00256709
C    0.31771364    1.62811981   -0.03288847   -0.00281150    0.01205050    0.00340422
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   15
   -420.53970152
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   15
   -420.53925856
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C   -0.76523705   -0.75308452   -0.01884271    0.01021206    0.00715500   -0.00141785
C    0.31467448    1.62153363   -0.02878634   -0.00882080   -0.00066733    0.00445381
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   15
   -420.53879730
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O   -1.91169289   -1.25137553    0.03289242    0.01552672    0.00145596    0.00119994
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C   -0.76555484   -0.75026556   -0.01558562    0.01069106    0.00895198   -0.00086686
C    0.31333247    1.61820948   -0.02683254   -0.01155464   -0.00508914    0.00475049
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   15
   -420.53838055
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O   -1.91070294   -1.25277550    0.03146444    0.01458252    0.00114307    0.00101663
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C   -0.76603438   -0.74758166   -0.01231540    0.01128256    0.01049754   -0.00033014
C    0.31216488    1.61496045   -0.02495038   -0.01402540   -0.00801227    0.00488162
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C    2.28179910    0.02971484    0.03006882   -0.00732279    0.00092552    0.00088944
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   15
   -420.53803390
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O   -1.90987831   -1.25418840    0.03002494    0.01353889    0.00079463    0.00081959
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C    0.35386334   -1.61618447   -0.04408331    0.00502049   -0.01586224   -0.00277043
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C    2.28154143    0.03461519    0.03092971   -0.00569329    0.00933906    0.00160673
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   15
   -420.53766080
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C    0.31049660    1.60884240   -0.02140648   -0.01784588   -0.00956163    0.00468416
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C    1.69961894    1.27726169    0.01187297   -0.00999039    0.00776384    0.00527439
C    1.65442083   -1.22895812   -0.00247024   -0.00652810    0.00997326   -0.00417774
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   15
   -420.53707464
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O   -1.90867805   -1.25703722    0.02712057    0.01157296    0.00006444    0.00037423
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C   -0.76853347   -0.74055187   -0.00250603    0.01291582    0.01338926    0.00119325
C    0.31005350    1.60599741   -0.01974180   -0.01904152   -0.00865632    0.00441149
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H    0.15392006    2.67732225   -0.10761300    0.01251296    0.00031614   -0.00316754
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C    2.28125435    0.04387336    0.03256818   -0.00170004    0.02468943    0.00296476
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   15
   -420.53622598
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O   -1.90828031   -1.25846482    0.02566073    0.01087088   -0.00031020    0.00013754
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C   -0.76974725   -0.73859782    0.00073773    0.01309373    0.01376806    0.00167481
C    0.30989758    1.60328268   -0.01814374   -0.01964109   -0.00721869    0.00408792
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C    1.70108348    1.28190853    0.00457856    0.00051770    0.02156067    0.00191294
C    1.65413893   -1.23771930   -0.00272776   -0.01468958    0.00536484   -0.00489214
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C    2.28116495    0.04799952    0.03332525    0.00033960    0.03126590    0.00358925
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   15
   -420.53524097
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O   -1.90800616   -1.25988889    0.02419934    0.01047218   -0.00067047   -0.00010372
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C    0.31003778    1.60067721   -0.01660746   -0.01955468   -0.00585709    0.00375917
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   15
   -420.53445348
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O   -1.90785112   -1.26130539    0.02273912    0.01041719   -0.00096582   -0.00034255
C   -0.75692543    0.73691838   -0.00158102    0.01262232    0.00679359   -0.00206781
C   -0.77276550   -0.73531500    0.00714230    0.01246337    0.01376717    0.00259028
C    0.31047267    1.59816116   -0.01512809   -0.01868588   -0.00519158    0.00347820
C    0.34985582   -1.60396139   -0.04065853    0.00288162   -0.00431256   -0.00120156
C    1.70252191    1.28527869   -0.00283400    0.00991741    0.02985965   -0.00097135
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   15
   -420.53425617
H   -2.63904366    0.44281471   -0.01770185    0.00501356    0.02629733   -0.00068810
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O   -1.90781458   -1.26271104    0.02128278    0.01073233   -0.00115061   -0.00057514
C   -0.75801278    0.73833590    0.00187826    0.01064529    0.01062134   -0.00152304
C   -0.77456035   -0.73398631    0.01028926    0.01157535    0.01346696    0.00301921
C    0.31118903    1.59572511   -0.01370139   -0.01696801   -0.00571980    0.00326364
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C    1.70305016    1.28631440   -0.00652881    0.01171981    0.03003149   -0.00213577
C    1.65554662   -1.25143518   -0.00255418   -0.02647273    0.00098703   -0.00527224
H    0.13714850    2.64741086   -0.08204273    0.01280088   -0.01313275   -0.00129150
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H    2.51072081    1.96545766   -0.03973226    0.00076192   -0.03850539    0.00051240
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C    2.28076778    0.05722099    0.03523670    0.00410482    0.04522514    0.00519776
H    3.36318230    0.00975882    0.00710013   -0.00311038   -0.00198185   -0.00224653
   15
   -420.53491573
H   -2.64496314    0.44891065   -0.02189386    0.00370893    0.02591964   -0.00080407
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O   -1.90790012   -1.26410363    0.01983296    0.01141798   -0.00131585   -0.00079311
C   -0.75926083    0.73959333    0.00536056    0.00842213    0.01404856   -0.00097006
C   -0.77652975   -0.73286109    0.01339061    0.01028993    0.01304358    0.00342471
C    0.31216081    1.59337728   -0.01232412   -0.01436319   -0.00764144    0.00311468
C    0.34787170   -1.59834652   -0.03912659   -0.00021017    0.00028924   -0.00056290
C    1.70340433    1.28689987   -0.01019153    0.01100206    0.02708230   -0.00313876
C    1.65674484   -1.25606943   -0.00233776   -0.02855246   -0.00153943   -0.00511842
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   15
   -420.53621127
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O   -1.90811543   -1.26548156    0.01839210    0.01241928   -0.00136883   -0.00099205
C   -0.76063593    0.74063889    0.00885751    0.00596941    0.01700776   -0.00040862
C   -0.77865442   -0.73193295    0.01644022    0.00865886    0.01253282    0.00380229
C    0.31334875    1.59114645   -0.01099398   -0.01093282   -0.01077408    0.00298884
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C    1.70359479    1.28707930   -0.01380692    0.00816996    0.02132138   -0.00403731
C    1.65837315   -1.26067935   -0.00204412   -0.02930446   -0.00492945   -0.00483086
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   15
   -420.53778349
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O   -1.90847186   -1.26684402    0.01696249    0.01368212   -0.00136885   -0.00117007
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C   -0.78090967   -0.73119426    0.01943238    0.00672403    0.01199122    0.00414942
C    0.31470111    1.58907944   -0.00970903   -0.00679296   -0.01465553    0.00284607
C    0.34590576   -1.59274356   -0.03756003   -0.00440297    0.00383700   -0.00003169
C    1.70366317    1.28693879   -0.01736133    0.00416668    0.01356579   -0.00489703
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H    0.10093590    2.64585665   -0.06003293    0.00702428   -0.00581270   -0.00076879
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   15
   -420.53915990
H   -2.66336994    0.44235441   -0.03339869   -0.01214467    0.01028120   -0.00178475
O   -2.00983059    1.17952265   -0.00481538    0.01124125   -0.04160186    0.00043316
O   -1.90898365   -1.26819093    0.01554612    0.01512312   -0.00135069   -0.00132646
C   -0.76361663    0.74192507    0.01586137    0.00058294    0.02109868    0.00072666
C   -0.78326633   -0.73063689    0.02236184    0.00456043    0.01146174    0.00446372
C    0.31615561    1.58723413   -0.00846705   -0.00216563   -0.01862732    0.00264791
C    0.34500625   -1.59001627   -0.03677407   -0.00680706    0.00521860    0.00017690
C    1.70366867    1.28659434   -0.02084168    0.00005978    0.00488209   -0.00576662
C    1.66294372   -1.26960789   -0.00124408   -0.02654731   -0.01429879   -0.00394963
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H    2.47819220    2.05457937   -0.03728398    0.01404141   -0.01124220    0.00083401
H    2.36611018   -2.13079951    0.00658217    0.00667795   -0.01326381    0.00187547
C    2.27953062    0.05997157    0.03666306   -0.00117840    0.04886376    0.00667977
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   15
   -420.54005773
H   -2.66658096    0.43498217   -0.03668189   -0.01753565    0.00418828   -0.00216093
O   -2.00725663    1.18146509   -0.00697603    0.01910377   -0.03580419    0.00046271
O   -1.90966706   -1.26952252    0.01414478    0.01664194   -0.00133423   -0.00146236
C   -0.76514082    0.74210392    0.01935112   -0.00227319    0.02211659    0.00129741
C   -0.78569178   -0.73025287    0.02522387    0.00225454    0.01098616    0.00474497
C    0.31764253    1.58566982   -0.00726502    0.00269914   -0.02204539    0.00236435
C    0.34420979   -1.58736763   -0.03599073   -0.00930216    0.00639178    0.00034499
C    1.70367226    1.28617590   -0.02423481   -0.00325544   -0.00366178   -0.00666810
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H    0.06988610    2.65089450   -0.04463092    0.00118027    0.00332756   -0.00032897
H    0.04098102   -2.62688309   -0.12987466   -0.00294335    0.00161252   -0.00235281
H    2.46567821    2.08586148   -0.03702140    0.01756354   -0.00154968    0.00094463
H    2.37255476   -2.12546926   -0.00027345    0.00589772   -0.01037716    0.00155456
C    2.27918926    0.05880851    0.03677948   -0.00402977    0.04702230    0.00692914
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   15
   -420.54045429
H   -2.66665797    0.42684049   -0.03957702   -0.02135953   -0.00085803   -0.00247224
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O   -1.91053922   -1.27083895    0.01276001    0.01812612   -0.00135755   -0.00158079
C   -0.76663060    0.74194926    0.02282125   -0.00515359    0.02239867    0.00186981
C   -0.78815125   -0.73003508    0.02801418   -0.00011245    0.01060846    0.00499609
C    0.31908866    1.58443758   -0.00609868    0.00754006   -0.02437593    0.00199309
C    0.34355413   -1.58481554   -0.03521254   -0.01183098    0.00746095    0.00048354
C    1.70372343    1.28581155   -0.02752708   -0.00523117   -0.01117968   -0.00760418
C    1.66909301   -1.27765816   -0.00020622   -0.01849470   -0.02632163   -0.00285932
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H    2.37794991   -2.11828514   -0.00740908    0.00422310   -0.00646912    0.00124553
C    2.27890905    0.05693585    0.03679120   -0.00706058    0.04406210    0.00712974
H    3.36479139    0.03199800    0.00584991   -0.00161378   -0.00035973   -0.00226087
   15
   -420.54053168
H   -2.66291868    0.41883288   -0.04202857   -0.02319552   -0.00450495   -0.00268214
O   -2.00282423    1.18650981   -0.01131277    0.02942976   -0.02600240    0.00035875
O   -1.91161686   -1.27213990    0.01139315    0.01947437   -0.00146985   -0.00168587
C   -0.76804252    0.74145683    0.02626310   -0.00800031    0.02195486    0.00244489
C   -0.79060904   -0.72997782    0.03072901   -0.00245209    0.01035184    0.00521485
C    0.32042112    1.58357212   -0.00496236    0.01210197   -0.02523640    0.00153037
C    0.34307724   -1.58237618   -0.03444165   -0.01424505    0.00845977    0.00061091
C    1.70385182    1.28561417   -0.03070435   -0.00566289   -0.01704429   -0.00856242
C    1.67262022   -1.28113313    0.00038176   -0.01301822   -0.03266262   -0.00231448
H    0.03797344    2.65367739   -0.02901243   -0.00450649    0.01010012    0.00041386
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H    2.43086911    2.14768222   -0.03703562    0.01988405    0.01514876    0.00128016
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C    2.27873546    0.05439830    0.03669518   -0.01000460    0.04000485    0.00727789
H    3.36706516    0.03632125    0.00708432   -0.00020103    0.00016692   -0.00219475
   15
   -420.54045706
H   -2.65503443    0.41161487   -0.04399885   -0.02290873   -0.00666245   -0.00277702
O   -2.00108243    1.18950130   -0.01348763    0.03134404   -0.02244595    0.00017129
O   -1.91291516   -1.27342415    0.01004542    0.02056961   -0.00164993   -0.00178390
C   -0.76933361    0.74063330    0.02966799   -0.01073921    0.02081379    0.00302216
C   -0.79302989   -0.73007729    0.03336501   -0.00468195    0.01025546    0.00540911
C    0.32157130    1.58308615   -0.00384909    0.01616405   -0.02443255    0.00100207
C    0.34281549   -1.58006472   -0.03367996   -0.01646357    0.00945386    0.00071657
C    1.70406385    1.28567207   -0.03375216   -0.00451139   -0.02087980   -0.00952573
C    1.67634373   -1.28411472    0.00100476   -0.00712578   -0.03861603   -0.00179566
H    0.02298230    2.65262516   -0.02127910   -0.00686863    0.01160411    0.00086800
H    0.05197722   -2.61899319   -0.15031882   -0.00087440    0.00275103   -0.00283502
H    2.40815966    2.17522920   -0.03737234    0.01841298    0.02115385    0.00147142
H    2.38690674   -2.10128214   -0.02230604   -0.00080192    0.00301375    0.00075186
C    2.27871276    0.05125718    0.03648918   -0.01263537    0.03488442    0.00737592
H    3.36937655    0.04061334    0.00871328    0.00111422    0.00076543   -0.00209263
   15
   -420.54041409
H   -2.64305576    0.40557506   -0.04547091   -0.02056575   -0.00734937   -0.00274646
O   -1.99969422    1.19274824   -0.01566434    0.03111576   -0.01982813   -0.00012374
O   -1.91444648   -1.27468959    0.00871792    0.02133306   -0.00194345   -0.00188099
C   -0.77046255    0.73949588    0.03302717   -0.01329465    0.01902280    0.00360257
C   -0.79538018   -0.73033203    0.03591926   -0.00672764    0.01033610    0.00558545
C    0.32247804    1.58296747   -0.00275093    0.01953205   -0.02191524    0.00043723
C    0.34280228   -1.57789624   -0.03292916   -0.01837599    0.01047567    0.00081875
C    1.70434239    1.28604291   -0.03665596   -0.00193359   -0.02244912   -0.01047411
C    1.68017516   -1.28651367    0.00165493   -0.00139795   -0.04357276   -0.00129604
H    0.00922122    2.64950579   -0.01370224   -0.00872941    0.01163508    0.00134653
H    0.05611588   -2.61729059   -0.15614963   -0.00032535    0.00268745   -0.00299198
H    2.38215974    2.19899541   -0.03797385    0.01528582    0.02521557    0.00165582
H    2.39136119   -2.09315393   -0.02997855   -0.00330362    0.00750147    0.00057200
C    2.27888051    0.04758981    0.03617172   -0.01477226    0.02877790    0.00742134
H    3.37149131    0.04476684    0.01071838    0.00217269    0.00141876   -0.00195080
   15
   -420.54048520
H   -2.62740227    0.40083878   -0.04645045   -0.01638037   -0.00663238   -0.00258787
O   -1.99865720    1.19622093   -0.01783956    0.02894483   -0.01809126   -0.00052324
O   -1.91621943   -1.27593287    0.00741177    0.02169694   -0.00236157   -0.00198255
C   -0.77139081    0.73807154    0.03633188   -0.01557786    0.01665096    0.00418654
C   -0.79762904   -0.73074327    0.03838909   -0.00852785    0.01060239    0.00574730
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C    0.34306646   -1.57588622   -0.03219086   -0.01988789    0.01151955    0.00090935
C    1.70464863    1.28675028   -0.03940144    0.00191651   -0.02163859   -0.01138916
C    1.68402871   -1.28825575    0.00232471    0.00354068   -0.04691572   -0.00079072
H   -0.00297668    2.64431287   -0.00636779   -0.01001419    0.01020628    0.00182778
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H    2.35342951    2.21825214   -0.03887315    0.01068192    0.02716218    0.00181997
H    2.39640033   -2.08636151   -0.03775413   -0.00510507    0.01099602    0.00039903
C    2.27927088    0.04348838    0.03574211   -0.01630051    0.02180263    0.00741353
H    3.37322056    0.04866436    0.01307407    0.00285150    0.00210555   -0.00176803
   15
   -420.54052593
H   -2.60882370    0.39728057   -0.04696569   -0.01064149   -0.00472586   -0.00232451
O   -1.99794700    1.19989965   -0.02000876    0.02512297   -0.01715112   -0.00102797
O   -1.91823809   -1.27714931    0.00612811    0.02161775   -0.00288240   -0.00209508
C   -0.77208402    0.73639604    0.03957329   -0.01748424    0.01378501    0.00477186
C   -0.79974928   -0.73131503    0.04077202   -0.01004750    0.01105121    0.00590524
C    0.32337055    1.58365559   -0.00056580    0.02363417   -0.01213652   -0.00068151
C    0.34363079   -1.57405029   -0.03146629   -0.02093005    0.01253476    0.00099063
C    1.70492461    1.28778188   -0.04197478    0.00684014   -0.01840726   -0.01225209
C    1.68783034   -1.28929108    0.00300636    0.00716234   -0.04811853   -0.00023007
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H    2.32279472    2.23265069   -0.04009965    0.00480346    0.02688495    0.00195327
H    2.40234157   -2.08152642   -0.04560088   -0.00573090    0.01297559    0.00017962
C    2.27990690    0.03905817    0.03520048   -0.01717184    0.01411573    0.00735151
H    3.37444276    0.05218276    0.01574750    0.00308995    0.00279256   -0.00154615
   15
   -420.54041854
H   -2.58834488    0.39456025   -0.04706359   -0.00386464   -0.00190864   -0.00198179
O   -1.99752067    1.20377343   -0.02216621    0.02008339   -0.01672673   -0.00162271
O   -1.92050155   -1.27833295    0.00486822    0.02107854   -0.00351459   -0.00221935
C   -0.77251350    0.73451259    0.04274255   -0.01889084    0.01052929    0.00535844
C   -0.80171796   -0.73205407    0.04306565   -0.01125950    0.01166329    0.00606285
C    0.32329449    1.58431512    0.00053800    0.02421464   -0.00534815   -0.00117825
C    0.34451092   -1.57240378   -0.03075667   -0.02144224    0.01347266    0.00105557
C    1.70509614    1.28908890   -0.04436295    0.01260729   -0.01279211   -0.01304580
C    1.69152562   -1.28960184    0.00369137    0.00917005   -0.04692409    0.00043756
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H    2.29130991    2.24224234   -0.04167729   -0.00210445    0.02432519    0.00205087
H    2.40929348   -2.07900168   -0.05347832   -0.00492049    0.01317489   -0.00014475
C    2.28080176    0.03441515    0.03454776   -0.01739283    0.00592191    0.00723925
H    3.37511577    0.05519893    0.01869875    0.00285342    0.00344747   -0.00128841
   15
   -420.53992890
H   -2.56717600    0.39217711   -0.04680558    0.00330198    0.00134076   -0.00158286
O   -1.99732156    1.20783708   -0.02430520    0.01440482   -0.01643695   -0.00228225
O   -1.92300372   -1.27947663    0.00363353    0.02010019   -0.00425276   -0.00235999
C   -0.77265808    0.73247025    0.04583080   -0.01968256    0.00701248    0.00594494
C   -0.80351677   -0.73296962    0.04526761   -0.01217333    0.01240871    0.00622710
C    0.32285349    1.58505458    0.00165952    0.02381464    0.00217189   -0.00160669
C    0.34571461   -1.57096074   -0.03006298   -0.02141860    0.01423989    0.00109711
C    1.70507641    1.29058668   -0.04655398    0.01889573   -0.00500304   -0.01375898
C    1.69508426   -1.28920587    0.00436959    0.00956673   -0.04346571    0.00124544
H   -0.02843661    2.62004588    0.01334778   -0.01021112   -0.00133598    0.00301871
H    0.07261931   -2.61459322   -0.17384156    0.00070753    0.00060846   -0.00352951
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H    2.41711164   -2.07882307   -0.06132762   -0.00275139    0.01162169   -0.00061043
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   15
   -420.53890747
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C   -0.80513189   -0.73407286    0.04737541   -0.01280330    0.01323565    0.00640388
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C    0.34724150   -1.56973273   -0.02938584   -0.02086310    0.01478160    0.00110274
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   15
   -420.53732559
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O   -1.92867532   -1.28160939    0.00124629    0.01698681   -0.00604387   -0.00268968
C   -0.77205667    0.72812277    0.05172876   -0.01889377   -0.00021435    0.00711696
C   -0.80655367   -0.73537626    0.04938635   -0.01320673    0.01409456    0.00659610
C    0.32091376    1.58632042    0.00398037    0.02052559    0.01675686   -0.00222090
C    0.34908323   -1.56872783   -0.02872531   -0.01981124    0.01502113    0.00105850
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C    1.70178450   -1.28652918    0.00565468    0.00712043   -0.03154825    0.00325410
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H    2.43362007   -2.08416500   -0.07657594    0.00417220    0.00497954   -0.00197573
C    2.28503190    0.02046222    0.03194373   -0.01499836   -0.01926175    0.00661598
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   15
   -420.53562455
H   -2.51186436    0.38169364   -0.04461698    0.01980638    0.00651781   -0.00042598
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O   -1.93180951   -1.28257820    0.00009748    0.01494730   -0.00707743   -0.00287837
C   -0.77132283    0.72592642    0.05452077   -0.01712835   -0.00356479    0.00770179
C   -0.80777606   -0.73689269    0.05129757   -0.01338734    0.01491026    0.00680069
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C    1.70292677    1.29493873   -0.05184317    0.03584291    0.02473709   -0.01536465
C    1.70496175   -1.28442702    0.00623128    0.00535627   -0.02441864    0.00435404
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H    2.18296566    2.24699612   -0.05176486   -0.03140410   -0.00158247    0.00217610
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C    2.28691712    0.01622574    0.03087089   -0.01357273   -0.02698169    0.00632155
H    3.37426692    0.06013163    0.03228510   -0.00159114    0.00498033   -0.00003520
   15
   -420.53403821
H   -2.49944896    0.37606970   -0.04364711    0.02192740    0.00480183   -0.00011449
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O   -1.93511304   -1.28346667   -0.00101868    0.01267092   -0.00818009   -0.00307284
C   -0.77033123    0.72378351    0.05719633   -0.01436273   -0.00653452    0.00828327
C   -0.80879628   -0.73863441    0.05310596   -0.01339449    0.01561215    0.00702007
C    0.31774186    1.58660256    0.00643425    0.01538867    0.02550853   -0.00258567
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C    1.70123030    1.29584550   -0.05315129    0.03858082    0.03270688   -0.01571969
C    1.70805762   -1.28195557    0.00674206    0.00390396   -0.01734814    0.00542234
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H    2.16688680    2.24563013   -0.05525874   -0.03597097   -0.00712740    0.00218586
H    2.44713354   -2.09303978   -0.09038749    0.01100011   -0.00260201   -0.00357027
C    2.28900747    0.01239632    0.02970252   -0.01207377   -0.03395816    0.00598589
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   15
   -420.53304691
H   -2.49095397    0.36960700   -0.04265554    0.02220847    0.00134031    0.00014630
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O   -1.93856012   -1.28426230   -0.00209995    0.01019360   -0.00934074   -0.00328276
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C   -0.80961425   -0.74061195    0.05480820   -0.01320418    0.01612977    0.00725180
C    0.31578685    1.58619452    0.00771856    0.01268274    0.02609895   -0.00272065
C    0.35630632   -1.56706217   -0.02683181   -0.01425720    0.01369084    0.00054578
C    1.69895358    1.29626175   -0.05422186    0.03879454    0.03737622   -0.01596766
C    1.71109370   -1.27922113    0.00717096    0.00308964   -0.01084318    0.00638972
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H    2.15724870    2.24550340   -0.05914591   -0.03811417   -0.00966400    0.00218187
H    2.45122037   -2.09711393   -0.09640168    0.01327227   -0.00556119   -0.00428544
C    2.29128042    0.00907921    0.02844370   -0.01062968   -0.04000218    0.00560897
H    3.37459980    0.05745300    0.03934978   -0.00402782    0.00471182    0.00064666
   15
   -420.53282858
H   -2.48643595    0.36292045   -0.04169002    0.02099800   -0.00327617    0.00037706
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O   -1.94212268   -1.28495196   -0.00314399    0.00754896   -0.01050530   -0.00350305
C   -0.76775605    0.71982912    0.06216313   -0.00612421   -0.01080184    0.00940996
C   -0.81023289   -0.74283306    0.05640077   -0.01278379    0.01640041    0.00749829
C    0.31363995    1.58539522    0.00904398    0.01006608    0.02393537   -0.00283327
C    0.35918686   -1.56693431   -0.02622143   -0.01186046    0.01261658    0.00024976
C    1.69609371    1.29611773   -0.05505117    0.03620604    0.03807010   -0.01607808
C    1.71408202   -1.27632162    0.00750345    0.00312297   -0.00525631    0.00720087
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H    2.15443233    2.24706317   -0.06342520   -0.03756608   -0.00853226    0.00213208
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C    2.29371427    0.00636563    0.02710012   -0.00934463   -0.04497994    0.00519021
H    3.37574764    0.05482451    0.04273825   -0.00474604    0.00428305    0.00099409
   15
   -420.53331788
H   -2.48568399    0.35682976   -0.04079295    0.01874180   -0.00828127    0.00059678
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O   -1.94577075   -1.28552245   -0.00414829    0.00475787   -0.01163965   -0.00372695
C   -0.76629663    0.71808195    0.06443735   -0.00098491   -0.01193394    0.00993895
C   -0.81065859   -0.74530176    0.05787996   -0.01208049    0.01636547    0.00775796
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C    0.36224652   -1.56699693   -0.02561475   -0.00932165    0.01132657   -0.00009709
C    1.69268964    1.29540263   -0.05563760    0.03093803    0.03505994   -0.01601703
C    1.71702200   -1.27334122    0.00772732    0.00407813   -0.00085035    0.00780852
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H    2.15834155    2.25010913   -0.06808707   -0.03446894   -0.00398718    0.00199290
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C    2.29628967    0.00433070    0.02567813   -0.00827428   -0.04879557    0.00472834
H    3.37774273    0.05142779    0.04594782   -0.00497768    0.00366572    0.00134364
   15
   -420.53427048
H   -2.48829724    0.35222622   -0.04000272    0.01585150   -0.01301352    0.00077901
O   -1.99757609    1.24422030   -0.03984492   -0.00439691    0.02594415   -0.00757114
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C   -0.76482273    0.71651435    0.06656135    0.00449119   -0.01236835    0.01042585
C   -0.81090206   -0.74801750    0.05924184   -0.01102292    0.01599960    0.00802786
C    0.30892754    1.58278803    0.01182444    0.00502566    0.01305433   -0.00294472
C    0.36544706   -1.56723065   -0.02500656   -0.00671858    0.00991539   -0.00047750
C    1.68882046    1.29416064   -0.05598212    0.02346457    0.02940477   -0.01575470
C    1.71989923   -1.27034632    0.00783341    0.00593893    0.00219941    0.00818409
H   -0.02932521    2.61202037    0.03986281   -0.00612634   -0.00570920    0.00416446
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H    2.16842605    2.25383931   -0.07310640   -0.02931350    0.00288551    0.00174352
H    2.44859191   -2.10216477   -0.10943988    0.01332499   -0.00826698   -0.00548242
C    2.29899046    0.00303207    0.02418470   -0.00742507   -0.05140763    0.00422458
H    3.38062634    0.04737361    0.04891552   -0.00468610    0.00288077    0.00169801
   15
   -420.53535759
H   -2.49376019    0.34995435   -0.03935230    0.01266585   -0.01698161    0.00093294
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O   -1.95319513   -1.28625601   -0.00602734   -0.00124971   -0.01352924   -0.00420483
C   -0.76341680    0.71513294    0.06852778    0.01001316   -0.01213088    0.01086184
C   -0.81097935   -0.75097470    0.06048234   -0.00955431    0.01527961    0.00830532
C    0.30643837    1.58114279    0.01328110    0.00247271    0.00585604   -0.00289576
C    0.36874917   -1.56761425   -0.02439114   -0.00411010    0.00849231   -0.00087127
C    1.68459836    1.29247549   -0.05608868    0.01447216    0.02255304   -0.01529489
C    1.72268567   -1.26738292    0.00781604    0.00861969    0.00380606    0.00831245
H   -0.02448111    2.62070642    0.04000857   -0.00645435   -0.00020403    0.00420609
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H    2.18376836    2.25703766   -0.07843778   -0.02278956    0.01062931    0.00136566
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C    2.30180372    0.00250921    0.02262744   -0.00674803   -0.05279426    0.00368361
H    3.38434673    0.04280290    0.05157748   -0.00390485    0.00195310    0.00205673
   15
   -420.53635568
H   -2.50150376    0.35072431   -0.03886926    0.00947879   -0.01990269    0.00104883
O   -1.99728155    1.25203866   -0.04301917   -0.00369880    0.03662355   -0.00866512
O   -1.95690330   -1.28639776   -0.00689667   -0.00444421   -0.01416878   -0.00445275
C   -0.76216198    0.71393421    0.07033005    0.01529328   -0.01128993    0.01123556
C   -0.81091272   -0.75416252    0.06159726   -0.00764341    0.01421742    0.00858720
C    0.30391194    1.57940907    0.01478142   -0.00018381   -0.00140375   -0.00274961
C    0.37211348   -1.56812636   -0.02376254   -0.00154531    0.00716984   -0.00126001
C    1.68015840    1.29044915   -0.05596420    0.00469361    0.01583284   -0.01465868
C    1.72534098   -1.26447533    0.00767328    0.01195402    0.00397775    0.00820005
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H    2.43491981   -2.09844688   -0.11334056    0.00777663   -0.00448670   -0.00522730
C    2.30471910    0.00278310    0.02101452   -0.00614032   -0.05295887    0.00311116
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   15
   -420.53718998
H   -2.51095678    0.35506016   -0.03857448    0.00650316   -0.02163705    0.00112809
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O   -1.96056098   -1.28637902   -0.00771549   -0.00773309   -0.01454114   -0.00469871
C   -0.76113777    0.71290557    0.07196254    0.02006464   -0.00994157    0.01153966
C   -0.81073104   -0.75756490    0.06258236   -0.00530165    0.01282824    0.00886691
C    0.30138840    1.57769578    0.01632318   -0.00292948   -0.00801108   -0.00250111
C    0.37550125   -1.56874712   -0.02311490    0.00093665    0.00604842   -0.00162932
C    1.67564759    1.28818210   -0.05561825   -0.00519955    0.01017257   -0.01388397
C    1.72781506   -1.26162635    0.00740675    0.01568447    0.00287940    0.00787547
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H    0.11155996   -2.61136202   -0.17070167   -0.00092767    0.00303928   -0.00242689
H    2.22545136    2.25642137   -0.08974550   -0.00842368    0.02371260    0.00031827
H    2.42570640   -2.09518044   -0.11386354    0.00381022   -0.00125318   -0.00480714
C    2.30772725    0.00385625    0.01935459   -0.00547780   -0.05191703    0.00251600
H    3.39366902    0.03279951    0.05572650   -0.00128914   -0.00022796    0.00276383
   15
   -420.53792130
H   -2.52158655    0.36327270   -0.03848183    0.00393868   -0.02209009    0.00115339
O   -1.99681789    1.25822122   -0.04580155   -0.00334733    0.04042091   -0.00943095
O   -1.96413088   -1.28619561   -0.00848102   -0.01107478   -0.01461400   -0.00492682
C   -0.76041604    0.71202677    0.07342063    0.02409839   -0.00820880    0.01177002
C   -0.81046967   -0.76116087    0.06343339   -0.00257349    0.01113576    0.00914309
C    0.29890922    1.57610216    0.01790263   -0.00571632   -0.01340933   -0.00215077
C    0.37887500   -1.56945967   -0.02244264    0.00330692    0.00520464   -0.00196418
C    1.67121487    1.28575935   -0.05506250   -0.01466798    0.00606268   -0.01300960
C    1.73005201   -1.25881968    0.00702142    0.01942363    0.00081585    0.00737413
H   -0.00300829    2.64343046    0.03594309   -0.00556371    0.01253702    0.00388179
H    0.11535406   -2.61229118   -0.16711789   -0.00120550    0.00332194   -0.00225430
H    2.24922156    2.25027304   -0.09553431   -0.00167595    0.02752852   -0.00028074
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C    2.31081799    0.00571295    0.01765664   -0.00461799   -0.04969980    0.00190861
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   15
   -420.53869338
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C    1.66700286    1.28324282   -0.05431012   -0.02326044    0.00368949   -0.01208471
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   15
   -420.53955275
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O   -1.97085626   -1.28533469   -0.00984161   -0.01761547   -0.01387895   -0.00538018
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C   -0.80987659   -0.76882736    0.06471686    0.00361400    0.00698764    0.00964007
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C    1.66314101    1.28066843   -0.05337503   -0.03060509    0.00301354   -0.01115147
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C    2.31719014    0.01162591    0.01418337   -0.00189157   -0.04193931    0.00070270
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   15
   -420.54057676
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O   -1.97393772   -1.28466551   -0.01043160   -0.02062468   -0.01309529   -0.00556447
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C   -0.80963812   -0.77283526    0.06514180    0.00680716    0.00461430    0.00984641
C    0.29215524    1.57272614    0.02280806   -0.01362379   -0.01910167   -0.00066654
C    0.38856269   -1.57204551   -0.02023134    0.00967474    0.00461116   -0.00267532
C    1.65974004    1.27804660   -0.05227126   -0.03638557    0.00388024   -0.01026211
C    1.73482132   -1.25032663    0.00523260    0.02596686   -0.00540108    0.00566178
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   15
   -420.54162341
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O   -1.97678551   -1.28384799   -0.01095851   -0.02331438   -0.01207447   -0.00571692
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C   -0.80950239   -0.77691274    0.06541792    0.00985199    0.00209027    0.01001400
C    0.29026445    1.57216446    0.02447401   -0.01587955   -0.01713956   -0.00010823
C    0.39154048   -1.57304678   -0.01941748    0.01152023    0.00495103   -0.00282519
C    1.65688692    1.27536444   -0.05101225   -0.04029280    0.00612116   -0.00944043
C    1.73565505   -1.24736806    0.00445400    0.02517757   -0.00551629    0.00526417
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C    2.32366784    0.02005553    0.01066727    0.00255012   -0.03024955   -0.00042880
H    3.41663192    0.01230484    0.05645360    0.00409286   -0.00601106    0.00402791
   15
   -420.54243758
H   -2.58080667    0.45668756   -0.04088415    0.00308116   -0.00390206    0.00051787
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C   -0.76297050    0.70887296    0.07801170    0.02955653    0.00184198    0.01188390
C   -0.80951525   -0.78102169    0.06554271    0.01258081   -0.00054297    0.01012800
C    0.28861338    1.57185983    0.02614162   -0.01784136   -0.01347474    0.00043630
C    0.39434432   -1.57412308   -0.01856092    0.01320028    0.00542926   -0.00294790
C    1.65464045    1.27258835   -0.04961034   -0.04208295    0.00948284   -0.00874194
C    1.73611018   -1.24432788    0.00359567    0.02268391   -0.00414905    0.00498244
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C    2.32686655    0.02500245    0.00891471    0.00534265   -0.02316435   -0.00095186
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   15
   -420.54278538
H   -2.59363889    0.48124583   -0.04177754    0.00530620    0.00271772    0.00026934
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O   -1.98166346   -1.28181638   -0.01181667   -0.02728631   -0.00944666   -0.00588533
C   -0.76482956    0.70827609    0.07838772    0.02777864    0.00338703    0.01173368
C   -0.80971779   -0.78512237    0.06551444    0.01486020   -0.00323061    0.01018724
C    0.28723158    1.57175716    0.02780270   -0.01941567   -0.00847369    0.00094056
C    0.39694881   -1.57528155   -0.01765984    0.01469612    0.00594794   -0.00304610
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C    1.73622404   -1.24122653    0.00266191    0.01877184   -0.00148228    0.00477092
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H    2.36857932    2.11427863   -0.12600715    0.01436376    0.00466934   -0.00223215
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C    2.32998416    0.03029880    0.00717651    0.00837985   -0.01540493   -0.00144699
H    3.42172151    0.01024587    0.05193956    0.00357202   -0.00765844    0.00416221
   15
   -420.54243494
H   -2.60742540    0.50532225   -0.04271910    0.00741611    0.00885403    0.00001389
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O   -1.98364870   -1.28063211   -0.01214602   -0.02839101   -0.00787083   -0.00588906
C   -0.76710775    0.70762840    0.07858639    0.02523473    0.00462640    0.01153929
C   -0.81014430   -0.78917419    0.06533222    0.01655188   -0.00593130    0.01018235
C    0.28614281    1.57178189    0.02944962   -0.02053171   -0.00285413    0.00139702
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C    1.65204070    1.26654056   -0.04641793   -0.03890815    0.01810499   -0.00778956
C    1.73605523   -1.23810376    0.00165601    0.01390556    0.00202093    0.00455384
H    0.06764110    2.62720530    0.00476479    0.00723923   -0.00516630    0.00175826
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H    2.38003666    2.08156221   -0.12981358    0.01177421   -0.00512299   -0.00197686
H    2.38046603   -2.10172680   -0.09426650   -0.00777729    0.00089187   -0.00263201
C    2.33297503    0.03582739    0.00546015    0.01147005   -0.00709497   -0.00191095
H    3.42326707    0.01121328    0.04856317    0.00273722   -0.00819841    0.00414943
   15
   -420.54139601
H   -2.62253315    0.52782674   -0.04366265    0.00852509    0.01349481   -0.00024128
O   -1.99259047    1.26807511   -0.05262778   -0.01512070   -0.00486328   -0.00816271
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C   -0.76976671    0.70691115    0.07861063    0.02203847    0.00554181    0.01130309
C   -0.81082028   -0.79313638    0.06499611    0.01757377   -0.00859724    0.01012063
C    0.28536375    1.57184991    0.03107547   -0.02106627    0.00263382    0.00181079
C    0.40147262   -1.57787451   -0.01571822    0.01701250    0.00665316   -0.00322448
C    1.65163994    1.26314009   -0.04464181   -0.03436820    0.02211982   -0.00752540
C    1.73567661   -1.23501187    0.00058135    0.00865652    0.00578606    0.00425554
H    0.07547613    2.62213555   -0.00137364    0.00881924   -0.00975183    0.00154786
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H    2.38253320   -2.10767674   -0.08960824   -0.00490362   -0.00379597   -0.00269712
C    2.33579266    0.04146277    0.00377265    0.01439173    0.00160862   -0.00234135
H    3.42432323    0.01365345    0.04444041    0.00166381   -0.00851926    0.00409072
   15
   -420.53989425
H   -2.63914937    0.54793567   -0.04456322    0.00781688    0.01584708   -0.00046876
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C   -0.77275820    0.70611050    0.07846403    0.01828314    0.00613312    0.01102699
C   -0.81176110   -0.79696871    0.06450709    0.01787267   -0.01118332    0.00997590
C    0.28490237    1.57187933    0.03267395   -0.02090747    0.00712711    0.00221631
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C    1.65175745    1.25940686   -0.04275184   -0.02873216    0.02475670   -0.00732266
C    1.73516692   -1.23200709   -0.00055747    0.00354296    0.00926180    0.00381777
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H    2.38548387   -2.11294747   -0.08446565   -0.00208062   -0.00819739   -0.00266255
C    2.33839321    0.04707358    0.00212050    0.01688930    0.01051950   -0.00273425
H    3.42508102    0.01762391    0.03958174    0.00049930   -0.00860447    0.00399330
   15
   -420.53824394
H   -2.65714014    0.56522792   -0.04537989    0.00487006    0.01571274   -0.00065799
O   -1.99027145    1.26941040   -0.05333099   -0.01064645   -0.01090518   -0.00722365
O   -1.98766434   -1.27662488   -0.01273671   -0.02756566   -0.00222921   -0.00555223
C   -0.77602548    0.70521752    0.07815075    0.01403687    0.00640436    0.01071086
C   -0.81297125   -0.80063215    0.06386728    0.01743388   -0.01363523    0.00977088
C    0.28475615    1.57180294    0.03423889   -0.01998122    0.01001250    0.00265541
C    0.40497295   -1.58086470   -0.01358153    0.01824264    0.00636853   -0.00340908
C    1.65230928    1.25530225   -0.04075129   -0.02302358    0.02500234   -0.00704014
C    1.73460294   -1.22914148   -0.00175380   -0.00100514    0.01204163    0.00321855
H    0.08621164    2.61774883   -0.01444742    0.01035539   -0.01390945    0.00106726
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H    2.40445408    1.99616502   -0.13943488    0.00069693   -0.03278364   -0.00055310
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C    2.34073921    0.05252533    0.00050963    0.01870497    0.01942799   -0.00307645
H    3.42574783    0.02313997    0.03400449   -0.00059326   -0.00844611    0.00386571
   15
   -420.53676181
H   -2.67597824    0.57972231   -0.04607864   -0.00009760    0.01349888   -0.00080587
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O   -1.98836657   -1.27520876   -0.01280541   -0.02589936   -0.00006488   -0.00533074
C   -0.77950448    0.70422807    0.07767558    0.00937738    0.00637222    0.01035627
C   -0.81444413   -0.80408957    0.06307984    0.01627840   -0.01594241    0.00950029
C    0.28491113    1.57157740    0.03576363   -0.01829062    0.01101899    0.00316213
C    0.40631347   -1.58250585   -0.01243656    0.01839020    0.00573809   -0.00350745
C    1.65321046    1.25082357   -0.03864458   -0.01832720    0.02199248   -0.00653330
C    1.73405312   -1.22645678   -0.00299859   -0.00469490    0.01385993    0.00246132
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H    2.39209184   -2.11844732   -0.07277803    0.00215006   -0.01435275   -0.00219491
C    2.34280351    0.05768364   -0.00105480    0.01960697    0.02808550   -0.00335061
H    3.42651806    0.03017269    0.02773195   -0.00145515   -0.00803113    0.00370351
   15
   -420.53563955
H   -2.69478063    0.59180352   -0.04663290   -0.00628816    0.01008627   -0.00091680
O   -1.98750318    1.27120881   -0.05370647    0.00237039   -0.00886969   -0.00627344
O   -1.98877560   -1.27379203   -0.01281368   -0.02359212    0.00221669   -0.00505870
C   -0.78312483    0.70314264    0.07704385    0.00438162    0.00604617    0.00996856
C   -0.81616231   -0.80730614    0.06214882    0.01444813   -0.01807966    0.00917842
C    0.28534181    1.57118729    0.03724045   -0.01590524    0.01029968    0.00376941
C    0.40737633   -1.58423341   -0.01123858    0.01819943    0.00480147   -0.00359132
C    1.65439091    1.24601685   -0.03643952   -0.01537264    0.01534492   -0.00568486
C    1.73357305   -1.22398036   -0.00428043   -0.00732289    0.01460585    0.00157106
H    0.08963861    2.62284692   -0.02826203    0.00940012   -0.00943562    0.00017582
H    0.18902475   -2.64919138   -0.09749719   -0.00075873   -0.00073735   -0.00093584
H    2.41861414    1.96551078   -0.14515228   -0.00022941   -0.03960112   -0.00040894
H    2.39499278   -2.11757502   -0.06631754    0.00319398   -0.01558635   -0.00176253
C    2.34457268    0.06241792   -0.00256868    0.01942763    0.03623137   -0.00353505
H    3.42754507    0.03864762    0.02079316   -0.00195649   -0.00736855    0.00351392
   15
   -420.53490386
H   -2.71244803    0.60207152   -0.04702198   -0.01266687    0.00646224   -0.00100052
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   15
   -420.53443017
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   15
   -420.53406858
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C    0.28788981    1.56921105    0.04128552   -0.00620146    0.00382103    0.00598218
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C    1.65928930    1.23086936   -0.02938883   -0.01508685   -0.02115938   -0.00129005
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   15
   -420.53379611
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O   -1.98809334   -1.26864780   -0.01231129   -0.00953233    0.01178538   -0.00363672
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C   -0.82480670   -0.81716439    0.05709934    0.00196632   -0.02454763    0.00738814
C    0.28899523    1.56839099    0.04246828   -0.00280991    0.00240892    0.00669939
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C    2.34900299    0.07486180   -0.00809140    0.00853177    0.05825984   -0.00294304
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   15
   -420.53361523
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O   -1.98754269   -1.26762813   -0.01207192   -0.00533951    0.01402981   -0.00325313
C   -0.80061116    0.69659000    0.07175345   -0.02204197    0.00065745    0.00780126
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C    1.66367765    1.22203809   -0.02455037   -0.01467266   -0.04816768    0.00183519
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H    0.07349173    2.64860029   -0.06099920    0.00164392    0.01385141   -0.00351803
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H    2.40240013   -2.07551258   -0.03130660   -0.00311495   -0.00268647    0.00111698
C    2.34965534    0.07593271   -0.00935006    0.00445164    0.05987385   -0.00241856
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   15
   -420.53357745
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O   -1.98693150   -1.26676745   -0.01179565   -0.00113863    0.01611786   -0.00286940
C   -0.80342422    0.69516873    0.07031502   -0.02668585   -0.00096894    0.00738734
C   -0.82951364   -0.81995831    0.05387583   -0.00582946   -0.02635526    0.00631599
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C    1.66620767    1.21861363   -0.02216119   -0.01282687   -0.05926806    0.00304964
C    1.73313017   -1.21305357   -0.01193091   -0.00002122    0.00114876   -0.00435067
H    0.06820598    2.64925546   -0.06618505    0.00036322    0.01569573   -0.00409489
H    0.23717330   -2.66691336   -0.05110388    0.00339373    0.00113452   -0.00014125
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H    2.40407142   -2.06284176   -0.02449405   -0.00569643    0.00215879    0.00157745
C    2.35024014    0.07610073   -0.01057230    0.00056983    0.05952658   -0.00176352
H    3.43881103    0.11017240   -0.03245462    0.00257352    0.00108018    0.00153619
   15
   -420.53373742
H   -2.74721082    0.65095468   -0.04548041   -0.01674890    0.00647355   -0.00084174
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O   -1.98630726   -1.26608938   -0.01148681    0.00292412    0.01798213   -0.00249997
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C   -0.83176465   -0.82076388    0.05211675   -0.00965044   -0.02683082    0.00575926
C    0.29238292    1.56570035    0.04537539    0.00544124    0.00551394    0.00804452
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C    1.66893024    1.21608218   -0.01981776   -0.00984249   -0.06783217    0.00394447
C    1.73328393   -1.21156051   -0.01305843    0.00311818   -0.00125613   -0.00507728
H    0.06285177    2.64710888   -0.07063616   -0.00066380    0.01591377   -0.00450648
H    0.24376642   -2.67046332   -0.04316946    0.00394237    0.00070726   -0.00006224
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H    2.40676359   -2.05055457   -0.01796420   -0.00794564    0.00667071    0.00194694
C    2.35081564    0.07537127   -0.01176801   -0.00274120    0.05709548   -0.00100777
H    3.44021419    0.12315969   -0.04271182    0.00349793    0.00294652    0.00106080
   15
   -420.53411892
H   -2.73992981    0.65699648   -0.04462412   -0.01044438    0.01063962   -0.00074255
O   -1.98268709    1.28150404   -0.05273507    0.01844675   -0.01416961   -0.00368127
O   -1.98571592   -1.26561506   -0.01114960    0.00669335    0.01957311   -0.00215303
C   -0.80778059    0.69239641    0.06710880   -0.03411638   -0.00444804    0.00665329
C   -0.83387006   -0.82116418    0.05027058   -0.01321673   -0.02696950    0.00520049
C    0.29339762    1.56467442    0.04610816    0.00715398    0.00914528    0.00812399
C    0.40718363   -1.59895833    0.00033948    0.00747923   -0.00514534   -0.00331991
C    1.67180045    1.21457271   -0.01753355   -0.00588653   -0.07343229    0.00449426
C    1.73339131   -1.21005005   -0.01410933    0.00563936   -0.00233987   -0.00568732
H    0.05761176    2.64212071   -0.07427865   -0.00131339    0.01451859   -0.00473369
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H    2.41087510   -2.03945401   -0.01178360   -0.00939488    0.01022452    0.00223200
C    2.35143154    0.07378113   -0.01294855   -0.00519156    0.05253786   -0.00018712
H    3.44099257    0.13561625   -0.05315982    0.00407157    0.00480913    0.00056929
   15
   -420.53482104
H   -2.73078041    0.66111801   -0.04363431   -0.00339832    0.01520674   -0.00063499
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C   -0.80921196    0.69109786    0.06535209   -0.03659478   -0.00620100    0.00634834
C   -0.83577612   -0.82115717    0.04834578   -0.01639040   -0.02673474    0.00464648
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C    1.67475869    1.21416953   -0.01531689   -0.00115669   -0.07578199    0.00471500
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H    2.41666083   -2.03017317   -0.00600401   -0.00962043    0.01235634    0.00246093
C    2.35212471    0.07139915   -0.01412630   -0.00660953    0.04594354    0.00065774
H    3.44104407    0.14720775   -0.06371037    0.00420488    0.00662473    0.00007943
   15
   -420.53563728
H   -2.72101556    0.66251281   -0.04253025    0.00323540    0.01920959   -0.00051803
O   -1.98396976    1.28515598   -0.05202114    0.00580326   -0.02051762   -0.00357379
O   -1.98479756   -1.26534517   -0.01040539    0.01279216    0.02162188   -0.00156283
C   -0.81009119    0.68989294    0.06349933   -0.03810445   -0.00786541    0.00609269
C   -0.83743500   -0.82074643    0.04635072   -0.01904914   -0.02609275    0.00410160
C    0.29508816    1.56213348    0.04720771    0.00868179    0.01929735    0.00769103
C    0.40549715   -1.60219431    0.00376474    0.00422215   -0.00637697   -0.00302098
C    1.67773368    1.21490804   -0.01317107    0.00415463   -0.07475332    0.00460323
C    1.73333240   -1.20693996   -0.01594573    0.00725699    0.00093436   -0.00664276
H    0.04787211    2.62489298   -0.07901306   -0.00147653    0.00738684   -0.00459046
H    0.25896015   -2.68138025   -0.01934541    0.00516217   -0.00163369    0.00015281
H    2.37063119    2.09413149   -0.14465900    0.01880162    0.01007455   -0.00647491
H    2.42415783   -2.02309287   -0.00066711   -0.00843631    0.01282310    0.00266785
C    2.35291649    0.06832483   -0.01531396   -0.00693816    0.03749760    0.00148427
H    3.44034527    0.15760829   -0.07427555    0.00386098    0.00833891   -0.00039889
   15
   -420.53661279
H   -2.71180579    0.66046998   -0.04133322    0.00798235    0.02179712   -0.00037837
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O   -1.98453949   -1.26557289   -0.01000511    0.01486719    0.02202504   -0.00132689
C   -0.81039571    0.68880677    0.06155441   -0.03852176   -0.00938014    0.00588752
C   -0.83880657   -0.81994168    0.04429364   -0.02109845   -0.02501593    0.00356737
C    0.29574094    1.56046581    0.04758100    0.00849176    0.02507719    0.00722457
C    0.40454607   -1.60367201    0.00554703    0.00285745   -0.00696891   -0.00287680
C    1.68064532    1.21677273   -0.01109449    0.00986989   -0.07037820    0.00419760
C    1.73314196   -1.20538977   -0.01671672    0.00611603    0.00526055   -0.00704548
H    0.04340257    2.61392782   -0.08012967   -0.00105398    0.00229582   -0.00428675
H    0.26225173   -2.68464084   -0.01144070    0.00543949   -0.00252003    0.00024211
H    2.34456501    2.10970672   -0.13894641    0.01320612    0.01015650   -0.00587293
H    2.43315372   -2.01829762    0.00418937   -0.00590174    0.01169914    0.00288271
C    2.35381193    0.06468539   -0.01652401   -0.00623868    0.02753493    0.00225950
H    3.43895821    0.16650982   -0.08476988    0.00304190    0.00990225   -0.00084839
   15
   -420.53753593
H   -2.70399323    0.65454009   -0.04006845    0.00990659    0.02195245   -0.00020739
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O   -1.98444934   -1.26605008   -0.00958975    0.01617318    0.02196152   -0.00112619
C   -0.81011917    0.68786213    0.05952041   -0.03781679   -0.01066439    0.00573262
C   -0.83985999   -0.81875926    0.04218261   -0.02245988   -0.02347988    0.00304787
C    0.29626599    1.55841935    0.04784515    0.00776871    0.03055546    0.00666772
C    0.40355157   -1.60504424    0.00737283    0.00169914   -0.00765378   -0.00274425
C    1.68340748    1.21969768   -0.00908106    0.01579018   -0.06286010    0.00355699
C    1.73286027   -1.20392061   -0.01738121    0.00397727    0.01081899   -0.00741847
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H    0.26456554   -2.68744890   -0.00357966    0.00564394   -0.00329026    0.00034089
H    2.31613780    2.12347864   -0.13218008    0.00648430    0.00852117   -0.00501509
H    2.44319694   -2.01559097    0.00852657   -0.00232429    0.00936062    0.00311989
C    2.35480065    0.06063098   -0.01776812   -0.00467954    0.01646040    0.00294787
H    3.43702872    0.17363186   -0.09511224    0.00184709    0.01124511   -0.00125785
   15
   -420.53830425
H   -2.69791832    0.64469730   -0.03876687    0.00868015    0.01941988    0.00000172
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O   -1.98454190   -1.26677594   -0.00916158    0.01666774    0.02138304   -0.00096618
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   15
   -420.53874665
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   15
   -420.53876595
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   15
   -420.53844132
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C   -0.84064623   -0.81081524    0.03335214   -0.02063746   -0.01322738    0.00113081
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C    1.69124136    1.23921303   -0.00144125    0.03380337   -0.01532722    0.00054635
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H    2.48023113   -2.01612665    0.01981630    0.01246482   -0.00172541    0.00398526
C    2.35910093    0.04369047   -0.02327055    0.00537810   -0.02870465    0.00468652
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   15
   -420.53798249
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O   -1.98671193   -1.27195049   -0.00735170    0.01069612    0.01432825   -0.00059952
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C    1.69205468    1.24514524    0.00042237    0.03430621   -0.00478203    0.00028270
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   15
   -420.53758917
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C   -0.83911560   -0.80547412    0.02880584   -0.01581612   -0.00645349    0.00024140
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C    1.69235206    1.25115326    0.00228129    0.03250296    0.00296523    0.00034775
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   15
   -420.53744963
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   15
   -420.53753630
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O   -1.98964925   -1.27759676   -0.00591931   -0.00005686    0.00569212   -0.00040691
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   15
   -420.53769975
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O   -1.99068525   -1.27965312   -0.00543158   -0.00422095    0.00265637   -0.00032031
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C   -0.83516439   -0.79686397    0.02197556   -0.00545451    0.00386663   -0.00107060
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C    2.36255514    0.03256946   -0.03172746    0.01237231   -0.05660305    0.00520772
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   15
   -420.53781854
H   -2.62746541    0.51871510   -0.03198104   -0.00575859   -0.01431789    0.00135592
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O   -1.99167331   -1.28173971   -0.00494023   -0.00844234   -0.00029422   -0.00021698
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C    2.36273686    0.03270679   -0.03365191    0.01256321   -0.05660031    0.00517341
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   15
   -420.53780592
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C   -0.78234720    0.68845385    0.03155418    0.01756677   -0.00029552    0.00541099
C   -0.83202872   -0.79132625    0.01749199    0.00221211    0.00981199   -0.00194160
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C    1.68806954    1.27964383    0.01135835   -0.00002326    0.00955225    0.00287690
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H    2.46464885   -2.01280071    0.01300780    0.00335126    0.00810946    0.00266895
C    2.36272887    0.03369775   -0.03565449    0.01254232   -0.05484600    0.00507663
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   15
   -420.53760965
H   -2.59562383    0.51150462   -0.03284102    0.00539302   -0.00759815    0.00121776
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O   -1.99331565   -1.28587183   -0.00395160   -0.01645925   -0.00563213    0.00004994
C   -0.77967072    0.68912222    0.02850953    0.02203535    0.00221973    0.00529553
C   -0.83048188   -0.78875796    0.01529094    0.00591881    0.01227917   -0.00237181
C    0.29822726    1.50335181    0.04413081   -0.00641337   -0.03448687    0.00462648
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C    1.73134970   -1.21578972   -0.01609983    0.01146580    0.00826966   -0.00518179
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H    2.45576013   -2.01424353    0.00965046   -0.00046188    0.01118701    0.00227094
C    2.36253127    0.03551589   -0.03773368    0.01244525   -0.05146584    0.00487663
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   15
   -420.53734025
H   -2.58063198    0.51028853   -0.03360684    0.01151711   -0.00291494    0.00111746
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C   -0.77732648    0.68975716    0.02538484    0.02572764    0.00462558    0.00515548
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   15
   -420.53709017
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   15
   -420.53701818
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O   -1.99429405   -1.29153731   -0.00247806   -0.02538917   -0.01144926    0.00057757
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C   -0.82657889   -0.78228090    0.00892803    0.01502077    0.01704374   -0.00357965
C    0.29955788    1.49249831    0.04141964   -0.01155636   -0.04321897    0.00167094
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   15
   -420.53715904
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O   -1.99408400   -1.29319227   -0.00199720   -0.02710482   -0.01271542    0.00077475
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C   -0.82567637   -0.78061116    0.00690741    0.01701937    0.01768486   -0.00393359
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C    1.68362338    1.30410340    0.01941090   -0.02921583    0.02309549    0.00412233
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   15
   -420.53749888
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O   -1.99356715   -1.29470336   -0.00152512   -0.02808979   -0.01362129    0.00097294
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C   -0.82503041   -0.77920824    0.00494623    0.01837872    0.01785611   -0.00425132
C    0.30127146    1.48844893    0.03945979   -0.01386725   -0.04019819   -0.00046081
C    0.38726114   -1.59795298    0.04290680    0.00326394   -0.00911527    0.00020522
C    1.68378047    1.30819365    0.02084536   -0.03131691    0.02895192    0.00428696
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H    2.42108406   -2.05568394   -0.01196582   -0.00479211    0.00734937    0.00051481
C    2.35870323    0.05454403   -0.04911782    0.01390140   -0.01744221    0.00220325
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   15
   -420.53785195
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O   -1.99273237   -1.29606024   -0.00106407   -0.02831732   -0.01417296    0.00116843
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C   -0.82466149   -0.77807474    0.00304926    0.01906977    0.01757657   -0.00452424
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C    0.38625839   -1.59551445    0.04510451    0.00427513   -0.00705590    0.00038528
C    1.68440923    1.31184542    0.02221495   -0.03188867    0.03540296    0.00448551
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   15
   -420.53807215
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O   -1.99157708   -1.29725666   -0.00061627   -0.02780403   -0.01434600    0.00135629
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C   -0.82458008   -0.77720646    0.00122064    0.01910830    0.01687277   -0.00474765
C    0.30381253    1.48681575    0.03752591   -0.01390401   -0.03432500   -0.00225393
C    0.38519106   -1.59296900    0.04729639    0.00522441   -0.00518733    0.00058539
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C    2.35575140    0.06481656   -0.05397338    0.01584715    0.00006490    0.00041251
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   15
   -420.53811473
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O   -1.99010706   -1.29829065   -0.00018384   -0.02657502   -0.01415761    0.00152878
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   15
   -420.53794667
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O   -1.98833617   -1.29916447    0.00023125   -0.02468785   -0.01358009    0.00168415
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C   -0.82527330   -0.77621741   -0.00221889    0.01741372    0.01435843   -0.00503516
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C    1.68910923    1.31920547    0.02590099   -0.02621349    0.05239798    0.00532645
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C    2.35184120    0.07508546   -0.05885331    0.01776102    0.01751675   -0.00148646
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   15
   -420.53771202
H   -2.59065074    0.48156157   -0.04688020    0.00055323   -0.01330311   -0.00066790
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O   -1.98628576   -1.29988469    0.00062726   -0.02220168   -0.01261654    0.00181909
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C   -0.82602243   -0.77605877   -0.00382544    0.01578399    0.01263800   -0.00510120
C    0.30910874    1.48822034    0.03490689   -0.00715755   -0.03175285   -0.00453709
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C    2.34949046    0.07988845   -0.06126678    0.01829502    0.02587047   -0.00239077
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   15
   -420.53755783
H   -2.60295958    0.48128801   -0.04842072   -0.00401346   -0.01586720   -0.00097889
O   -1.99401411    1.29606192   -0.02709242   -0.00076525    0.03324732    0.00043004
O   -1.98398397   -1.30046218    0.00100266   -0.01919450   -0.01125236    0.00192453
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C   -0.82700968   -0.77609094   -0.00535491    0.01371338    0.01068606   -0.00512032
C    0.31114827    1.48964873    0.03415571   -0.00315941   -0.03340287   -0.00538764
C    0.38002865   -1.58222428    0.05593999    0.00689381   -0.00021426    0.00162592
C    1.69428201    1.32032509    0.02796407   -0.02069576    0.05404704    0.00573120
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H    2.32888111    2.17457064    0.07718757   -0.00462224   -0.01579053    0.00106367
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C    2.34686373    0.08430078   -0.06364418    0.01829133    0.03382365   -0.00322393
H    3.41882982   -0.06334032   -0.16511961   -0.00310962   -0.01746971   -0.00270020
   15
   -420.53762198
H   -2.61456184    0.48384865   -0.04978559   -0.00746724   -0.01693069   -0.00124710
O   -1.99253751    1.29257412   -0.02567596    0.00391974    0.03176210    0.00094795
O   -1.98146488   -1.30091230    0.00135626   -0.01571823   -0.00957591    0.00200311
C   -0.78027675    0.68794865   -0.01342253    0.00979299    0.00466887    0.00164074
C   -0.82820378   -0.77628447   -0.00680702    0.01124648    0.00854528   -0.00508903
C    0.31323502    1.49158276    0.03348609    0.00128297   -0.03559161   -0.00631351
C    0.37848308   -1.57949132    0.05805023    0.00655675    0.00053934    0.00194046
C    1.69735827    1.31966011    0.02886703   -0.01871945    0.05035381    0.00568356
C    1.71637199   -1.24737754   -0.00490012   -0.00146804   -0.01768257    0.00583151
H    0.00990480    2.52660566    0.11310303    0.00093467   -0.00793334    0.00128649
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H    2.34804332    2.16264751    0.08497898   -0.00265798   -0.01652296    0.00106837
H    2.38928363   -2.13523734   -0.04345960    0.00499544   -0.01722196   -0.00253398
C    2.34396141    0.08820233   -0.06597297    0.01752221    0.04126574   -0.00396396
H    3.41393918   -0.06252563   -0.15878002   -0.00481828   -0.01748060   -0.00221328
   15
   -420.53789935
H   -2.62483940    0.48943456   -0.05092685   -0.00956552   -0.01642079   -0.00144776
O   -1.99110449    1.28872767   -0.02427019    0.00763819    0.02847278    0.00139128
O   -1.97876785   -1.30125407    0.00168716   -0.01184794   -0.00760250    0.00205187
C   -0.78258782    0.68698545   -0.01723220    0.00354252    0.00236075    0.00099777
C   -0.82956749   -0.77660704   -0.00818224    0.00842770    0.00626855   -0.00501431
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   15
   -420.53829116
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   15
   -420.53864575
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   15
   -420.53884591
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   15
   -420.53881729
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   15
   -420.53859396
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C    1.72096720    1.30395084    0.03272447   -0.00415026   -0.00238496    0.00206037
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   15
   -420.53827087
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O   -1.96151544   -1.30241565    0.00318629    0.01538132    0.00633801    0.00184691
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   15
   -420.53801928
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O   -1.95894490   -1.30270944    0.00335882    0.01960711    0.00821427    0.00176776
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   15
   -420.53794471
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O   -1.95659635   -1.30309605    0.00351130    0.02336804    0.00971689    0.00168785
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C    1.73416713    1.29453922    0.03407293    0.01699456   -0.01751887    0.00103765
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   15
   -420.53800197
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   15
   -420.53805031
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O   -1.95272833   -1.30421070    0.00375955    0.02889333    0.01134608    0.00156296
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   15
   -420.53785820
H   -2.69580509    0.57931728   -0.04951576   -0.00375487    0.01259876   -0.00059987
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O   -1.95127129   -1.30495713    0.00385672    0.03040153    0.01136154    0.00152816
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C   -0.84164146   -0.77907926   -0.01893474   -0.02461274   -0.01073008   -0.00230577
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C    0.35665546   -1.55219165    0.07977373   -0.00621122    0.01762654    0.00513373
C    1.74499304    1.28729511    0.03525412    0.04331668   -0.01421231    0.00220788
C    1.68994720   -1.23167551   -0.00423548    0.00035933   -0.01626952    0.00870628
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C    2.30419768    0.06896564   -0.08712762   -0.02944985    0.03312711   -0.00972316
H    3.40411503    0.12078266   -0.07278061    0.00643706    0.01094642    0.00307277
   15
   -420.53734633
H   -2.70506911    0.57390420   -0.04872560   -0.01036304    0.00805824   -0.00082898
O   -1.98136304    1.24018802   -0.00904877    0.02122640   -0.02363220    0.00324484
O   -1.95015822   -1.30583196    0.00393655    0.03095064    0.01082429    0.00151533
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C   -0.84122384   -0.77856075   -0.01961442   -0.02483789   -0.00997671   -0.00203164
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C    1.68693470   -1.22730856   -0.00503852   -0.00435489   -0.00723041    0.00831466
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   15
   -420.53660935
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   15
   -420.53585247
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   15
   -420.53534404
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O   -1.94888964   -1.30913498    0.00407198    0.02684817    0.00603030    0.00162474
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   15
   -420.53512929
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   15
   -420.53521791
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O   -1.94959071   -1.31170850    0.00407073    0.02014814    0.00074045    0.00181333
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C    1.67389265   -1.20639490   -0.01071983   -0.01481974    0.02916207    0.00380048
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   15
   -420.53556252
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O   -1.95030412   -1.31302335    0.00403981    0.01603497   -0.00229818    0.00193106
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C    1.74370621    1.27496625    0.03633109    0.05566100   -0.00070431    0.00485309
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H    2.38812725    2.12985572    0.15399635   -0.00578191   -0.00435403    0.00157243
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   15
   -420.53588989
H   -2.68174574    0.52156600   -0.03807457   -0.01258438    0.00512032   -0.00054965
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O   -1.95119919   -1.31431210    0.00398699    0.01165252   -0.00541474    0.00205535
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C    1.73987086    1.27321088    0.03619388    0.04837246   -0.00403026    0.00439634
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   15
   -420.53620114
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O   -1.95222635   -1.31553933    0.00391085    0.00718101   -0.00859394    0.00218224
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C   -0.82673879   -0.77115843   -0.02419200   -0.00149202    0.00605949   -0.00097154
C    0.32466177    1.59212475    0.04467833   -0.00529472    0.01045645   -0.00186654
C    0.34746498   -1.55135182    0.08900573   -0.01301611    0.01055340    0.00735586
C    1.73530548    1.27151668    0.03599027    0.03996680   -0.00754978    0.00388755
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C    2.30275034    0.01095813   -0.09011471   -0.00997726   -0.06537992   -0.01045577
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   15
   -420.53640059
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O   -1.95333505   -1.31666913    0.00380995    0.00278530   -0.01169656    0.00230840
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C    1.73013653    1.26993616    0.03572781    0.03097483   -0.01068066    0.00341896
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   15
   -420.53671345
H   -2.62932976    0.49020534   -0.03147514    0.00346210    0.01502338    0.00002502
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O   -1.95447557   -1.31766633    0.00368288   -0.00137688   -0.01467471    0.00242694
C   -0.74804783    0.70649522   -0.08255506    0.01456734   -0.01368307   -0.01758256
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C    1.72449944    1.26851609    0.03541355    0.02183585   -0.01297755    0.00304413
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C    2.30523065    0.00529700   -0.08897561   -0.00654578   -0.07206263   -0.00956286
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   15
   -420.53722751
H   -2.61190317    0.47504281   -0.02924903    0.00624549    0.01549840    0.00003686
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O   -1.95560079   -1.31849724    0.00352829   -0.00518304   -0.01747223    0.00253381
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C    0.34758375   -1.55463309    0.09020845   -0.01128950    0.00960060    0.00733354
C    1.71853196    1.26729093    0.03505312    0.01289694   -0.01419915    0.00279344
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H    2.37261287   -1.99652305    0.02056688   -0.00391511    0.01692201   -0.00012898
C    2.30663086    0.00407974   -0.08818571   -0.00580386   -0.07200410   -0.00903453
H    3.38242047    0.09011276   -0.05435334   -0.00684489    0.01298630    0.00368023
   15
   -420.53790233
H   -2.59557282    0.45712608   -0.02702802    0.00703957    0.01352099   -0.00005269
O   -1.99413721    1.22306718    0.00052859   -0.02041243   -0.01654053    0.00684768
O   -1.95666765   -1.31913012    0.00334498   -0.00853546   -0.02004092    0.00262512
C   -0.73975631    0.71450011   -0.08407685    0.02426187   -0.00866292   -0.01840114
C   -0.81707984   -0.76850766   -0.02608233    0.01127905    0.01142224   -0.00101730
C    0.32680945    1.60300203    0.04950883   -0.00191119    0.00897836    0.00136451
C    0.34798173   -1.55601878    0.09038639   -0.00984910    0.00992257    0.00716564
C    1.71236891    1.26627897    0.03465029    0.00442230   -0.01421085    0.00268286
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   15
   -420.53868467
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   15
   -420.53932277
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   15
   -420.53952532
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O   -1.95916831   -1.31956268    0.00261331   -0.01535702   -0.02628158    0.00278735
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   15
   -420.53911028
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   15
   -420.53815611
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   15
   -420.53679934
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   15
   -420.53531985
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   15
   -420.53398428
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O   -1.95980975   -1.31418282    0.00076623   -0.01701331   -0.03029875    0.00261943
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   15
   -420.53302587
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O   -1.95935261   -1.31209187    0.00030500   -0.01630660   -0.02987048    0.00253122
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   15
   -420.53240785
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O   -1.95871074   -1.30966250   -0.00018494   -0.01532829   -0.02899203    0.00243332
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C   -0.80490972   -0.77298550   -0.02951156    0.00534023    0.00264146   -0.00238762
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   15
   -420.53210293
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O   -1.95789524   -1.30690467   -0.00070247   -0.01408042   -0.02768296    0.00233045
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C   -0.80449978   -0.77401844   -0.02970110    0.00375217    0.00071877   -0.00262005
C    0.33110633    1.61368898    0.05795054    0.02112328    0.00077372    0.00748088
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C    2.32623911    0.04599942   -0.07134082    0.02518628    0.02914540    0.00086199
H    3.39561620   -0.16461740   -0.11775273   -0.00110276   -0.02553556   -0.00117424
   15
   -420.53204145
H   -2.45196677    0.29816249    0.00455885    0.01463254   -0.01393563    0.00060022
O   -1.99352491    1.21443019   -0.00085131   -0.00776639    0.01584573    0.00545323
O   -1.95692026   -1.30383319   -0.00124644   -0.01256165   -0.02597333    0.00222696
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C   -0.80414670   -0.77506210   -0.02985102    0.00226301   -0.00132135   -0.00286732
C    0.33043278    1.61326252    0.05804845    0.02300566   -0.00527192    0.00728695
C    0.35545783   -1.58426036    0.08525714    0.00642592   -0.00067662    0.00446737
C    1.65875134    1.25909743    0.02583790   -0.05518657   -0.00336244    0.00305649
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   15
   -420.53217227
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   15
   -420.53253071
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   15
   -420.53321578
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   15
   -420.53432692
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   15
   -420.53585894
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   15
   -420.53775030
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   15
   -420.53973824
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   15
   -420.54146733
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   15
   -420.54264133
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   15
   -420.54306566
H   -2.56016568    0.36188595    0.02133912   -0.00439307   -0.00467195    0.00269771
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   15
   -420.54284381
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   15
   -420.54219362
H   -2.60059567    0.37420711    0.02028139   -0.01531799   -0.00913806    0.00293981
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O   -1.94191904   -1.25219076   -0.00946273    0.01711496    0.00615113    0.00166442
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H    2.36798314   -2.12378324    0.03015098    0.00028797   -0.01018721    0.00138859
C    2.30384591    0.04588824   -0.05402615   -0.01913467    0.01662607    0.00674371
H    3.41611648    0.09945977   -0.16294886    0.01838773    0.00738958   -0.00461824
   15
   -420.54138907
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   15
   -420.54071034
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   15
   -420.54020758
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O   -1.94068373   -1.23873442   -0.01194593    0.01717955    0.01220660    0.00197536
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   15
   -420.53981287
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   15
   -420.53933793
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   15
   -420.53863619
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O   -1.94115827   -1.22650319   -0.01463101    0.01217992    0.01583790    0.00231288
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C    1.70749140   -1.26926539   -0.00251517   -0.00079729    0.00555850    0.00003981
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   15
   -420.53766871
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O   -1.94162209   -1.22276965   -0.01557690    0.00990028    0.01656392    0.00239229
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C    2.29377316    0.02004121   -0.05035872    0.00078672   -0.03646267    0.00131545
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   15
   -420.53659310
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   15
   -420.53575306
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O   -1.94285969   -1.21587227   -0.01755058    0.00520870    0.01755744    0.00246626
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   15
   -420.53552922
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   15
   -420.53603981
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   15
   -420.53717715
H   -2.64891221    0.45849354   -0.01944546    0.00199574    0.01712573    0.00025262
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C    0.37663848   -1.62622276    0.05454998   -0.01012610   -0.00597004    0.00052963
C    1.70243117    1.29345005   -0.00592513    0.02324903    0.00980948    0.00264503
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C    2.28796928    0.01511613   -0.04866802    0.01203786   -0.03997700   -0.00237267
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   15
   -420.53844538
H   -2.65205565    0.44753345   -0.02385994   -0.00378493    0.00992121    0.00008116
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C   -0.76871633    0.69246402    0.03111805   -0.00024765   -0.04240974    0.00858994
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   15
   -420.53958684
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O   -1.94659609   -1.20217389   -0.02296617   -0.00342556    0.01899636    0.00213695
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C   -0.77112245   -0.74687091   -0.00369563    0.01296828    0.02727599   -0.00800789
C    0.29705902    1.59754631    0.02955870   -0.00310233    0.01498288   -0.00341391
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C    2.28438697    0.01739890   -0.04780020   -0.00004420   -0.03428892   -0.00275924
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   15
   -420.54015174
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O   -1.94729189   -1.20006887   -0.02412645   -0.00443022    0.01921104    0.00199829
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C   -0.77001893   -0.74602338   -0.00103482    0.01330802    0.02907677   -0.00750830
C    0.29791853    1.59575627    0.02811937   -0.00096130    0.01900309   -0.00390306
C    0.38592900   -1.62601289    0.05028011   -0.00241495   -0.00087268    0.00118476
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C    1.72624864   -1.29237573    0.01640776    0.00335616   -0.02293985    0.00723538
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H    2.48329484   -2.06323878   -0.05341431    0.00310842    0.00838990   -0.00394983
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   15
   -420.54016173
H   -2.65353349    0.40911884   -0.03700732   -0.01723907   -0.00937800   -0.00073772
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O   -1.94793758   -1.19818174   -0.02530938   -0.00526006    0.01941120    0.00183924
C   -0.76296690    0.68614801    0.04207559    0.01008658   -0.05053950    0.01066815
C   -0.76911634   -0.74561449    0.00173943    0.01338601    0.03001946   -0.00694439
C    0.29879209    1.59368091    0.02673905    0.00157475    0.02138088   -0.00438159
C    0.38915304   -1.62588548    0.04882611    0.00029271    0.00011092    0.00149671
C    1.68927886    1.29714300   -0.01243492    0.01272517    0.02637755    0.00274203
C    1.72779070   -1.29346274    0.01810755    0.00024139   -0.02170519    0.00787785
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H    3.38079473    0.11827041   -0.10622959    0.00937569    0.01056678   -0.00041590
   15
   -420.53969844
H   -2.64870038    0.39831171   -0.04119467   -0.01847902   -0.01294009   -0.00101864
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O   -1.94852371   -1.19651479   -0.02651315   -0.00595694    0.01960056    0.00166384
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C   -0.76841588   -0.74565841    0.00461861    0.01324896    0.03008484   -0.00632738
C    0.29964118    1.59128505    0.02542497    0.00464818    0.02148873   -0.00486129
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C    1.68542084    1.29724232   -0.01416875    0.01024962    0.03059481    0.00254420
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   15
   -420.53908484
H   -2.64056723    0.38980874   -0.04519947   -0.01787364   -0.01476248   -0.00124699
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C    1.68140865    1.29688043   -0.01594103    0.00710889    0.03369276    0.00233696
C    1.73090150   -1.29467229    0.02114209   -0.00414866   -0.01926593    0.00880745
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C    2.27811580    0.02747490   -0.04553951   -0.02530057   -0.00912873   -0.00380973
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   15
   -420.53850183
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C    0.30107125    1.58556397    0.02302449    0.01240385    0.01434694   -0.00578520
C    0.39864573   -1.62553519    0.04430844    0.00747716    0.00039830    0.00245145
C    1.67729030    1.29601125   -0.01774870    0.00287859    0.03503996    0.00217581
C    1.73253577   -1.29483105    0.02246288   -0.00472155   -0.01859199    0.00901828
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C    2.27729990    0.03061096   -0.04484278   -0.02811848   -0.00113045   -0.00425183
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   15
   -420.53805526
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C   -0.75757286    0.68820254    0.05440882    0.01933242   -0.04433448    0.01211052
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C    1.67313005    1.29461490   -0.01958939   -0.00267354    0.03423461    0.00211018
C    1.73423982   -1.29470807    0.02364755   -0.00397167   -0.01845107    0.00903851
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   15
   -420.53768265
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O   -1.95012918   -1.19208946   -0.03149329   -0.00792485    0.02029724    0.00075473
C   -0.75688054    0.69049194    0.05704402    0.02072632   -0.04006266    0.01216765
C   -0.76755512   -0.75018867    0.01698703    0.01109937    0.02224291   -0.00338618
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C    1.66901176    1.29270362   -0.02146214   -0.00947301    0.03122630    0.00215587
C    1.73600229   -1.29430544    0.02469579   -0.00187662   -0.01887800    0.00886547
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C    2.27695039    0.03681415   -0.04324898   -0.02801599    0.01444723   -0.00525331
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   15
   -420.53726970
H   -2.58165358    0.38096636   -0.05880327   -0.00030454   -0.00613348   -0.00123608
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O   -1.95031784   -1.19155380   -0.03276676   -0.00818355    0.02051991    0.00048899
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C   -0.76778465   -0.75226159    0.02023649    0.01025017    0.01871910   -0.00254745
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C    1.66503764    1.29032241   -0.02336760   -0.01704592    0.02639355    0.00229183
C    1.73779158   -1.29361670    0.02561022    0.00149057   -0.01985513    0.00851160
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H    2.35139720    2.11010572   -0.09634735   -0.00393742   -0.01191085   -0.00080460
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C    2.27741516    0.03964667   -0.04233681   -0.02505837    0.02128537   -0.00576747
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   15
   -420.53663605
H   -2.56428938    0.38310553   -0.06160242    0.00617402   -0.00100319   -0.00098176
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O   -1.95041383   -1.19125091   -0.03404575   -0.00827515    0.02074470    0.00020462
C   -0.75645225    0.69680804    0.06176406    0.02274579   -0.02920449    0.01190139
C   -0.76816900   -0.75461706    0.02352442    0.00927660    0.01480322   -0.00166713
C    0.30119131    1.57243717    0.01930961    0.02608261   -0.01445738   -0.00664513
C    0.40962648   -1.62506646    0.03775595    0.01413719   -0.00233823    0.00320168
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C    1.73955707   -1.29262721    0.02639614    0.00591148   -0.02128410    0.00800170
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H    2.35176608    2.11376324   -0.09959205   -0.00038613   -0.00792287   -0.00108408
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C    2.27825659    0.04215865   -0.04133747   -0.02026697    0.02705926   -0.00626455
H    3.38300134   -0.08743823   -0.07675951    0.01198143   -0.02201995    0.00120002
   15
   -420.53567722
H   -2.54803214    0.38542444   -0.06422577    0.01232980    0.00420975   -0.00067415
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O   -1.95041613   -1.19118340   -0.03532706   -0.00814854    0.02098622   -0.00008316
C   -0.75674689    0.70067096    0.06385292    0.02348753   -0.02292944    0.01159232
C   -0.76869342   -0.75719603    0.02683751    0.00815310    0.01062267   -0.00074914
C    0.30034002    1.56942283    0.01862838    0.02680295   -0.02063154   -0.00649856
C    0.41189463   -1.62488688    0.03600227    0.01555666   -0.00273047    0.00330286
C    1.65797774    1.28445762   -0.02728509   -0.03165847    0.01384363    0.00260174
C    1.74123229   -1.29131556    0.02706124    0.01106448   -0.02299753    0.00737677
H   -0.06878227    2.61152585    0.03708245   -0.01326449    0.00633097    0.00278744
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H    2.35220161    2.11884010   -0.10264150    0.00338688   -0.00343605   -0.00137799
H    2.47462417   -2.10394159   -0.03878825    0.00513250   -0.00401394   -0.00288473
C    2.27940256    0.04426307   -0.04024348   -0.01389668    0.03153327   -0.00671768
H    3.36994810   -0.10714501   -0.07287937    0.00422539   -0.02470434    0.00163300
   15
   -420.53453153
H   -2.53397924    0.38699857   -0.06672732    0.01739899    0.00852674   -0.00039395
O   -2.04212588    1.23627949   -0.02179410   -0.04858550    0.00702723   -0.00713459
O   -1.95032624   -1.19135393   -0.03660740   -0.00776402    0.02121752   -0.00037961
C   -0.75739656    0.70488013    0.06576662    0.02414477   -0.01629181    0.01118679
C   -0.76934092   -0.75993545    0.03016190    0.00687149    0.00630952    0.00020038
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   15
   -420.53341203
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O   -1.95014854   -1.19176509   -0.03788345   -0.00708955    0.02141498   -0.00066506
C   -0.75841120    0.70933537    0.06751127    0.02474417   -0.00944568    0.01070137
C   -0.77009211   -0.76277025    0.03348321    0.00541717    0.00197523    0.00117938
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C    1.65280470    1.27775200   -0.03135810   -0.04084560    0.00187483    0.00255103
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C    2.28220877    0.04700047   -0.03774546    0.00134217    0.03623413   -0.00736198
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   15
   -420.53263246
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C   -0.77092500   -0.76563504    0.03678667    0.00381511   -0.00227276    0.00218002
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   15
   -420.53250354
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O   -1.94956376   -1.19331746   -0.04040984   -0.00488650    0.02161205   -0.00120343
C   -0.76157049    0.71857023    0.07052359    0.02563463    0.00421755    0.00957166
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C    0.41839007   -1.62376383    0.02848059    0.02178933   -0.00169838    0.00343849
C    1.65005828    1.27091268   -0.03558182   -0.04141114   -0.00618524    0.00181336
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C    2.28495086    0.04757124   -0.03480497    0.01300323    0.03607445   -0.00746117
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   15
   -420.53313055
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C   -0.76372827    0.72314363    0.07180831    0.02565791    0.01071238    0.00895595
C   -0.77273769   -0.77120101    0.04327920    0.00038786   -0.01011415    0.00423720
C    0.29068106    1.56010072    0.01657426    0.00687688   -0.02867110   -0.00388511
C    0.41925179   -1.62340168    0.02647076    0.02341771   -0.00118761    0.00339324
C    1.64962672    1.26760505   -0.03773795   -0.03830725   -0.00832089    0.00116165
C    1.74557597   -1.27915442    0.02892470    0.03008562   -0.02354151    0.00411355
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   15
   -420.53440719
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C    0.28809331    1.55955635    0.01637812   -0.00035936   -0.02582920   -0.00317548
C    0.41975963   -1.62302135    0.02440973    0.02491713   -0.00084108    0.00327831
C    1.64977192    1.26442162   -0.03991142   -0.03320037   -0.00912054    0.00032956
C    1.74522883   -1.27558424    0.02907448    0.02940544   -0.01945590    0.00363420
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C    2.28697230    0.04597504   -0.03141698    0.01193913    0.03286099   -0.00682044
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   15
   -420.53602784
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C   -0.77457603   -0.77616237    0.04951527   -0.00259825   -0.01655907    0.00633928
C    0.28551111    1.55940156    0.01623000   -0.00769171   -0.02220895   -0.00246936
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C    1.74443913   -1.27172185    0.02916927    0.02705029   -0.01377814    0.00319336
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H    2.42005813   -2.10985699    0.00234127   -0.00944685    0.00210837    0.00048431
C    2.28770033    0.04441838   -0.02956550    0.00580756    0.03017812   -0.00620888
H    3.33792706   -0.11341244   -0.05705311   -0.02347661   -0.02360526    0.00233299
   15
   -420.53766341
H   -2.52973916    0.35989581   -0.08166150    0.00427886   -0.01155691   -0.00250481
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C   -0.77544721   -0.77829112    0.05249750   -0.00362173   -0.01909304    0.00740250
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C    1.74324193   -1.26765263    0.02921577    0.02342963   -0.00690094    0.00275858
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H    2.30435943    2.13550751   -0.11652754    0.00204726    0.00383201   -0.00042895
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C    2.28834384    0.04240671   -0.02762036   -0.00298552    0.02649135   -0.00542310
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   15
   -420.53891786
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O   -1.94743819   -1.20145756   -0.04643772    0.00247284    0.02028611   -0.00247903
C   -0.77608324    0.73895614    0.07568986    0.01773691    0.03093946    0.00635332
C   -0.77626418   -0.78013183    0.05536780   -0.00418055   -0.02110515    0.00847573
C    0.28079780    1.56004300    0.01603534   -0.02059123   -0.01525003   -0.00108505
C    0.41895462   -1.62179949    0.01794418    0.02747495   -0.00184444    0.00233006
C    1.65278169    1.25563997   -0.04639916   -0.00986374   -0.00423022   -0.00296109
C    1.74169137   -1.26347983    0.02922058    0.01906571    0.00060151    0.00230933
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H    2.41802336   -2.11639820    0.01433454   -0.00501689   -0.00437900    0.00105726
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   15
   -420.53967433
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O   -1.94703284   -1.20379419   -0.04757081    0.00348605    0.01968687   -0.00278626
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C   -0.77701855   -0.78165409    0.05810993   -0.00421448   -0.02256907    0.00955664
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C    0.41786742   -1.62134825    0.01571077    0.02732891   -0.00303191    0.00178059
C    1.65425229    1.25288753   -0.04849567   -0.00131228   -0.00114496   -0.00416839
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C    2.28991950    0.03726000   -0.02349822   -0.02269997    0.01548847   -0.00352323
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   15
   -420.53998996
H   -2.55419641    0.36109806   -0.08320106   -0.00578498   -0.01810275   -0.00356806
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C   -0.77770988   -0.78283581    0.06070758   -0.00369156   -0.02346565    0.01063887
C    0.27730503    1.56162895    0.01590569   -0.02867183   -0.01252260    0.00040830
C    0.41636774   -1.62085069    0.01345058    0.02657652   -0.00461548    0.00111608
C    1.65574368    1.25015263   -0.05052921    0.00648362    0.00172945   -0.00532411
C    1.73779539   -1.25527501    0.02913272    0.01006515    0.01516405    0.00134211
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H    2.27048814    2.12571324   -0.11891969   -0.01031887   -0.00712030    0.00115352
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C    2.29114660    0.03429111   -0.02134984   -0.03105232    0.00827344   -0.00250018
H    3.40046911   -0.02209282   -0.05707389    0.01324749   -0.01212951    0.00015874
   15
   -420.54002388
H   -2.56093921    0.36769612   -0.08249472   -0.00711401   -0.01757308   -0.00362797
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O   -1.94634740   -1.20912916   -0.04973818    0.00446519    0.01818090   -0.00351652
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C   -0.77834607   -0.78366342    0.06314439   -0.00263022   -0.02380227    0.01171567
C    0.27618101    1.56271354    0.01583727   -0.03054382   -0.01325613    0.00128399
C    0.41446700   -1.62028296    0.01117364    0.02520181   -0.00651354    0.00035254
C    1.65713873    1.24739276   -0.05248240    0.01289643    0.00365855   -0.00636065
C    1.73558511   -1.25146193    0.02905463    0.00618510    0.02119780    0.00084740
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H    2.42060364   -2.11902896    0.03074973    0.00173301   -0.01191647    0.00201304
C    2.29284058    0.03119794   -0.01916365   -0.03726316    0.00033467   -0.00148247
H    3.41429634    0.00779844   -0.05741773    0.02006459   -0.00754715   -0.00040773
   15
   -420.53993678
H   -2.56641873    0.37743855   -0.08113745   -0.00722938   -0.01569345   -0.00353193
O   -2.00066284    1.24147209   -0.01386424    0.02736345    0.01581527   -0.00096623
O   -1.94607841   -1.21211042   -0.05076417    0.00442265    0.01727251   -0.00394254
C   -0.79231016    0.74754216    0.07803515   -0.00974618    0.03872925    0.00374873
C   -0.77894310   -0.78413181    0.06540408   -0.00107644   -0.02360418    0.01278106
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   15
   -420.53983204
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   15
   -420.53961592
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   15
   -420.53926932
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   15
   -420.53867351
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   15
   -420.53775383
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C   -0.78232734   -0.78142566    0.07349903    0.01004761   -0.01648361    0.01746093
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   15
   -420.53660203
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C   -0.78332144   -0.78002626    0.07437807    0.01198199   -0.01419987    0.01815057
C    0.28070377    1.57713202    0.01402160   -0.01846375   -0.01333411    0.00685302
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   15
   -420.53538906
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   15
   -420.53437142
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C   -0.78587490   -0.77662153    0.07530460    0.01459568   -0.00907482    0.01918182
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   15
   -420.53374892
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   15
   -420.53368163
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O   -1.94508457   -1.25045598   -0.05769079    0.00007628    0.00361923   -0.00808272
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   15
   -420.53413728
H   -2.63807276    0.49431003   -0.03972652   -0.00337447    0.00675305   -0.00105368
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C   -0.79135797   -0.77059563    0.07451295    0.01479305   -0.00052923    0.01977137
C    0.29300614    1.59269206    0.00999962   -0.00349594    0.02144534    0.00542531
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C    2.34374051    0.02025410    0.00586269    0.04763294   -0.02789160    0.00306482
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   15
   -420.53492870
H   -2.65037033    0.49308515   -0.03480722   -0.00949419    0.00169965   -0.00115892
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O   -1.94498041   -1.25916621   -0.05810320    0.00081868    0.00063804   -0.00843328
C   -0.79842565    0.72459266    0.08066188   -0.04086281   -0.00160416    0.00446207
C   -0.79363809   -0.76851264    0.07365351    0.01391975    0.00236403    0.01971545
C    0.29580075    1.59530946    0.00891712   -0.00065342    0.02892895    0.00471501
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   15
   -420.53586301
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   15
   -420.53673526
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   15
   -420.53738690
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C   -0.80165692   -0.76264624    0.06929956    0.00916036    0.01037118    0.01887327
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   15
   -420.53784358
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C   -0.80464282   -0.76095267    0.06727048    0.00702043    0.01258820    0.01837925
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   15
   -420.53819632
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   15
   -420.53846696
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   15
   -420.53869112
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   15
   -420.53883485
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C   -0.75611917    0.70335916    0.07754293    0.02362116   -0.03249060    0.00768924
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C    0.31445977    1.59754356   -0.00192623    0.02462706    0.01753339    0.00486125
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   15
   -420.53889739
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   15
   -420.53889783
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C    1.65689970    1.23073076   -0.06409226   -0.03978174   -0.02295072   -0.00215859
C    1.70734821   -1.23856724    0.02982580   -0.00265632   -0.00696201    0.00080593
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   15
   -420.53886876
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C    0.31668006    1.59202648   -0.00707420    0.02477929    0.00581211    0.00481396
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C    1.65933515    1.23308392   -0.06339813   -0.04283271   -0.02611462   -0.00109081
C    1.70860257   -1.23905838    0.02994579    0.00369832   -0.01081509    0.00099288
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H    2.36536777    2.06059239   -0.19440753    0.00785333   -0.00525554   -0.00233485
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C    2.35317854    0.05574970    0.02385311    0.01021494    0.03968149    0.00291482
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   15
   -420.53880812
H   -2.61502128    0.50156891    0.03177453    0.01210273    0.01655637    0.00083145
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O   -1.94674027   -1.30817902   -0.05263977    0.00633778   -0.01120467   -0.00639967
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C   -0.82912826   -0.75579423    0.04197110   -0.01452903    0.01487899    0.01097912
C    0.31665578    1.58994775   -0.00893840    0.02216849    0.00450737    0.00443105
C    0.35589919   -1.56127314   -0.01804008   -0.02202134    0.00207837   -0.01228031
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C    1.70980128   -1.23938646    0.03005082    0.00982188   -0.01427584    0.00113598
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   15
   -420.53868128
H   -2.61128224    0.49332060    0.03690018    0.00992074    0.01256207    0.00101392
O   -2.01513234    1.25816155    0.01463786   -0.03880259   -0.00422420   -0.00589746
O   -1.94724125   -1.31164255   -0.05162937    0.00664643   -0.01178755   -0.00597404
C   -0.73706455    0.70392442    0.07199867    0.05096306   -0.02395546    0.00820148
C   -0.83164810   -0.75626391    0.03788540   -0.01720144    0.01317159    0.00965418
C    0.31629788    1.58779921   -0.01086942    0.01825453    0.00457314    0.00389225
C    0.35706349   -1.55813992   -0.01712727   -0.01912583    0.00445843   -0.01182694
C    1.66616612    1.23900526   -0.06197374   -0.04413361   -0.02942534    0.00054105
C    1.71085236   -1.23949982    0.03013872    0.01521916   -0.01681771    0.00124251
H    0.00784681    2.64422045   -0.12396174   -0.00753151    0.01126487   -0.00304087
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H    2.35845604   -2.09908898    0.00919049   -0.00764788    0.00519435   -0.00115796
C    2.35248944    0.05761831    0.02607773    0.02396799    0.04473955    0.00253676
H    3.43545576   -0.01963195    0.01441772   -0.00058758   -0.01193246    0.00099632
   15
   -420.53839821
H   -2.60930507    0.48284026    0.04184218    0.00608051    0.00653634    0.00128672
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O   -1.94781750   -1.31497237   -0.05055122    0.00683628   -0.01235826   -0.00553007
C   -0.73527198    0.70528987    0.07052295    0.05468395   -0.01996319    0.00828820
C   -0.83390816   -0.75693241    0.03365381   -0.01962241    0.01118220    0.00826326
C    0.31566534    1.58558004   -0.01285916    0.01321893    0.00586693    0.00323355
C    0.35851630   -1.55507435   -0.01603579   -0.01566499    0.00703203   -0.01125036
C    1.67058092    1.24262290   -0.06126806   -0.04206843   -0.02909269    0.00101710
C    1.71167477   -1.23936057    0.03020785    0.01946213   -0.01798410    0.00133034
H   -0.00032386    2.63384351   -0.11911329   -0.00748480    0.00703442   -0.00232744
H    0.09737861   -2.61259319   -0.00377752   -0.00310552    0.00075616    0.00364597
H    2.37760930    2.08483650   -0.20261171    0.01229626    0.00200152   -0.00424215
H    2.34931313   -2.10298317    0.00557074   -0.00977304    0.00593833   -0.00143149
C    2.35165648    0.05755399    0.02713122    0.03117347    0.04482519    0.00249786
H    3.41933234   -0.04376407    0.01910131   -0.01081761   -0.01405884    0.00127785
   15
   -420.53794483
H   -2.60841374    0.47119510    0.04655163    0.00161385   -0.00031602    0.00162169
O   -2.01590104    1.26174849    0.01818490   -0.03062537    0.00957884   -0.00627953
O   -1.94847114   -1.31816199   -0.04941038    0.00684807   -0.01293536   -0.00506860
C   -0.73430525    0.70695662    0.06892190    0.05760358   -0.01552577    0.00838714
C   -0.83587198   -0.75776972    0.02929736   -0.02167302    0.00899026    0.00681133
C    0.31483402    1.58327103   -0.01489770    0.00731798    0.00810206    0.00249638
C    0.36020537   -1.55211507   -0.01477435   -0.01173831    0.00960387   -0.01054941
C    1.67562958    1.24667861   -0.06057745   -0.03819617   -0.02729741    0.00124462
C    1.71220466   -1.23895141    0.03025687    0.02227303   -0.01750540    0.00141485
H   -0.00715280    2.62221656   -0.11384686   -0.00699400    0.00171639   -0.00154350
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H    2.37747604    2.09266863   -0.20395019    0.01175857    0.00273458   -0.00453383
H    2.34191404   -2.10792750    0.00220886   -0.01081885    0.00539322   -0.00171638
C    2.35035413    0.05681382    0.02814679    0.03677556    0.04334775    0.00257675
H    3.40513772   -0.06537394    0.02355622   -0.01975048   -0.01559275    0.00146495
   15
   -420.53748665
H   -2.60781836    0.45960318    0.05096894   -0.00253451   -0.00687022    0.00197002
O   -2.01573868    1.26342024    0.02006409   -0.02582143    0.01639209   -0.00648085
O   -1.94920224   -1.32120484   -0.04821209    0.00661907   -0.01353284   -0.00459823
C   -0.73420832    0.70885780    0.06719402    0.05956418   -0.01082139    0.00850336
C   -0.83750873   -0.75874285    0.02483797   -0.02322431    0.00670035    0.00531975
C    0.31389263    1.58083894   -0.01697395    0.00092821    0.01080290    0.00173143
C    0.36207156   -1.54930076   -0.01335357   -0.00751146    0.01198920   -0.00972427
C    1.68125370    1.25114522   -0.05990535   -0.03264329   -0.02400794    0.00121105
C    1.71239962   -1.23827972    0.03028448    0.02355122   -0.01531709    0.00151126
H   -0.01272765    2.61028833   -0.10830262   -0.00617359   -0.00414617   -0.00075980
H    0.08457540   -2.60728286    0.00114374   -0.00565803   -0.00113201    0.00363343
H    2.37524080    2.10002191   -0.20447545    0.01019811    0.00252952   -0.00462832
H    2.33644615   -2.11382404   -0.00084371   -0.01075006    0.00353622   -0.00202206
C    2.34849955    0.05541975    0.02912328    0.03926196    0.04059510    0.00276148
H    3.39445771   -0.08418247    0.02774861   -0.02584077   -0.01673905    0.00156546
   15
   -420.53718907
H   -2.60678093    0.44923156    0.05503199   -0.00573290   -0.01227494    0.00228194
O   -2.01528303    1.26490724    0.02201674   -0.02144672    0.02193352   -0.00662976
O   -1.95000816   -1.32409415   -0.04696166    0.00610502   -0.01415827   -0.00411259
C   -0.73501060    0.71092248    0.06533754    0.06038388   -0.00602339    0.00864117
C   -0.83879509   -0.75981728    0.02029820   -0.02415420    0.00440568    0.00379685
C    0.31293720    1.57824370   -0.01907643   -0.00547481    0.01333833    0.00100769
C    0.36405117   -1.54666730   -0.01178590   -0.00313360    0.01403860   -0.00878202
C    1.68736957    1.25597311   -0.05925129   -0.02563935   -0.01929387    0.00094379
C    1.71224021   -1.23737822    0.03028922    0.02340605   -0.01166961    0.00161798
H   -0.01719318    2.59910379   -0.10262040   -0.00522061   -0.00983352   -0.00005684
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H    2.37118213    2.10693371   -0.20417084    0.00772159    0.00143094   -0.00452629
H    2.33289933   -2.12034199   -0.00353198   -0.00972309    0.00060837   -0.00234587
C    2.34605644    0.05341311    0.03005790    0.03758595    0.03686205    0.00302603
H    3.38837172   -0.09997875    0.03166006   -0.02795625   -0.01776280    0.00160425
   15
   -420.53721608
H   -2.60473054    0.44104649    0.05868533   -0.00762186   -0.01607877    0.00251565
O   -2.01458341    1.26614705    0.02404452   -0.01780478    0.02572207   -0.00669200
O   -1.95088302   -1.32682284   -0.04566457    0.00525636   -0.01480093   -0.00361917
C   -0.73672431    0.71307835    0.06335038    0.05990872   -0.00130935    0.00880064
C   -0.83971711   -0.76095842    0.01570103   -0.02437296    0.00219575    0.00225745
C    0.31206396    1.57544791   -0.02119428   -0.01140068    0.01494388    0.00038534
C    0.36607820   -1.54424552   -0.01008558    0.00123701    0.01564368   -0.00773083
C    1.69387166    1.26109117   -0.05861127   -0.01752071   -0.01330492    0.00046747
C    1.71172835   -1.23630150    0.03026951    0.02206714   -0.00701416    0.00172412
H   -0.02071699    2.58967529   -0.09692596   -0.00438978   -0.01452682    0.00050469
H    0.07581216   -2.60123570    0.00346392   -0.00758462   -0.00173667    0.00336357
H    2.36574216    2.11359988   -0.20305420    0.00451578   -0.00039239   -0.00425707
H    2.33109316   -2.12695981   -0.00579781   -0.00803186   -0.00298482   -0.00267722
C    2.34305039    0.05085004    0.03094673    0.03154256    0.03238733    0.00333267
H    3.38725701   -0.11257709    0.03528323   -0.02582316   -0.01877206    0.00161167
   15
   -420.53755458
H   -2.60132885    0.43572996    0.06188730   -0.00806565   -0.01808341    0.00264445
O   -2.01368109    1.26709689    0.02614811   -0.01498244    0.02753653   -0.00664088
O   -1.95181719   -1.32938365   -0.04432644    0.00406756   -0.01545139   -0.00310162
C   -0.73934203    0.71525428    0.06123014    0.05797733    0.00317344    0.00898488
C   -0.84027152   -0.76213296    0.01106975   -0.02383199    0.00014893    0.00071060
C    0.31136192    1.57242814   -0.02331811   -0.01637478    0.01493680   -0.00010722
C    0.36808669   -1.54205966   -0.00826849    0.00546839    0.01673883   -0.00658428
C    1.70063780    1.26640920   -0.05797814   -0.00873507   -0.00632987   -0.00015175
C    1.71088392   -1.23511931    0.03022374    0.01986044   -0.00189107    0.00181190
H   -0.02344519    2.58283645   -0.09131969   -0.00392404   -0.01745800    0.00088419
H    0.07339659   -2.59776129    0.00370166   -0.00813656   -0.00134857    0.00313913
H    2.35949463    2.12034431   -0.20117295    0.00087435   -0.00269057   -0.00387184
H    2.33072849   -2.13303766   -0.00758191   -0.00601444   -0.00673491   -0.00299218
C    2.33957176    0.04779815    0.03178515    0.02190999    0.02722317    0.00365045
H    3.39073966   -0.12179632    0.03861639   -0.02009271   -0.01970790    0.00161980
   15
   -420.53809004
H   -2.59649630    0.43364198    0.06461484   -0.00704773   -0.01822935    0.00265916
O   -2.01260807    1.26773625    0.02832691   -0.01297422    0.02729606   -0.00646751
O   -1.95279721   -1.33176919   -0.04295312    0.00255511   -0.01609938   -0.00257055
C   -0.74283445    0.71738267    0.05897402    0.05449827    0.00729359    0.00918960
C   -0.84046654   -0.76331003    0.00642772   -0.02250187   -0.00167205   -0.00083074
C    0.31090585    1.56918501   -0.02544048   -0.02003852    0.01288551   -0.00047145
C    0.37001284   -1.54012621   -0.00635194    0.00942641    0.01730275   -0.00536076
C    1.70753582    1.27182228   -0.05734264    0.00021134    0.00119317   -0.00082889
C    1.70973985   -1.23390843    0.03015063    0.01711715    0.00314523    0.00185690
H   -0.02545937    2.57910732   -0.08586991   -0.00398510   -0.01812021    0.00108083
H    0.07244188   -2.59405061    0.00337506   -0.00840642   -0.00050414    0.00285733
H    2.35309036    2.12757448   -0.19859549   -0.00281702   -0.00507844   -0.00343332
H    2.33144613   -2.13790809   -0.00882793   -0.00396422   -0.01013277   -0.00326582
C    2.33576455    0.04433569    0.03256839    0.01006755    0.02125077    0.00395655
H    3.39780810   -0.12746852    0.04165820   -0.01212064   -0.02047610    0.00162450
   15
   -420.53869252
H   -2.59041507    0.43480960    0.06686527   -0.00465099   -0.01653338    0.00255382
O   -2.01138723    1.26806785    0.03057896   -0.01171225    0.02502780   -0.00617454
O   -1.95380598   -1.33397215   -0.04155065    0.00076017   -0.01673048   -0.00201912
C   -0.74714888    0.71940131    0.05657893    0.04941614    0.01096030    0.00941331
C   -0.84032221   -0.76446212    0.00179823   -0.02041679   -0.00322579   -0.00235561
C    0.31075097    1.56574957   -0.02755583   -0.02224769    0.00877589   -0.00074635
C    0.37179691   -1.53845376   -0.00435441    0.01302109    0.01739759   -0.00407830
C    1.71443113    1.27721734   -0.05669460    0.00875353    0.00869075   -0.00147536
C    1.70833727   -1.23274445    0.03004951    0.01411913    0.00763497    0.00184002
H   -0.02674747    2.57860613   -0.08061261   -0.00462205   -0.01643465    0.00113618
H    0.07299611   -2.59025494    0.00253476   -0.00836104    0.00073325    0.00252997
H    2.34718841    2.13571280   -0.19539889   -0.00612328   -0.00705357   -0.00305015
H    2.33288128   -2.14096461   -0.00948696   -0.00215921   -0.01279765   -0.00347917
C    2.33180588    0.04055304    0.03329183   -0.00241593    0.01436998    0.00424904
H    3.40704778   -0.12946106    0.04440743   -0.00336865   -0.02080714    0.00163493
   15
   -420.53915560
H   -2.58351582    0.43893086    0.06865729   -0.00098326   -0.01315559    0.00234193
O   -2.01003296    1.26811740    0.03290093   -0.01109222    0.02080332   -0.00576482
O   -1.95482318   -1.33598539   -0.04012529   -0.00123854   -0.01731760   -0.00144776
C   -0.75220855    0.72125486    0.05404150    0.04275897    0.01411741    0.00965008
C   -0.83986999   -0.76556582   -0.00279568   -0.01765114   -0.00448059   -0.00385358
C    0.31093077    1.56218347   -0.02965993   -0.02304189    0.00301277   -0.00099120
C    0.37338464   -1.53704388   -0.00229526    0.01617871    0.01711386   -0.00275810
C    1.72119525    1.28248174   -0.05602433    0.01636045    0.01554297   -0.00199348
C    1.70672121   -1.23169481    0.02992065    0.01112132    0.01120084    0.00174572
H   -0.02719667    2.58103465   -0.07555866   -0.00570736   -0.01275237    0.00110913
H    0.07505134   -2.58659546    0.00123950   -0.00802189    0.00225286    0.00216775
H    2.34237973    2.14510625   -0.19165104   -0.00864550   -0.00809119   -0.00278791
H    2.33471135   -2.14173211   -0.00952094   -0.00077740   -0.01443103   -0.00361027
C    2.32788283    0.03655409    0.03395103   -0.01420640    0.00664726    0.00452862
H    3.41690081   -0.12771849    0.04686231    0.00491902   -0.02047054    0.00164210
   15
   -420.53943661
H   -2.57645383    0.44539858    0.07002904    0.00365733   -0.00828768    0.00203735
O   -2.00855245    1.26793253    0.03528822   -0.01092631    0.01489709   -0.00526520
O   -1.95582625   -1.33780222   -0.03868353   -0.00334140   -0.01785870   -0.00086105
C   -0.75791292    0.72289560    0.05135816    0.03461563    0.01675409    0.00988855
C   -0.83915158   -0.76660211   -0.00733138   -0.01432088   -0.00544832   -0.00531339
C    0.31145747    1.55857296   -0.03174902   -0.02261354   -0.00367946   -0.00125779
C    0.37472834   -1.53589246   -0.00019443    0.01886432    0.01659676   -0.00142125
C    1.72771354    1.28751261   -0.05532418    0.02269251    0.02118532   -0.00230567
C    1.70493678   -1.23081306    0.02976551    0.00830398    0.01357606    0.00156792
H   -0.02661487    2.58573970   -0.07070407   -0.00700567   -0.00774635    0.00105759
H    0.07854693   -2.58334317   -0.00044565   -0.00742080    0.00388515    0.00178106
H    2.33911132    2.15593713   -0.18739920   -0.01005441   -0.00780371   -0.00269726
H    2.33668929   -2.13991885   -0.00890624    0.00005879   -0.01487474   -0.00365439
C    2.32417261    0.03245550    0.03454178   -0.02439119   -0.00179404    0.00479437
H    3.42588806   -0.12230102    0.04902180    0.01186139   -0.01941816    0.00163158
   15
   -420.53948147
H   -2.57005829    0.45334405    0.07103478    0.00883251   -0.00244688    0.00167847
O   -2.00694786    1.26757977    0.03773519   -0.01088739    0.00780946   -0.00471427
O   -1.95679140   -1.33941651   -0.03723200   -0.00543665   -0.01835001   -0.00026439
C   -0.76413914    0.72428363    0.04852532    0.02518020    0.01889549    0.01012187
C   -0.83821717   -0.76755641   -0.01178680   -0.01056819   -0.00612562   -0.00672201
C    0.31232500    1.55501824   -0.03381902   -0.02127380   -0.01049604   -0.00158300
C    0.37578740   -1.53499195    0.00192789    0.02105415    0.01603707   -0.00008365
C    1.73389051    1.29222507   -0.05458946    0.02757943    0.02527411   -0.00239451
C    1.70302643   -1.23013491    0.02958677    0.00579421    0.01458061    0.00130319
H   -0.02477252    2.59183207   -0.06604019   -0.00826106   -0.00223162    0.00103260
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C    2.32082853    0.02838457    0.03506006   -0.03241288   -0.01067358    0.00504828
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   15
   -420.53933691
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O   -2.00522013    1.26713875    0.04023563   -0.01044572    0.00038168   -0.00416231
O   -1.95769499   -1.34082271   -0.03577748   -0.00740864   -0.01877849    0.00033393
C   -0.77074482    0.72538650    0.04553947    0.01471050    0.02059470    0.01033517
C   -0.83712327   -0.76841841   -0.01614066   -0.00656571   -0.00654184   -0.00806596
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C    1.70102804   -1.22967544    0.02938841    0.00365451    0.01412404    0.00096085
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C    2.31797152    0.02447515    0.03550201   -0.03796757   -0.01965002    0.00529040
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   15
   -420.53900049
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O   -2.00337491    1.26669275    0.04278332   -0.00891493   -0.00630088   -0.00366551
O   -1.95851476   -1.34201602   -0.03432674   -0.00914785   -0.01912645    0.00092346
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C    0.37692653   -1.53391321    0.00615634    0.02398124    0.01557240    0.00254088
C    1.74494486    1.30047122   -0.05301358    0.03352192    0.02893982   -0.00204990
C    1.69897390   -1.22942778    0.02917560    0.00190913    0.01224214    0.00055406
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H    2.34001261    2.19519870   -0.17160990   -0.00757526    0.00133006   -0.00341031
H    2.34255621   -2.11931788   -0.00317011   -0.00105916   -0.00894758   -0.00329075
C    2.31568541    0.02086251    0.03586399   -0.04091745   -0.02835867    0.00552022
H    3.43693619   -0.08650024    0.05377552    0.02063572   -0.01245137    0.00140198
   15
   -420.53863785
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O   -2.00143017    1.26631652    0.04537269   -0.00562207   -0.01112685   -0.00327150
O   -1.95923105   -1.34299239   -0.03288647   -0.01056105   -0.01941446    0.00149466
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C   -0.83469907   -0.76984401   -0.02446374    0.00146660   -0.00666037   -0.01049871
C    0.31673152    1.54565783   -0.03985978   -0.01463846   -0.02535309   -0.00294680
C    0.37696239   -1.53372832    0.00822283    0.02471012    0.01597734    0.00380839
C    1.74973164    1.30394867   -0.05217749    0.03517183    0.02917803   -0.00176067
C    1.69689050   -1.22936368    0.02895447    0.00047563    0.00910083    0.00010151
H   -0.00972720    2.60891739   -0.05319894   -0.00978320    0.01076312    0.00127224
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H    2.34471203   -2.10857874   -0.00003287   -0.00245692   -0.00502815   -0.00305124
C    2.31401469    0.01767786    0.03614253   -0.04119265   -0.03645192    0.00573716
H    3.43356287   -0.06944113    0.05483143    0.01911379   -0.00924529    0.00124077
   15
   -420.53829453
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O   -1.99942365    1.26606412    0.04799927   -0.00017342   -0.01336568   -0.00299526
O   -1.95982792   -1.34374861   -0.03146312   -0.01158149   -0.01962708    0.00203896
C   -0.79121297    0.72675444    0.03563432   -0.01935337    0.02361956    0.01073570
C   -0.83348988   -0.77040575   -0.02839620    0.00520847   -0.00641335   -0.01155819
C    0.31869070    1.54322106   -0.04179409   -0.01229222   -0.02727298   -0.00345496
C    0.37662528   -1.53378564    0.01023179    0.02491125    0.01689533    0.00503881
C    1.75398715    1.30698553   -0.05131476    0.03638783    0.02895492   -0.00149107
C    1.69479968   -1.22943599    0.02873184   -0.00077921    0.00500333   -0.00037341
H   -0.00123783    2.61162739   -0.04934967   -0.00921997    0.01256999    0.00142410
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H    2.34773082    2.22118301   -0.15810745   -0.00297276    0.01043277   -0.00398026
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C    2.31296350    0.01504321    0.03633433   -0.03880654   -0.04360544    0.00594525
H    3.42678043   -0.05072078    0.05566428    0.01538098   -0.00582867    0.00104201
   15
   -420.53795943
H   -2.57622976    0.48198281    0.07262370    0.01695762    0.00967541    0.00070737
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O   -1.96029380   -1.34428228   -0.03006287   -0.01217785   -0.01974849    0.00255099
C   -0.79768132    0.72651263    0.03201005   -0.03031207    0.02402463    0.01074438
C   -0.83235904   -0.77087072   -0.03215406    0.00861804   -0.00599374   -0.01249457
C    0.32083593    1.54119454   -0.04367620   -0.01010787   -0.02747433   -0.00393906
C    0.37591218   -1.53409899    0.01216462    0.02456101    0.01828311    0.00622069
C    1.75769269    1.30958464   -0.05042941    0.03743411    0.02869068   -0.00129759
C    1.69272072   -1.22958336    0.02851484   -0.00208509    0.00043087   -0.00084622
H    0.00890377    2.61209692   -0.04575679   -0.00810959    0.01282708    0.00157819
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H    2.35065056   -2.08518288    0.00784127   -0.00563715    0.00367474   -0.00252171
C    2.31249602    0.01306636    0.03643624   -0.03392634   -0.04954772    0.00614220
H    3.41725828   -0.03095219    0.05631021    0.00961376   -0.00237034    0.00079320
   15
   -420.53751659
H   -2.58723054    0.48233683    0.07250108    0.01205404    0.00538297    0.00074400
O   -1.99549469    1.26600255    0.05335252    0.01618053   -0.01049835   -0.00267604
O   -1.96062193   -1.34459204   -0.02869153   -0.01234265   -0.01975732    0.00302324
C   -0.80369233    0.72590803    0.02822344   -0.04046498    0.02406928    0.01066969
C   -0.83135801   -0.77124525   -0.03572316    0.01162358   -0.00541889   -0.01330091
C    0.32313427    1.53958138   -0.04549882   -0.00812921   -0.02599326   -0.00437046
C    0.37482847   -1.53468921    0.01400347    0.02361147    0.01999707    0.00734507
C    1.76083224    1.31174963   -0.04952434    0.03847310    0.02868859   -0.00119839
C    1.69067370   -1.22973734    0.02831061   -0.00371719   -0.00405846   -0.00129932
H    0.02049798    2.61027962   -0.04244769   -0.00647161    0.01153649    0.00171076
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H    2.35763164    2.23979924   -0.14177262    0.00099102    0.01720154   -0.00400453
H    2.35499608   -2.07407805    0.01248332   -0.00675858    0.00745112   -0.00226959
C    2.31253893    0.01183693    0.03644530   -0.02694468   -0.05407233    0.00632890
H    3.40602922   -0.01075490    0.05681399    0.00220800    0.00094475    0.00050136
   15
   -420.53681928
H   -2.60038377    0.48173481    0.07224469    0.00595766    0.00017632    0.00077160
O   -1.99375622    1.26616236    0.05607549    0.02539829   -0.00700231   -0.00253826
O   -1.96081044   -1.34467779   -0.02735444   -0.01209136   -0.01964375    0.00345584
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C   -0.83053218   -0.77153802   -0.03909133    0.01419039   -0.00470705   -0.01397017
C    0.32555591    1.53835929   -0.04725545   -0.00636613   -0.02293135   -0.00471943
C    0.37338858   -1.53558197    0.01573134    0.02200774    0.02182867    0.00840475
C    1.76339001    1.31348029   -0.04860101    0.03957194    0.02913446   -0.00120317
C    1.68868357   -1.22983075    0.02812600   -0.00590849   -0.00789907   -0.00172458
H    0.03325155    2.60640683   -0.03944599   -0.00439025    0.00878251    0.00180339
H    0.14024163   -2.59617044   -0.01917941    0.00067957    0.00256539   -0.00166565
H    2.36248579    2.24474718   -0.13252118    0.00223206    0.01889412   -0.00374594
H    2.36054685   -2.06429901    0.01753427   -0.00709981    0.01016362   -0.00203696
C    2.31298755    0.01142312    0.03635869   -0.01860540   -0.05701250    0.00649485
H    3.39441581    0.00927629    0.05722788   -0.00609885    0.00397030    0.00018528
   15
   -420.53595157
H   -2.61460546    0.48109881    0.07185002   -0.00041538   -0.00489834    0.00075715
O   -1.99230518    1.26640146    0.05882721    0.03390983   -0.00337384   -0.00234988
O   -1.96086212   -1.34454087   -0.02605651   -0.01146581   -0.01937283    0.00384750
C   -0.81374663    0.72361479    0.02016914   -0.05718578    0.02274315    0.01022511
C   -0.82992034   -0.77175979   -0.04224843    0.01628745   -0.00387656   -0.01450127
C    0.32807400    1.53748228   -0.04894085   -0.00474769   -0.01851522   -0.00497058
C    0.37161681   -1.53680458    0.01733226    0.01970395    0.02351609    0.00936970
C    1.76534940    1.31476980   -0.04765937    0.04073328    0.03010833   -0.00129588
C    1.68678364   -1.22980603    0.02796743   -0.00879679   -0.01067017   -0.00212278
H    0.04679140    2.60097091   -0.03676813   -0.00197592    0.00478904    0.00184157
H    0.14939068   -2.60220379   -0.02101339    0.00171449    0.00052740   -0.00210290
H    2.36694737    2.24631300   -0.12259479    0.00285583    0.01926012   -0.00338102
H    2.36736146   -2.05632947    0.02295211   -0.00643588    0.01149046   -0.00181611
C    2.31371717    0.01186932    0.03617394   -0.01003186   -0.05831583    0.00662099
H    3.38389811    0.02859859    0.05760854   -0.01422813    0.00658815   -0.00013735
   15
   -420.53505402
H   -2.62876032    0.48133259    0.07132002   -0.00625001   -0.00912736    0.00068346
O   -1.99123732    1.26667935    0.06160551    0.04082654   -0.00028387   -0.00208082
O   -1.96078406   -1.34418436   -0.02480219   -0.01050617   -0.01892324    0.00419619
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C   -0.82955416   -0.77192307   -0.04518644    0.01788172   -0.00294739   -0.01489487
C    0.33066396    1.53688401   -0.05055123   -0.00315107   -0.01312816   -0.00511319
C    0.36954793   -1.53838233    0.01879159    0.01672943    0.02483441    0.01024443
C    1.76669291    1.31560346   -0.04669808    0.04190011    0.03159278   -0.00144748
C    1.68501747   -1.22962155    0.02784094   -0.01229910   -0.01215518   -0.00250480
H    0.06068560    2.59468555   -0.03442080    0.00063842   -0.00006943    0.00181521
H    0.15823014   -2.60833301   -0.02246950    0.00278623   -0.00142211   -0.00250939
H    2.37090396    2.24443063   -0.11206157    0.00286038    0.01829410   -0.00287668
H    2.37531846   -2.05040740    0.02869679   -0.00466397    0.01135358   -0.00158712
C    2.31459986    0.01319528    0.03588916   -0.00259677   -0.05801073    0.00667693
H    3.37592066    0.04674109    0.05801364   -0.02086237    0.00877261   -0.00043751
   15
   -420.53437629
H   -2.64180485    0.48318963    0.07066785   -0.01099875   -0.01205620    0.00054686
O   -1.99063051    1.26696128    0.06440734    0.04552263    0.00192286   -0.00172149
O   -1.96058705   -1.34361336   -0.02359544   -0.00927358   -0.01828867    0.00450308
C   -0.82037333    0.71995836    0.01149889   -0.06776718    0.01898443    0.00929521
C   -0.82945777   -0.77204190   -0.04789940    0.01896887   -0.00192707   -0.01515464
C    0.33330144    1.53648373   -0.05208442   -0.00142856   -0.00733546   -0.00514665
C    0.36722692   -1.54033479    0.02009619    0.01308032    0.02552100    0.01099858
C    1.76740304    1.31595897   -0.04571485    0.04296422    0.03347922   -0.00163156
C    1.68343769   -1.22925477    0.02775234   -0.01616544   -0.01241908   -0.00289026
H    0.07446471    2.58841681   -0.03239935    0.00326615   -0.00521794    0.00172674
H    0.16656832   -2.61421198   -0.02347458    0.00384941   -0.00300964   -0.00287392
H    2.37435468    2.23927256   -0.10101172    0.00226525    0.01607781   -0.00229317
H    2.38410156   -2.04651090    0.03472677   -0.00196486    0.00993177   -0.00132904
C    2.31552482    0.01539651    0.03550353    0.00237835   -0.05621127    0.00663674
H    3.37165877    0.06331007    0.05849657   -0.02472623    0.01055735   -0.00067692
   15
   -420.53412923
H   -2.65288971    0.48719574    0.06991745   -0.01429620   -0.01352997    0.00037530
O   -1.99053772    1.26722234    0.06722858    0.04764379    0.00310293   -0.00125786
O   -1.96028506   -1.34283507   -0.02243973   -0.00780540   -0.01745984    0.00476991
C   -0.82218656    0.71768409    0.00694920   -0.07044591    0.01609692    0.00862282
C   -0.82964755   -0.77213169   -0.05038338    0.01951393   -0.00083127   -0.01528855
C    0.33596013    1.53619477   -0.05353991    0.00060950   -0.00186283   -0.00508798
C    0.36470887   -1.54267215    0.02123464    0.00882287    0.02541712    0.01162766
C    1.76746385    1.31580804   -0.04470695    0.04378704    0.03555464   -0.00181691
C    1.68210229   -1.22870140    0.02770745   -0.02000141   -0.01172724   -0.00328813
H    0.08765874    2.58308130   -0.03068806    0.00569729   -0.00994113    0.00159190
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H    2.37740483    2.23123551   -0.08954954    0.00116874    0.01279362   -0.00167565
H    2.39322947   -2.04438877    0.04099539    0.00134581    0.00755707   -0.00102855
C    2.31641785    0.01844602    0.03501771    0.00405807   -0.05307342    0.00647336
H    3.37179653    0.07798308    0.05910007   -0.02503539    0.01201733   -0.00082910
   15
   -420.53444434
H   -2.66142477    0.49361560    0.06909988   -0.01590128   -0.01348510    0.00017405
O   -1.99098288    1.26744922    0.07006401    0.04699540    0.00318453   -0.00070685
O   -1.95989473   -1.34185888   -0.02133809   -0.00612747   -0.01644808    0.00499093
C   -0.82293684    0.71516722    0.00226932   -0.07134205    0.01257871    0.00779752
C   -0.83013168   -0.77220899   -0.05263635    0.01946755    0.00032259   -0.01530299
C    0.33860902    1.53593536   -0.05491855    0.00313267    0.00249573   -0.00496085
C    0.36205797   -1.54539266    0.02219746    0.00408191    0.02439076    0.01211486
C    1.76686312    1.31511967   -0.04367161    0.04419049    0.03750937   -0.00196977
C    1.68106862   -1.22797148    0.02771228   -0.02332247   -0.01043498   -0.00368833
H    0.09983295    2.57951774   -0.02926302    0.00772126   -0.01346731    0.00143514
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H    2.38024955    2.22090689   -0.07778557   -0.00027060    0.00872150   -0.00106220
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   15
   -420.53521471
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O   -1.95943507   -1.34069627   -0.02029302   -0.00425566   -0.01526268    0.00516466
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C    1.76559503    1.31386484   -0.04260657    0.04394584    0.03890252   -0.00205796
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   15
   -420.53630907
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O   -1.95892730   -1.33936068   -0.01930649   -0.00220473   -0.01394190    0.00528894
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C    0.34371494    1.53527155   -0.05745334    0.01000976    0.00545003   -0.00463165
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C    2.31889238    0.03211828    0.03299433   -0.00789231   -0.03636479    0.00518819
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   15
   -420.53750478
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O   -1.95839470   -1.33786703   -0.01837991    0.00003099   -0.01251106    0.00535446
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C   -0.83329536   -0.77254270   -0.05801536    0.01550461    0.00392485   -0.01470591
C    0.34606819    1.53482299   -0.05861442    0.01424519    0.00370816   -0.00447050
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C    1.76108625    1.30958992   -0.04038308    0.04054491    0.03801712   -0.00203278
C    1.68020301   -1.22492368    0.02808425   -0.02676302   -0.00654027   -0.00472906
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   15
   -420.53850836
H   -2.66922350    0.53902884    0.06584096   -0.00438903    0.00214876   -0.00032752
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O   -1.95786261   -1.33623153   -0.01751403    0.00244930   -0.01101022    0.00537101
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C    0.34820566    1.53432038   -0.05970788    0.01877391    0.00030939   -0.00431897
C    0.35162254   -1.55958637    0.02417542   -0.01667296    0.01156844    0.01275275
C    1.75789755    1.30658426   -0.03922497    0.03696308    0.03486739   -0.00195870
C    1.68071703   -1.22368661    0.02834482   -0.02519449   -0.00601844   -0.00493357
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C    2.32101488    0.04411491    0.03124225   -0.01964358   -0.01917151    0.00390086
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   15
   -420.53919550
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O   -1.95735847   -1.33447118   -0.01670903    0.00504513   -0.00947368    0.00533095
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C    0.35005925    1.53381427   -0.06073605    0.02332893   -0.00406824   -0.00416286
C    0.34944827   -1.56372019    0.02418950   -0.02134520    0.00696792    0.01263541
C    1.75415161    1.30305394   -0.03803725    0.03204966    0.02964393   -0.00189173
C    1.68161037   -1.22235786    0.02867985   -0.02228849   -0.00606161   -0.00502255
H    0.13630952    2.59765791   -0.02561267    0.00938238   -0.00202300    0.00114201
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H    2.42373467   -2.04346579    0.08017678    0.01313850   -0.00403632    0.00110231
C    2.32247764    0.05061549    0.03027276   -0.02384861   -0.00898190    0.00322633
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   15
   -420.53958808
H   -2.66545759    0.56296225    0.06448707    0.00773345    0.01542729   -0.00006984
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O   -1.95691169   -1.33260337   -0.01596445    0.00778972   -0.00794209    0.00523541
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C    0.35156045    1.53336988   -0.06170132    0.02761876   -0.00865819   -0.00398278
C    0.34759594   -1.56795928    0.02401269   -0.02537111    0.00232917    0.01242418
C    1.74992255    1.29907771   -0.03682085    0.02594582    0.02252634   -0.00188032
C    1.68283934   -1.22093676    0.02909066   -0.01820767   -0.00666996   -0.00497876
H    0.13832500    2.60552180   -0.02550395    0.00856049    0.00344690    0.00117411
H    0.19393801   -2.63901531   -0.00967259    0.00902994    0.00243503   -0.00366057
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H    2.42138953   -2.04193534    0.08636101    0.01182789   -0.00346310    0.00129364
C    2.32429892    0.05725100    0.02925445   -0.02634556    0.00194362    0.00257497
H    3.44173237    0.11275718    0.06695989    0.01780968    0.01193138    0.00005557
   15
   -420.53973907
H   -2.66510416    0.57137278    0.06384347    0.01200409    0.02025927    0.00013411
O   -2.00477093    1.26960306    0.08969189   -0.01790824   -0.02060530    0.00440559
O   -1.95655337   -1.33064545   -0.01527921    0.01063961   -0.00644412    0.00508588
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C   -0.84048005   -0.77388803   -0.06211856    0.00117613    0.00787193   -0.01266692
C    0.35264474    1.53305588   -0.06260645    0.03135872   -0.01281876   -0.00375252
C    0.34612627   -1.57223392    0.02364812   -0.02861697   -0.00202424    0.01213382
C    1.74530225    1.29476264   -0.03557592    0.01898116    0.01397272   -0.00195696
C    1.68434237   -1.21941422    0.02957656   -0.01315141   -0.00777389   -0.00478796
H    0.13879990    2.61277310   -0.02560643    0.00766977    0.00836228    0.00119459
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H    2.41692781   -2.03979401    0.09231365    0.00960986   -0.00205218    0.00138696
C    2.32651621    0.06385665    0.02819715   -0.02693335    0.01324835    0.00197451
H    3.44746224    0.10801065    0.06830477    0.01996144    0.01016802    0.00018310
   15
   -420.53980458
H   -2.66686972    0.57617777    0.06317644    0.01337771    0.02224664    0.00029510
O   -2.00695339    1.27048627    0.09236429   -0.02564861   -0.02073168    0.00524747
O   -1.95631577   -1.32861436   -0.01465161    0.01351731   -0.00501556    0.00488506
C   -0.79420549    0.69382639   -0.03788636   -0.02571790   -0.02173718   -0.00363838
C   -0.84247679   -0.77448904   -0.06264342   -0.00365847    0.00843568   -0.01195717
C    0.35325584    1.53293457   -0.06345492    0.03432583   -0.01606338   -0.00346756
C    0.34508818   -1.57647866    0.02310018   -0.03095511   -0.00582288    0.01176632
C    1.74039551    1.29023723   -0.03430129    0.01157974    0.00465409   -0.00212544
C    1.68604340   -1.21777366    0.03013467   -0.00743961   -0.00923686   -0.00445625
H    0.13789308    2.61853456   -0.02592348    0.00683053    0.01220556    0.00117934
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H    2.41717960    2.13666803    0.01578118    0.00468605   -0.00564574    0.00266624
H    2.41074535   -2.03729391    0.09801793    0.00664140    0.00001028    0.00138135
C    2.32913831    0.07026201    0.02710990   -0.02551111    0.02451616    0.00144943
H    3.44962937    0.10143753    0.06961757    0.01997086    0.00813407    0.00024978
   15
   -420.53990036
H   -2.67099380    0.57702830    0.06245830    0.01131426    0.02083866    0.00034732
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O   -1.95623143   -1.32652632   -0.01407937    0.01631620   -0.00368117    0.00464477
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C   -0.84441793   -0.77521733   -0.06298756   -0.00872189    0.00876572   -0.01117795
C    0.35334912    1.53305458   -0.06425104    0.03632684   -0.01806892   -0.00311823
C    0.34451697   -1.58063632    0.02237443   -0.03232057   -0.00887770    0.01131984
C    1.73531358    1.28564152   -0.03299442    0.00423772   -0.00471431   -0.00237350
C    1.68785658   -1.21599336    0.03075999   -0.00144943   -0.01076369   -0.00399719
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H    2.42198533    2.13095564    0.02619380    0.00786525   -0.00391336    0.00321812
H    2.40337408   -2.03480197    0.10347498    0.00318116    0.00247191    0.00128123
C    2.33214361    0.07629731    0.02600061   -0.02201138    0.03528211    0.00102533
H    3.44823255    0.09340242    0.07088645    0.01782402    0.00593932    0.00024364
   15
   -420.53989688
H   -2.67711151    0.57417213    0.06168050    0.00625607    0.01643461    0.00024069
O   -2.01040976    1.27291388    0.09751911   -0.03027052   -0.01156514    0.00733437
O   -1.95633199   -1.32439642   -0.01355979    0.01890632   -0.00247021    0.00437278
C   -0.78073448    0.69055273   -0.04786911   -0.00609648   -0.02568742   -0.00714218
C   -0.84622717   -0.77607784   -0.06316276   -0.01381050    0.00883769   -0.01033690
C    0.35289447    1.53344607   -0.06500010    0.03722915   -0.01867551   -0.00270756
C    0.34443322   -1.58466073    0.02147764   -0.03266392   -0.01114128    0.01077953
C    1.73016695    1.28111630   -0.03165160   -0.00262247   -0.01344419   -0.00266561
C    1.68969188   -1.21405069    0.03144564    0.00437566   -0.01199848   -0.00344567
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H    2.42537940    2.12595007    0.03602738    0.01073257   -0.00236202    0.00375428
H    2.39543141   -2.03275606    0.10870240   -0.00038806    0.00498048    0.00111539
C    2.33547920    0.08180030    0.02487568   -0.01645117    0.04509421    0.00072060
H    3.44365757    0.08429864    0.07211289    0.01359262    0.00370816    0.00014792
   15
   -420.53964385
H   -2.68432971    0.56838451    0.06086146   -0.00058768    0.01017843    0.00000137
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O   -1.95664669   -1.32223837   -0.01308980    0.02114006   -0.00142195    0.00407868
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C    0.35187837    1.53411816   -0.06570828    0.03694554   -0.01782530   -0.00224430
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C    1.72505902    1.27679291   -0.03026848   -0.00869741   -0.02098864   -0.00295802
C    1.69146179   -1.21192747    0.03218331    0.00956122   -0.01252215   -0.00284851
H    0.12828496    2.62132083   -0.02809587    0.00516076    0.01454774    0.00084526
H    0.16328097   -2.65747009    0.02007932    0.00413663    0.00122477   -0.00292468
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H    2.38755452   -2.03160149    0.11372870   -0.00365738    0.00711049    0.00093395
C    2.33906122    0.08662317    0.02373969   -0.00899475    0.05352364    0.00054769
H    3.43666191    0.07452609    0.07331399    0.00753914    0.00155955   -0.00003985
   15
   -420.53901268
H   -2.69143710    0.56077060    0.06004326   -0.00777028    0.00343014   -0.00031553
O   -2.01252739    1.27584094    0.10233960   -0.02582414    0.00421397    0.00980780
O   -1.95720076   -1.32006398   -0.01266607    0.02287266   -0.00057572    0.00377113
C   -0.76689452    0.68881433   -0.05742059    0.01349360   -0.02600802   -0.01050964
C   -0.84914626   -0.77819633   -0.06305808   -0.02315898    0.00826859   -0.00849433
C    0.35030510    1.53505805   -0.06638258    0.03546825   -0.01555389   -0.00173632
C    0.34573465   -1.59218437    0.01920513   -0.03053297   -0.01352203    0.00939140
C    1.72008139    1.27278496   -0.02884070   -0.01377526   -0.02696781   -0.00320184
C    1.69308846   -1.20961630    0.03296409    0.01366274   -0.01190136   -0.00228709
H    0.12311819    2.61694958   -0.02915991    0.00502108    0.01203692    0.00062470
H    0.15394934   -2.66260080    0.02774494    0.00234928   -0.00079639   -0.00263218
H    2.42600420    2.11704285    0.05358278    0.01432810   -0.00084424    0.00463128
H    2.38032568   -2.03171522    0.11858636   -0.00621927    0.00842349    0.00077618
C    2.34277740    0.09063888    0.02259526   -0.00005001    0.06022506    0.00050237
H    3.42832880    0.06447040    0.07452336    0.00013832   -0.00041007   -0.00031188
   15
   -420.53802096
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O   -1.95801368   -1.31788283   -0.01228512    0.02395783    0.00003828    0.00346446
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C   -0.85011532   -0.77944573   -0.06280603   -0.02697267    0.00767535   -0.00751037
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   15
   -420.53685579
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O   -1.95909768   -1.31570187   -0.01194348    0.02428276    0.00038592    0.00316901
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   15
   -420.53577402
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O   -1.96045632   -1.31352506   -0.01163781    0.02375207    0.00046774    0.00288898
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C   -0.85078826   -0.78228120   -0.06197662   -0.03193931    0.00611613   -0.00547122
C    0.34255032    1.53905314   -0.06828035    0.02465763   -0.00258748   -0.00014348
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   15
   -420.53503667
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O   -1.96208358   -1.31135330   -0.01136493    0.02233914    0.00027092    0.00263094
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C    1.70274878    1.26130425   -0.02263222   -0.02266883   -0.03303819   -0.00302432
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   15
   -420.53472767
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O   -1.96396346   -1.30918438   -0.01112192    0.02006259   -0.00017722    0.00239703
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C   -0.84955106   -0.78548576   -0.06081648   -0.03264553    0.00436563   -0.00339338
C    0.33542399    1.54203596   -0.06952037    0.01425040    0.00576136    0.00071809
C    0.35627938   -1.60730900    0.01129640   -0.01408124   -0.01655987    0.00420257
C    1.69922817    1.25968636   -0.02095911   -0.02231750   -0.03069085   -0.00259868
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   15
   -420.53486233
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O   -1.96607019   -1.30701322   -0.01090612    0.01698870   -0.00084977    0.00218772
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C    0.35925460   -1.60962980    0.00945582   -0.01008039   -0.01798165    0.00303480
C    1.69604415    1.25853138   -0.01924682   -0.02131971   -0.02742148   -0.00205219
C    1.69789301   -1.19386598    0.03818322    0.01044170    0.01838432   -0.00102029
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H    2.36352775   -2.05755063    0.14447203   -0.00253023   -0.00509675    0.00186128
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   15
   -420.53524042
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C   -0.73158255    0.69337165   -0.08469322    0.06339417   -0.00547496   -0.01953105
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C    0.36238234   -1.61167833    0.00756934   -0.00615110   -0.01974345    0.00188757
C    1.69318205    1.25779046   -0.01750359   -0.02000431   -0.02370685   -0.00142530
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H    0.09605043   -2.67638886    0.09035187   -0.00932927   -0.00686635    0.00062865
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C    2.36213297    0.09135962    0.01435963    0.02551352    0.05505182   -0.00088969
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   15
   -420.53562898
H   -2.64760318    0.53294953    0.05908303   -0.00269400    0.00212655   -0.00071181
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C   -0.72968721    0.69480129   -0.08754234    0.06651907   -0.00159886   -0.02038623
C   -0.84409356   -0.79075483   -0.05873022   -0.02575157    0.00176506   -0.00033278
C    0.32330516    1.54587766   -0.07146756    0.00005735    0.00462554    0.00121015
C    0.36560322   -1.61342797    0.00565426   -0.00235472   -0.02178670    0.00079318
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C    1.69790272   -1.18981277    0.04005826    0.00451533    0.02979076   -0.00092540
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C    2.36324986    0.08769600    0.01318314    0.01990010    0.04830803   -0.00169089
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   15
   -420.53585645
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O   -1.97336676   -1.30040292   -0.01039915    0.00431548   -0.00355921    0.00165441
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C   -0.84143700   -0.79258193   -0.05800435   -0.02177389    0.00089273    0.00063973
C    0.31917493    1.54698174   -0.07215150   -0.00345682    0.00027476    0.00114185
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   15
   -420.53598313
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O   -1.97596504   -1.29813310   -0.01027024   -0.00044514   -0.00450855    0.00149308
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C   -0.83845187   -0.79442247   -0.05728810   -0.01725608   -0.00001307    0.00157364
C    0.31509623    1.54808279   -0.07285262   -0.00635363   -0.00500164    0.00099474
C    0.37209762   -1.61590632    0.00180338    0.00469801   -0.02599594   -0.00118003
C    1.68633794    1.25750841   -0.01218387   -0.01713172   -0.01471663    0.00044188
C    1.69763404   -1.18753698    0.04198773   -0.00041523    0.03640159   -0.00050373
H    0.02035018    2.58648127   -0.03785003   -0.00154697   -0.00607156   -0.00098995
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H    2.36547047   -2.06567176    0.15586350    0.00149857   -0.01156284    0.00234290
C    2.36466512    0.07830039    0.01091956    0.00949214    0.03165120   -0.00332492
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   15
   -420.53611547
H   -2.60257137    0.53080648    0.06144244    0.01575993    0.01713311   -0.00012281
O   -2.00268527    1.28058330    0.11871313   -0.05034686    0.00025191    0.01541600
O   -1.97855831   -1.29581221   -0.01015826   -0.00515039   -0.00537905    0.00133315
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C   -0.83520624   -0.79626275   -0.05659559   -0.01239568   -0.00097553    0.00246239
C    0.31111298    1.54925945   -0.07356870   -0.00874680   -0.01027851    0.00079374
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C    1.69749113   -1.18720233    0.04296567   -0.00227355    0.03745118   -0.00012895
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   15
   -420.53640257
H   -2.59196711    0.52491545    0.06230133    0.01739428    0.01722908   -0.00031806
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O   -1.98109339   -1.29343040   -0.01006140   -0.00961712   -0.00613121    0.00117132
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C   -0.83177338   -0.79808818   -0.05594024   -0.00738349   -0.00200790    0.00329041
C    0.30726151    1.55059052   -0.07429675   -0.01077140   -0.01473601    0.00056989
C    0.37831150   -1.61681979   -0.00197756    0.01103208   -0.02871627   -0.00288929
C    1.68309711    1.25851857   -0.00865442   -0.01694190   -0.01315465    0.00146870
C    1.69738208   -1.18743203    0.04394543   -0.00370683    0.03693770    0.00036033
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H    2.28823103    2.14645206    0.09237245   -0.00619762   -0.00599690    0.00253200
H    2.36537384   -2.05808627    0.15908026   -0.00008245   -0.00821147    0.00179433
C    2.36547835    0.06700365    0.00885521    0.00449234    0.01239586   -0.00460311
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   15
   -420.53690072
H   -2.58445063    0.51597069    0.06322187    0.01609229    0.01400803   -0.00076329
O   -1.99514255    1.27982829    0.11947919   -0.04288559    0.00467889    0.01593014
O   -1.98351972   -1.29097917   -0.00997780   -0.01370517   -0.00673558    0.00099839
C   -0.73550688    0.70132956   -0.09696682    0.06132005    0.01155238   -0.02294601
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   15
   -420.53747416
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O   -1.98579104   -1.28845170   -0.00990552   -0.01729472   -0.00716588    0.00082199
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C    0.38386128   -1.61601478   -0.00558393    0.01672341   -0.02781650   -0.00456579
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C    1.69734692   -1.18953166    0.04587926   -0.00557504    0.03170523    0.00161036
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H    2.36545460   -2.04480985    0.16103015   -0.00362245   -0.00122842    0.00080786
C    2.36598324    0.05495820    0.00706624    0.00675309   -0.00707379   -0.00527984
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   15
   -420.53796286
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O   -1.98786671   -1.28584311   -0.00984254   -0.02031472   -0.00741924    0.00063687
C   -0.74457569    0.70294609   -0.09835123    0.04865901    0.01292610   -0.02300633
C   -0.82110484   -0.80331279   -0.05431664    0.00713581   -0.00562745    0.00530074
C    0.29678701    1.55606423   -0.07651906   -0.01559256   -0.01823615   -0.00007371
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C    1.68014388    1.26155735   -0.00354782   -0.01530216   -0.01425789    0.00322783
C    1.69744945   -1.19132320    0.04681447   -0.00632312    0.02757727    0.00231818
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H    3.47397513    0.02970763    0.09996988    0.01739645   -0.00318737    0.00232861
   15
   -420.53817585
H   -2.57640049    0.47848752    0.06723725    0.00315898   -0.00539295   -0.00246482
O   -1.98049172    1.27805811    0.11926437   -0.01448326    0.02475596    0.01648714
O   -1.98971248   -1.28315055   -0.00978678   -0.02273378   -0.00746869    0.00044537
C   -0.75026459    0.70346525   -0.09852160    0.04002426    0.01292575   -0.02274903
C   -0.81766904   -0.80490964   -0.05392334    0.01150845   -0.00699991    0.00577434
C    0.29373657    1.55844067   -0.07726175   -0.01696556   -0.01551362   -0.00025425
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C    1.67963923    1.26299331   -0.00193042   -0.01350744   -0.01410771    0.00400659
C    1.69764779   -1.19353120    0.04771470   -0.00724209    0.02303848    0.00299358
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H    2.36816179   -2.03071210    0.16240118   -0.00740216    0.00674322   -0.00025047
C    2.36604386    0.04333010    0.00559315    0.01605709   -0.02449143   -0.00528513
H    3.46547623    0.03707121    0.09985200    0.01228574   -0.00162340    0.00197241
   15
   -420.53812223
H   -2.57598637    0.46628763    0.06933168   -0.00091963   -0.01097892   -0.00282311
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O   -1.99130092   -1.28037346   -0.00973607   -0.02455211   -0.00731319    0.00025243
C   -0.75655678    0.70378939   -0.09834828    0.02989064    0.01259842   -0.02226182
C   -0.81440689   -0.80640061   -0.05361722    0.01558896   -0.00842937    0.00613705
C    0.29094255    1.56104941   -0.07800060   -0.01827256   -0.01094439   -0.00041509
C    0.39020641   -1.61179355   -0.01043840    0.02320632   -0.01778324   -0.00750071
C    1.67933789    1.26464170   -0.00037372   -0.01095787   -0.01323350    0.00490227
C    1.69795606   -1.19608769    0.04856978   -0.00858889    0.01862248    0.00356819
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C    2.36574876    0.03800691    0.00497680    0.02269367   -0.03187871   -0.00507533
H    3.45478788    0.04472837    0.09938129    0.00567370   -0.00015030    0.00146675
   15
   -420.53778974
H   -2.57542041    0.45603791    0.07193195   -0.00391461   -0.01491347   -0.00301540
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O   -1.99261139   -1.27751358   -0.00968821   -0.02578896   -0.00694039    0.00006118
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C    0.28842469    1.56382168   -0.07873319   -0.01951297   -0.00478460   -0.00056165
C    0.39165840   -1.60976730   -0.01185038    0.02437236   -0.01271855   -0.00856302
C    1.67920139    1.26648909    0.00110874   -0.00771732   -0.01148018    0.00589621
C    1.69839490   -1.19892651    0.04937089   -0.01055191    0.01482464    0.00403877
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H    2.37605274   -2.02130364    0.16392900   -0.00878284    0.01193474   -0.00089082
C    2.36510993    0.03316437    0.00443709    0.02985377   -0.03817359   -0.00478592
H    3.44309078    0.05241485    0.09864791   -0.00177963    0.00116566    0.00087173
   15
   -420.53725226
H   -2.57416852    0.44844829    0.07507197   -0.00558842   -0.01714380   -0.00301871
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O   -1.99362982   -1.27457521   -0.00964106   -0.02648477   -0.00632301   -0.00012210
C   -0.77031750    0.70387461   -0.09700416    0.00556950    0.01151515   -0.02048852
C   -0.80864523   -0.80897805   -0.05328654    0.02273552   -0.01136156    0.00649841
C    0.28620175    1.56666483   -0.07945729   -0.02066799    0.00255472   -0.00070492
C    0.39274279   -1.60754915   -0.01313289    0.02481031   -0.00733239   -0.00960430
C    1.67918087    1.26850895    0.00250197   -0.00390306   -0.00881006    0.00695841
C    1.69899419   -1.20199057    0.05011113   -0.01320066    0.01195802    0.00431779
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H    2.23331042    2.22464117    0.07865849   -0.00574463    0.01618197    0.00155753
H    2.38232908   -2.01961019    0.16490795   -0.00794740    0.01253396   -0.00090600
C    2.36402031    0.02889761    0.00396974    0.03655231   -0.04331144   -0.00450109
H    3.43171248    0.05989506    0.09775778   -0.00911116    0.00226964    0.00027112
   15
   -420.53657314
H   -2.57193008    0.44392148    0.07875337   -0.00591329   -0.01773276   -0.00288530
O   -1.95919718    1.27171417    0.11642496    0.02454153    0.03318744    0.01302408
O   -1.99434828   -1.27156535   -0.00959253   -0.02667560   -0.00545584   -0.00029118
C   -0.77741882    0.70365173   -0.09586019   -0.00822215    0.01101649   -0.01918199
C   -0.80625366   -0.81002025   -0.05326745    0.02571886   -0.01279808    0.00649909
C    0.28429112    1.56946864   -0.08017072   -0.02167109    0.01048570   -0.00086072
C    0.39345304   -1.60522006   -0.01427031    0.02443419   -0.00201639   -0.01055686
C    1.67921885    1.27066093    0.00378996    0.00031826   -0.00524531    0.00805608
C    1.69979376   -1.20523674    0.05078629   -0.01637173    0.01013986    0.00442478
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H    2.22894153    2.22674492    0.07518862   -0.00712301    0.01528510    0.00112409
H    2.39002068   -2.02015267    0.16604693   -0.00601032    0.01172975   -0.00071398
C    2.36237994    0.02528435    0.00357057    0.04165213   -0.04729854   -0.00431722
H    3.42195573    0.06697015    0.09681742   -0.01516213    0.00317618   -0.00022820
   15
   -420.53588154
H   -2.56864568    0.44256539    0.08295262   -0.00495936   -0.01681437   -0.00264780
O   -1.95430575    1.26919046    0.11531213    0.03289234    0.02995134    0.01137559
O   -1.99476459   -1.26849384   -0.00954071   -0.02639523   -0.00432929   -0.00044226
C   -0.78439500    0.70326209   -0.09442652   -0.02269038    0.01067298   -0.01761233
C   -0.80425033   -0.81086903   -0.05334650    0.02822543   -0.01417083    0.00638565
C    0.28270781    1.57211411   -0.08087108   -0.02239756    0.01824200   -0.00105150
C    0.39379491   -1.60285999   -0.01524829    0.02318507    0.00288897   -0.01136059
C    1.67925177    1.27289126    0.00495613    0.00473088   -0.00089928    0.00914906
C    1.70084110   -1.20863733    0.05139475   -0.01974258    0.00921582    0.00438633
H   -0.04274137    2.60037872   -0.03357526   -0.00567488   -0.00760218   -0.00022919
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H    2.22585920    2.22611280    0.07151670   -0.00878606    0.01329254    0.00066346
H    2.39878171   -2.02278944    0.16731166   -0.00320710    0.00973874   -0.00034442
C    2.36011310    0.02238492    0.00323692    0.04403611   -0.05019152   -0.00433234
H    3.41489376    0.07347569    0.09591461   -0.01882119    0.00392753   -0.00052674
   15
   -420.53526832
H   -2.56448583    0.44421717    0.08762756   -0.00283777   -0.01455178   -0.00234243
O   -1.94978675    1.26632871    0.11407046    0.04049402    0.02483779    0.00952586
O   -1.99488188   -1.26537341   -0.00948390   -0.02566880   -0.00296594   -0.00056932
C   -0.79102781    0.70271084   -0.09272683   -0.03739682    0.01053235   -0.01582092
C   -0.80267308   -0.81150364   -0.05352196    0.03018320   -0.01545632    0.00616119
C    0.28146261    1.57448505   -0.08155548   -0.02269081    0.02494760   -0.00130777
C    0.39378728   -1.60054275   -0.01605473    0.02107456    0.00709411   -0.01197520
C    1.67921324    1.27513450    0.00598404    0.00907735    0.00401514    0.01018964
C    1.70218665   -1.21217797    0.05193699   -0.02286770    0.00886168    0.00426097
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C    2.35718464    0.02024309    0.00296908    0.04299865   -0.05204207   -0.00460435
H    3.41117500    0.07927493    0.09510243   -0.01938298    0.00460464   -0.00056446
   15
   -420.53476449
H   -2.55982995    0.44847141    0.09272348    0.00029883   -0.01110474   -0.00199252
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O   -1.99470841   -1.26221956   -0.00942066   -0.02450484   -0.00137417   -0.00066921
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C   -0.80155138   -0.81190470   -0.05379046    0.03148064   -0.01661792    0.00583752
C    0.28055977    1.57648113   -0.08221998   -0.02239754    0.02972856   -0.00166093
C    0.39346197   -1.59833166   -0.01668039    0.01817179    0.01039214   -0.01236393
C    1.67903787    1.27731680    0.00685800    0.01307484    0.00913024    0.01113065
C    1.70387709   -1.21585282    0.05241487   -0.02529276    0.00867776    0.00411186
H   -0.03437610    2.59683815   -0.03239383   -0.00253846   -0.01468339   -0.00027298
H    0.21987052   -2.66420708    0.18360118    0.00344349   -0.00605999    0.00716128
H    2.22476709    2.21821662    0.06389601   -0.01233483    0.00706914   -0.00021284
H    2.41742136   -2.03279410    0.16993592    0.00351258    0.00383722    0.00068114
C    2.35361025    0.01888694    0.00277117    0.03853229   -0.05290802   -0.00512900
H    3.41089973    0.08424609    0.09438794   -0.01678834    0.00522751   -0.00033548
   15
   -420.53437361
H   -2.55523888    0.45471154    0.09817788    0.00417911   -0.00671537   -0.00162900
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O   -1.99425736   -1.25905029   -0.00934986   -0.02290566    0.00041255   -0.00073742
C   -0.80238130    0.70112926   -0.08863973   -0.06525460    0.01074580   -0.01186634
C   -0.80090476   -0.81205468   -0.05414711    0.03202261   -0.01762709    0.00542217
C    0.27999460    1.57803079   -0.08285923   -0.02139893    0.03196822   -0.00213169
C    0.39286273   -1.59627648   -0.01711938    0.01459412    0.01267685   -0.01251470
C    1.67866563    1.27936130    0.00756383    0.01639723    0.01401554    0.01193896
C    1.70594862   -1.21965858    0.05283050   -0.02662432    0.00826054    0.00401106
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H    0.23308461   -2.66405295    0.18203751    0.00551594   -0.00592926    0.00713968
H    2.22738897    2.21206287    0.06010436   -0.01376502    0.00361581   -0.00056194
H    2.42610316   -2.03911175    0.17111262    0.00658216    0.00079426    0.00120731
C    2.34945666    0.01832956    0.00265104    0.03129473   -0.05277095   -0.00584235
H    3.41360970    0.08827780    0.09373088   -0.01164254    0.00576708    0.00009738
   15
   -420.53407691
H   -2.55140518    0.46215245    0.10392597    0.00839581   -0.00175325   -0.00127722
O   -1.93926797    1.25637989    0.10978590    0.05675792    0.00151206    0.00380170
O   -1.99354688   -1.25588583   -0.00927072   -0.02086570    0.00234764   -0.00077915
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C   -0.80074126   -0.81193837   -0.05458564    0.03169346   -0.01845562    0.00492704
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   15
   -420.53389490
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   15
   -420.53384803
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   15
   -420.53413101
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H    2.44543606   -2.06184244    0.17295567    0.01097965   -0.00505826    0.00228995
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   15
   -420.53478110
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C    0.28141926    1.57924717   -0.08537348   -0.01041475    0.01088719   -0.00560879
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C    1.67272082    1.28549261    0.00824122    0.01379745    0.01995966    0.01320399
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H    2.44543028   -2.06557144    0.17245587    0.00965238   -0.00438220    0.00222304
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   15
   -420.53578995
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O   -1.98708054   -1.24093449   -0.00874370   -0.00476694    0.01275970   -0.00062192
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C    0.38689798   -1.58814878   -0.01594139   -0.01048712    0.00987479   -0.00938166
C    1.67076962    1.28577357    0.00777974    0.00928317    0.01692491    0.01297068
C    1.72598912   -1.24415509    0.05400741   -0.00485815   -0.01014941    0.00539102
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C    2.31928302    0.03043130    0.00417197   -0.01361920   -0.02779190   -0.00905219
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   15
   -420.53700564
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C   -0.80858351   -0.80520075   -0.05845249    0.00938178   -0.01806403    0.00080014
C    0.28334728    1.57795882   -0.08586393   -0.00711716   -0.00013921   -0.00670473
C    0.38610604   -1.58741873   -0.01518508   -0.01349148    0.00904530   -0.00856891
C    1.66867890    1.28579936    0.00712227    0.00407253    0.01328412    0.01263635
C    1.73008187   -1.24808136    0.05395117    0.00276996   -0.01570359    0.00586445
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H    2.44063465   -2.07096015    0.17029618    0.00463161   -0.00081591    0.00173947
C    2.31445544    0.03443326    0.00487612   -0.01583532   -0.02011120   -0.00898100
H    3.42814453    0.08667867    0.08389843    0.01791832    0.00286967    0.00196225
   15
   -420.53823650
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O   -1.93775444    1.23573618    0.09883197    0.05862546   -0.01741209   -0.00124279
O   -1.98383139   -1.23580043   -0.00847947    0.00302988    0.01655184   -0.00039847
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C   -0.81083340   -0.80307991   -0.05920567    0.00301636   -0.01699553   -0.00002848
C    0.28448412    1.57727762   -0.08596099   -0.00615398   -0.00397703   -0.00706938
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C    1.66652692    1.28562444    0.00627384   -0.00139355    0.00953114    0.01222571
C    1.73413234   -1.25177012    0.05380628    0.01073519   -0.02130000    0.00630621
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H    2.43674217   -2.07325450    0.16872170    0.00143281    0.00158140    0.00141183
C    2.30986501    0.03873869    0.00571583   -0.01616708   -0.01192784   -0.00872626
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   15
   -420.53934994
H   -2.60152576    0.48600477    0.15234815   -0.00368801    0.00034182    0.00314843
O   -1.94028562    1.23367257    0.09729713    0.05543131   -0.01317464   -0.00119487
O   -1.98223617   -1.23350435   -0.00833991    0.00666739    0.01821986   -0.00023632
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C   -0.81312863   -0.80070243   -0.05995836   -0.00356221   -0.01565018   -0.00089797
C    0.28571439    1.57665478   -0.08595136   -0.00561874   -0.00637199   -0.00729120
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C    1.66439578    1.28530504    0.00524061   -0.00669779    0.00607206    0.01176344
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C    2.30551685    0.04322420    0.00668729   -0.01474185   -0.00351372   -0.00830717
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   15
   -420.54017493
H   -2.61358726    0.48400406    0.15723963   -0.00924394   -0.00293870    0.00395631
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C   -0.81537006   -0.79808868   -0.06069743   -0.01008466   -0.01402195   -0.00180876
C    0.28703011    1.57612645   -0.08583164   -0.00553271   -0.00724764   -0.00737809
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C    1.66236529    1.28489311    0.00402959   -0.01150935    0.00320414    0.01126064
C    1.74162934   -1.25810644    0.05322589    0.02569537   -0.03053750    0.00681865
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H    2.42875569   -2.07910018    0.16486877   -0.00453825    0.00564873    0.00083701
C    2.30138972    0.04776288    0.00778419   -0.01182010    0.00485489   -0.00775512
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   15
   -420.54060529
H   -2.62400221    0.48251952    0.16141992   -0.01363114   -0.00531572    0.00466074
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O   -1.97930795   -1.22954819   -0.00805514    0.01254461    0.02087353    0.00021834
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C   -0.81745941   -0.79526322   -0.06140911   -0.01628131   -0.01212951   -0.00276115
C    0.28842992    1.57570588   -0.08560050   -0.00581805   -0.00661414   -0.00734300
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C    1.66050787    1.28443176    0.00264833   -0.01554043    0.00111555    0.01073502
C    1.74485092   -1.26061559    0.05278283    0.03167617   -0.03313293    0.00675776
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H    2.42572388   -2.08337156    0.16269161   -0.00648144    0.00646395    0.00071100
C    2.29744008    0.05222856    0.00899824   -0.00788614    0.01291569   -0.00711223
H    3.38258860    0.07175567    0.07140921   -0.00150179   -0.00279672    0.00021168
   15
   -420.54067543
H   -2.63198573    0.48197451    0.16476459   -0.01646038   -0.00649320    0.00513964
O   -1.95141660    1.22820412    0.09276601    0.03712388   -0.00355869   -0.00048587
O   -1.97804132   -1.22791811   -0.00791512    0.01446437    0.02174423    0.00052177
C   -0.77002742    0.68136249   -0.05455276   -0.01835500   -0.01267226   -0.00476938
C   -0.81930331   -0.79225468   -0.06207899   -0.02190134   -0.00996468   -0.00376011
C    0.28991795    1.57538362   -0.08525847   -0.00635372   -0.00462562   -0.00720187
C    0.38570524   -1.58596015   -0.00970845   -0.01686802    0.01501598   -0.00415232
C    1.65888425    1.28395253    0.00110479   -0.01859164   -0.00013801    0.01018803
C    1.74759538   -1.26262610    0.05223794    0.03614072   -0.03388290    0.00644160
H    0.04986052    2.64514405   -0.03683628    0.00489701    0.00786427    0.00175142
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H    2.38214699    2.12513094    0.02493431    0.01498894    0.00470446    0.00027603
H    2.42384191   -2.08878974    0.16038440   -0.00736308    0.00603854    0.00074464
C    2.29360932    0.05649958    0.01031979   -0.00366941    0.02044785   -0.00643131
H    3.36907861    0.06864925    0.06796204   -0.00861051   -0.00399148   -0.00030789
   15
   -420.54042649
H   -2.63703199    0.48257860    0.16718725   -0.01748804   -0.00629305    0.00537598
O   -1.95607542    1.22650170    0.09127116    0.02827693   -0.00279173   -0.00003548
O   -1.97693799   -1.22653435   -0.00778107    0.01554477    0.02225197    0.00087329
C   -0.76137480    0.67987790   -0.05126159   -0.00388060   -0.01545630   -0.00485965
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   15
   -420.53987598
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   15
   -420.53916559
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   15
   -420.53829552
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   15
   -420.53734647
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   15
   -420.53636131
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   15
   -420.53550201
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   15
   -420.53487582
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   15
   -420.53461103
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   15
   -420.53467265
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   15
   -420.53497511
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O   -1.97293891   -1.22534673   -0.00781395   -0.01083792    0.00925840    0.00501603
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   15
   -420.53541079
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O   -1.97254214   -1.22615244   -0.00806191   -0.01427276    0.00726989    0.00521264
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H    2.43690402   -2.10226050    0.10857153    0.00029230   -0.00706343    0.00164213
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   15
   -420.53593231
H   -2.59969085    0.41780875    0.13993333   -0.00772629   -0.00262018    0.00360267
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O   -1.97198380   -1.22704068   -0.00836894   -0.01734830    0.00534047    0.00534250
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C   -0.80180256   -0.75498156   -0.05955622   -0.01431881    0.02392951   -0.01682355
C    0.31698928    1.57288984   -0.07229741    0.01423742   -0.03033806   -0.00328989
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C    1.66296163    1.27608047   -0.02962400   -0.01926029   -0.01262967    0.00120085
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   15
   -420.53651264
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   15
   -420.53721372
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   15
   -420.53802159
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   15
   -420.53890429
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   15
   -420.53978654
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   15
   -420.54055311
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O   -1.96362573   -1.23296693   -0.01149023   -0.02659121   -0.00337235    0.00505928
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C    0.32348304    1.58617848   -0.06273294    0.01997417    0.00164713   -0.00193716
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   15
   -420.54112103
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   15
   -420.54148020
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   15
   -420.54166489
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   15
   -420.54168230
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O   -1.95230782   -1.23640330   -0.01472448   -0.02219248   -0.00467974    0.00410651
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C   -0.76257324   -0.75801057   -0.03177108    0.03269724    0.00987854   -0.01369273
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C    2.28029921    0.02214427    0.05033576    0.00273504   -0.03508710    0.00765187
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   15
   -420.54153853
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C    2.28267901    0.01982976    0.05152403   -0.00179971   -0.03771707    0.00793845
H    3.36053334    0.09808494    0.05957803   -0.00611805    0.01009317   -0.00135982
   15
   -420.54130279
H   -2.48589905    0.33577378    0.03723391    0.01937213    0.00677276   -0.00035541
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O   -1.94507532   -1.23781162   -0.01663258   -0.01580031   -0.00393682    0.00341896
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C   -0.75843379   -0.76161795   -0.02338996    0.03811038    0.00267931   -0.01133540
C    0.31956488    1.59924596   -0.05207677    0.01626832    0.01825131   -0.00073954
C    0.36832125   -1.62247902   -0.00459459    0.00188973    0.00354711    0.00775913
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   15
   -420.54098173
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O   -1.94117099   -1.23844637   -0.01764679   -0.01148471   -0.00328218    0.00304753
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   15
   -420.54055705
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O   -1.93713702   -1.23904408   -0.01869555   -0.00647899   -0.00244074    0.00266902
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   15
   -420.54003392
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O   -1.93303011   -1.23961424   -0.01977460   -0.00085965   -0.00142487    0.00229172
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C   -0.75654009   -0.76719446   -0.00958553    0.03815763   -0.00805429   -0.00725743
C    0.31422353    1.60216243   -0.04654142    0.01255510    0.00083333    0.00152209
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C    1.70358302    1.28732051   -0.06681206    0.02565151    0.01683118   -0.01050910
C    1.67486965   -1.24557494    0.02931208   -0.02385017    0.00733866    0.00044972
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H    2.44559680   -2.03210432   -0.00253107    0.01170688    0.00169914   -0.00250539
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   15
   -420.53937989
H   -2.50041443    0.31498041   -0.00136393    0.00959310   -0.00285388   -0.00216556
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C    0.31203024    1.60298678   -0.04472633    0.00979095   -0.00453342    0.00229623
C    0.35175003   -1.62655241   -0.01250532   -0.02562002   -0.00258660    0.00200785
C    1.70459976    1.28744678   -0.06841268    0.02331272    0.01478700   -0.01073155
C    1.67312050   -1.24529581    0.02864282   -0.02014034    0.00408977    0.00063967
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   15
   -420.53862443
H   -2.50998929    0.30957311   -0.01028035    0.00504532   -0.00650490   -0.00281281
O   -1.99581431    1.20131467    0.04141240    0.04019499   -0.00047187    0.00036680
O   -1.92485746   -1.24072005   -0.02200653    0.01166131    0.00114152    0.00157017
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C   -0.75815460   -0.77039658    0.00020049    0.03229412   -0.01418100   -0.00436777
C    0.30968993    1.60387828   -0.04294586    0.00622139   -0.00874832    0.00299407
C    0.34832430   -1.62755151   -0.01461467   -0.03122084   -0.00503820    0.00053792
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C    1.67167507   -1.24507792    0.02796395   -0.01577822    0.00035657    0.00076741
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C    2.29958411    0.01790032    0.05607902   -0.01249314   -0.02753792    0.00806036
H    3.41705351    0.01032212    0.08356518    0.01874278    0.00066870    0.00100526
   15
   -420.53780418
H   -2.52047333    0.30533108   -0.01869058    0.00054374   -0.00977198   -0.00347523
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O   -1.92093340   -1.24128483   -0.02315125    0.01819239    0.00271736    0.00122897
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C    0.30725636    1.60490039   -0.04121053    0.00197365   -0.01154848    0.00358702
C    0.34536945   -1.62847464   -0.01673216   -0.03588490   -0.00732736   -0.00089667
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C    2.30310196    0.01932640    0.05640693   -0.00828461   -0.02287236    0.00798705
H    3.41667383   -0.00686358    0.08735282    0.01680149   -0.00162856    0.00134008
   15
   -420.53697624
H   -2.53106005    0.30283876   -0.02647606   -0.00353993   -0.01243367   -0.00409797
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O   -1.91721564   -1.24188051   -0.02430991    0.02462346    0.00443280    0.00089882
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C   -0.76170229   -0.77274791    0.01025055    0.02250852   -0.01893225   -0.00144138
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C    1.70574042    1.28664516   -0.07223984    0.01258277    0.00729231   -0.01060631
C    1.66943021   -1.24460127    0.02657047   -0.00686714   -0.00680768    0.00088066
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H    0.19867156   -2.69714549   -0.06878728    0.01190268    0.00299231    0.00058041
H    2.34473072    2.18111791   -0.15389685    0.00133692    0.01083677   -0.00144115
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C    2.30674302    0.02109807    0.05661405   -0.00238411   -0.01801019    0.00793681
H    3.41329535   -0.02375690    0.09090014    0.01307120   -0.00386588    0.00161118
   15
   -420.53633128
H   -2.54101613    0.30257219   -0.03352542   -0.00694419   -0.01432478   -0.00463825
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O   -1.91377687   -1.24252651   -0.02547878    0.03070855    0.00622287    0.00057002
C   -0.80243868    0.76337620    0.05142788   -0.07503618    0.03127527    0.00739728
C   -0.76402544   -0.77351146    0.01531934    0.01661455   -0.02067641    0.00002367
C    0.30237364    1.60748012   -0.03790900   -0.00794757   -0.01219853    0.00434655
C    0.34113728   -1.62996221   -0.02090615   -0.04185465   -0.01048356   -0.00357733
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C    1.66849720   -1.24423552    0.02585408   -0.00329249   -0.00920477    0.00090699
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H    0.20634717   -2.69906808   -0.06479304    0.01291052    0.00310075    0.00100494
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   15
   -420.53583607
H   -2.54973448    0.30487213   -0.03974165   -0.00942914   -0.01537778   -0.00504872
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C   -0.76659947   -0.77396300    0.02038774    0.01042240   -0.02192866    0.00150615
C    0.30007403    1.60904752   -0.03635424   -0.01324217   -0.01000903    0.00448385
C    0.33995006   -1.63047917   -0.02292208   -0.04300110   -0.01113950   -0.00483793
C    1.70545211    1.28548400   -0.07398782    0.00551361    0.00530856   -0.01025057
C    1.66761529   -1.24373228    0.02512396   -0.00083429   -0.01023867    0.00094599
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C    2.31401846    0.02538536    0.05666847    0.01310239   -0.00853070    0.00792901
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   15
   -420.53549772
H   -2.55677129    0.30992518   -0.04505132   -0.01079156   -0.01542431   -0.00529183
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O   -1.90800492   -1.24405082   -0.02783206    0.04090696    0.00976190   -0.00012267
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C   -0.76933100   -0.77408358    0.02543337    0.00415493   -0.02267310    0.00299587
C    0.29797459    1.61076439   -0.03486705   -0.01849705   -0.00632070    0.00446006
C    0.33941150   -1.63082833   -0.02486489   -0.04291927   -0.01126144   -0.00606396
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C    1.66674764   -1.24307622    0.02437951    0.00027233   -0.00965813    0.00101300
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H    2.38034669    2.16207925   -0.17636809    0.00908798    0.01177900   -0.00286009
H    2.35740318   -2.06465918   -0.02770901   -0.00760200    0.00852235   -0.00271273
C    2.31742018    0.02775806    0.05651591    0.02145121   -0.00420987    0.00794904
H    3.39309866   -0.06885437    0.09968400   -0.00501572   -0.00916353    0.00197768
   15
   -420.53534173
H   -2.56188447    0.31773854   -0.04941104   -0.01088487   -0.01428000   -0.00533701
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O   -1.90578706   -1.24496906   -0.02900859    0.04460530    0.01129102   -0.00051441
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C   -0.77212560   -0.77386202    0.03043367   -0.00189262   -0.02285499    0.00451439
C    0.29615443    1.61257540   -0.03344713   -0.02346458   -0.00149352    0.00429686
C    0.33952039   -1.63100766   -0.02671606   -0.04163245   -0.01098962   -0.00725507
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C    1.66587750   -1.24227601    0.02361973    0.00004831   -0.00751650    0.00110365
H    0.10135279    2.68073508   -0.13375058    0.00482115    0.00217912   -0.00127559
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H    2.38945095    2.15139448   -0.18293037    0.00996844    0.00978066   -0.00311225
H    2.34725127   -2.07565170   -0.02936069   -0.00761402    0.00565973   -0.00278269
C    2.32049850    0.03019487    0.05624320    0.02903026   -0.00021229    0.00794880
H    3.38661110   -0.08096503    0.10191891   -0.01101430   -0.01038747    0.00201044
   15
   -420.53524196
H   -2.56505817    0.32810204   -0.05281339   -0.00959119   -0.01169542   -0.00514789
O   -2.00511684    1.19320160    0.02917057    0.04414000   -0.00511141    0.00194602
O   -1.90407412   -1.24601512   -0.03017926    0.04715053    0.01251421   -0.00095287
C   -0.79213682    0.76980043    0.05746574   -0.04773434    0.03454216    0.00582195
C   -0.77489215   -0.77329560    0.03536570   -0.00746306   -0.02245311    0.00606465
C    0.29468852    1.61440835   -0.03209212   -0.02796829    0.00387979    0.00406183
C    0.34025733   -1.63102102   -0.02845752   -0.03917678   -0.01053974   -0.00842513
C    1.70447252    1.28308061   -0.07545162   -0.00081506    0.00908793   -0.00994118
C    1.66500803   -1.24136370    0.02284327   -0.00132050   -0.00410559    0.00119697
H    0.11441550    2.67545946   -0.13289494    0.00736657   -0.00383314   -0.00068560
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H    2.39677392    2.13896384   -0.18893457    0.00992727    0.00674721   -0.00322052
H    2.33845970   -2.08764943   -0.03051105   -0.00689237    0.00183665   -0.00287010
C    2.32314006    0.03263516    0.05585039    0.03485882    0.00355179    0.00787865
H    3.38208388   -0.09120838    0.10379144   -0.01546850   -0.01141493    0.00206355
   15
   -420.53516384
H   -2.56652578    0.34054707   -0.05529286   -0.00686057   -0.00745591   -0.00470774
O   -2.00876633    1.19210390    0.02733075    0.03522838   -0.00959304    0.00138906
O   -1.90289489   -1.24720276   -0.03133908    0.04845003    0.01332905   -0.00144930
C   -0.78744194    0.77010917    0.05874060   -0.03758001    0.03384703    0.00546765
C   -0.77754671   -0.77239042    0.04020598   -0.01233936   -0.02145077    0.00765896
C    0.29364464    1.61618295   -0.03079850   -0.03177955    0.00899601    0.00381101
C    0.34158549   -1.63087502   -0.03007167   -0.03568800   -0.01010656   -0.00955248
C    1.70413718    1.28204050   -0.07563752   -0.00141743    0.01161021   -0.00994319
C    1.66415951   -1.24039028    0.02204876   -0.00353423    0.00008469    0.00126111
H    0.12615675    2.67086832   -0.13191577    0.00959309   -0.00945584   -0.00011362
H    0.20878661   -2.71276394   -0.04872546    0.01213788   -0.00506270    0.00245375
H    2.40232223    2.12533119   -0.19436222    0.00900708    0.00287970   -0.00318244
H    2.33090223   -2.09997146   -0.03114479   -0.00574045   -0.00248363   -0.00294973
C    2.32525769    0.03502180    0.05533858    0.03814301    0.00722408    0.00769404
H    3.38030746   -0.09939894    0.10529160   -0.01759658   -0.01233852    0.00217368
   15
   -420.53508502
H   -2.56677743    0.35430965   -0.05692849   -0.00279199   -0.00153222   -0.00403273
O   -2.01281363    1.19111629    0.02547538    0.02435113   -0.01548655    0.00057847
O   -1.90226408   -1.24854114   -0.03248242    0.04846485    0.01364915   -0.00200424
C   -0.78217971    0.76990673    0.05993277   -0.02674963    0.03267280    0.00514014
C   -0.78001579   -0.77116162    0.04493041   -0.01633576   -0.01985550    0.00929694
C    0.29308019    1.61782296   -0.02956261   -0.03472391    0.01294952    0.00363396
C    0.34345203   -1.63057592   -0.03154146   -0.03121534   -0.00990260   -0.01063422
C    1.70382235    1.28082460   -0.07567303   -0.00128744    0.01429164   -0.00998149
C    1.66336506   -1.23941842    0.02123524   -0.00627629    0.00451014    0.00126564
H    0.13617751    2.66795982   -0.13091501    0.01135214   -0.01372811    0.00035089
H    0.20228486   -2.71422529   -0.04665595    0.01098236   -0.00683978    0.00267463
H    2.40626069    2.11118739   -0.19921943    0.00735654   -0.00153723   -0.00300747
H    2.32437760   -2.11184649   -0.03124803   -0.00452151   -0.00680624   -0.00299114
C    2.32680215    0.03729920    0.05471057    0.03850868    0.01090132    0.00736738
H    3.38166010   -0.10536916    0.10639886   -0.01705333   -0.01322096    0.00238359
   15
   -420.53491963
H   -2.56654071    0.36832691   -0.05784088    0.00226505    0.00576564   -0.00317787
O   -2.01713581    1.19030546    0.02361363    0.01205329   -0.02252052   -0.00043353
O   -1.90218188   -1.25003382   -0.03360293    0.04722959    0.01342018   -0.00264076
C   -0.77651347    0.76921078    0.06104717   -0.01557504    0.03107931    0.00484924
C   -0.78223904   -0.76963329    0.04951420   -0.01937110   -0.01769447    0.01098479
C    0.29303953    1.61926952   -0.02838184   -0.03668111    0.01497850    0.00359997
C    0.34578951   -1.63012664   -0.03285053   -0.02590115   -0.01006454   -0.01166149
C    1.70352636    1.27939286   -0.07555757   -0.00061539    0.01672932   -0.01003005
C    1.66266583   -1.23851442    0.02040270   -0.00926073    0.00867328    0.00118301
H    0.14416176    2.66749131   -0.12997428    0.01255225   -0.01584585    0.00060864
H    0.19380903   -2.71446269   -0.04506760    0.00959354   -0.00812755    0.00287426
H    2.40888383    2.09732144   -0.20353623    0.00521765   -0.00611145   -0.00274647
H    2.31867015   -2.12250230   -0.03081361   -0.00348033   -0.01064744   -0.00296573
C    2.32776782    0.03941182    0.05397139    0.03607630    0.01456978    0.00688917
H    3.38604660   -0.10895794    0.10707636   -0.01400235   -0.01413533    0.00266541
   15
   -420.53468346
H   -2.56671370    0.38129770   -0.05818209    0.00750481    0.01353965   -0.00226385
O   -2.02159426    1.18975026    0.02175687   -0.00071861   -0.02975085   -0.00152386
O   -1.90263437   -1.25167824   -0.03469339    0.04482671    0.01264041   -0.00335061
C   -0.77061172    0.76804538    0.06208821   -0.00438374    0.02910647    0.00459586
C   -0.78417064   -0.76783806    0.05393184   -0.02139503   -0.01501055    0.01271692
C    0.29355222    1.62049245   -0.02725575   -0.03760744    0.01468273    0.00375647
C    0.34851780   -1.62952467   -0.03398335   -0.01990129   -0.01065857   -0.01261706
C    1.70323935    1.27770903   -0.07529056    0.00031994    0.01845895   -0.01000824
C    1.66210673   -1.23774052    0.01955242   -0.01226392    0.01209861    0.00099616
H    0.14989589    2.66983766   -0.12913967    0.01308273   -0.01537520    0.00063500
H    0.18360840   -2.71324602   -0.04399638    0.00802771   -0.00880295    0.00305042
H    2.41056892    2.08455212   -0.20735910    0.00298596   -0.01041384   -0.00245057
H    2.31359911   -2.13124992   -0.02984600   -0.00290106   -0.01369814   -0.00286398
C    2.32819065    0.04130423    0.05312820    0.03147770    0.01818249    0.00630249
H    3.39292629   -0.11000354    0.10727308   -0.00904573   -0.01492316    0.00301577
   15
   -420.53441408
H   -2.56822538    0.39184567   -0.05811414    0.01186893    0.02027662   -0.00145436
O   -2.02604531    1.18953153    0.01991733   -0.01266342   -0.03581272   -0.00251581
O   -1.90359443   -1.25346558   -0.03574580    0.04140423    0.01133505   -0.00411385
C   -0.76464337    0.76644032    0.06305972    0.00653946    0.02678432    0.00439146
C   -0.78577995   -0.76581640    0.05815723   -0.02244111   -0.01189172    0.01446463
C    0.29463221    1.62149606   -0.02618667   -0.03746483    0.01220436    0.00407491
C    0.35154634   -1.62876098   -0.03492553   -0.01336885   -0.01172339   -0.01347421
C    1.70294761    1.27574752   -0.07487239    0.00115189    0.01903081   -0.00985942
C    1.66173288   -1.23714831    0.01868721   -0.01509704    0.01453682    0.00070549
H    0.15328304    2.67491505   -0.12841601    0.01303049   -0.01239341    0.00042636
H    0.17196484   -2.71045457   -0.04347394    0.00634798   -0.00879886    0.00319440
H    2.41171253    2.07364639   -0.21074017    0.00102791   -0.01392580   -0.00220394
H    2.30905787   -2.13754681   -0.02836407   -0.00281372   -0.01565851   -0.00267252
C    2.32813912    0.04292201    0.05218979    0.02558333    0.02157308    0.00565929
H    3.40141964   -0.10836568    0.10692664   -0.00306831   -0.01548065    0.00337934
   15
   -420.53431236
H   -2.57184448    0.39878397   -0.05777754    0.01410683    0.02428272   -0.00097681
O   -2.03035480    1.18971653    0.01810610   -0.02235192   -0.03902302   -0.00322377
O   -1.90502338   -1.25538111   -0.03675149    0.03713093    0.00956916   -0.00494241
C   -0.75877320    0.76443071    0.06396476    0.01688807    0.02411270    0.00424210
C   -0.78705104   -0.76361539    0.06216391   -0.02257219   -0.00841967    0.01622053
C    0.29627739    1.62231705   -0.02517933   -0.03628787    0.00816808    0.00449201
C    0.35477672   -1.62781962   -0.03566414   -0.00655247   -0.01317333   -0.01421933
C    1.70263902    1.27350012   -0.07430538    0.00152453    0.01806256   -0.00950697
C    1.66158689   -1.23677444    0.01781144   -0.01761458    0.01578114    0.00031569
H    0.15433208    2.68219545   -0.12776655    0.01244430   -0.00747399    0.00004091
H    0.15918049   -2.70608832   -0.04352638    0.00458389   -0.00812596    0.00330921
H    2.41266199    2.06523000   -0.21372260   -0.00026892   -0.01621797   -0.00208647
H    2.30503137   -2.14104313   -0.02640226   -0.00329620   -0.01638005   -0.00239595
C    2.32770127    0.04421409    0.05116581    0.01927005    0.02456483    0.00501573
H    3.41046360   -0.10394618    0.10597240    0.00303860   -0.01565500    0.00370560
   15
   -420.53448016
H   -2.57796071    0.40140655   -0.05725744    0.01335266    0.02442171   -0.00091767
O   -2.03441370    1.19034074    0.01633111   -0.02879074   -0.03827220   -0.00353759
O   -1.90687292   -1.25740482   -0.03770120    0.03219869    0.00742679   -0.00578397
C   -0.75315734    0.76205699    0.06480559    0.02637201    0.02106874    0.00415184
C   -0.78798181   -0.76128734    0.06592539   -0.02189598   -0.00472160    0.01793781
C    0.29847003    1.62301532   -0.02423992   -0.03411751    0.00348228    0.00491528
C    0.35810604   -1.62667871   -0.03618790    0.00036861   -0.01493568   -0.01484099
C    1.70230825    1.27098172   -0.07359495    0.00118655    0.01535658   -0.00889921
C    1.66170672   -1.23663764    0.01693102   -0.01970504    0.01576590   -0.00015982
H    0.15314705    2.69080594   -0.12712311    0.01142459   -0.00148428   -0.00043750
H    0.14557089   -2.70026820   -0.04417392    0.00281761   -0.00683762    0.00338157
H    2.41364640    2.05971128   -0.21632661   -0.00063564   -0.01699925   -0.00216121
H    2.30160700   -2.14160885   -0.02401008   -0.00435812   -0.01584160   -0.00204809
C    2.32697160    0.04513552    0.05006591    0.01329881    0.02696554    0.00443465
H    3.41896954   -0.09671404    0.10435205    0.00852188   -0.01538164    0.00394984
   15
   -420.53491932
H   -2.58643658    0.39969092   -0.05656646    0.00956125    0.02056682   -0.00123005
O   -2.03814918    1.19139531    0.01459590   -0.03178240   -0.03340667   -0.00346494
O   -1.90908729   -1.25951254   -0.03858528    0.02680778    0.00502025   -0.00665151
C   -0.74793882    0.75936519    0.06558358    0.03473032    0.01763109    0.00412208
C   -0.78858236   -0.75888805    0.06941573   -0.02051619   -0.00091469    0.01958723
C    0.30117740    1.62366058   -0.02337471   -0.03100523   -0.00091125    0.00525339
C    0.36142995   -1.62531181   -0.03648745    0.00716046   -0.01685043   -0.01531759
C    1.70196051    1.26823318   -0.07275029    0.00005994    0.01095329   -0.00802611
C    1.66212385   -1.23673771    0.01605309   -0.02127287    0.01451793   -0.00070004
H    0.14991009    2.69968152   -0.12640086    0.01008408    0.00466510   -0.00092076
H    0.13145369   -2.69322412   -0.04542968    0.00108690   -0.00506975    0.00341370
H    2.41473063    2.05723018   -0.21853838   -0.00001058   -0.01620996   -0.00245238
H    2.29897459   -2.13934079   -0.02125011   -0.00592471   -0.01406687   -0.00163620
C    2.32603974    0.04565005    0.04889883    0.00819784    0.02866089    0.00394417
H    3.42595797   -0.08672193    0.10202147    0.01284524   -0.01456196    0.00409198
   15
   -420.53548790
H   -2.59660320    0.39431558   -0.05565055    0.00359617    0.01379336   -0.00178016
O   -2.04152664    1.19282617    0.01289976   -0.03204525   -0.02554932   -0.00314441
O   -1.91160552   -1.26167701   -0.03939390    0.02116050    0.00243329   -0.00752360
C   -0.74324382    0.75640734    0.06629917    0.04177259    0.01377898    0.00415096
C   -0.78887340   -0.75647492    0.07261004   -0.01853284    0.00287830    0.02113805
C    0.30435256    1.62431830   -0.02258873   -0.02703132   -0.00422788    0.00542315
C    0.36464611   -1.62369036   -0.03655555    0.01357380   -0.01869064   -0.01564862
C    1.70161263    1.26532079   -0.07178450   -0.00170883    0.00513543   -0.00694307
C    1.66286191   -1.23705599    0.01518579   -0.02225660    0.01219323   -0.00127632
H    0.14486112    2.70772727   -0.12551450    0.00852636    0.01016935   -0.00132603
H    0.11714126   -2.68527171   -0.04729960   -0.00058887   -0.00300121    0.00340541
H    2.41580425    2.05764780   -0.22030570    0.00146120   -0.01404003   -0.00294017
H    2.29741459   -2.13455647   -0.01819609   -0.00789148   -0.01119997   -0.00118769
C    2.32498249    0.04573224    0.04767197    0.00430104    0.02954718    0.00356307
H    3.43065571   -0.07411578    0.09895603    0.01566710   -0.01321500    0.00409650
   15
   -420.53590308
H   -2.60740431    0.38647500   -0.05441364   -0.00328880    0.00576946   -0.00237519
O   -2.04454198    1.19454560    0.01123922   -0.03077356   -0.01629693   -0.00275826
O   -1.91436372   -1.26386901   -0.04011718    0.01543102   -0.00022854   -0.00837486
C   -0.73917862    0.75324163    0.06695193    0.04733996    0.00952814    0.00423313
C   -0.78888486   -0.75410513    0.07548493   -0.01602728    0.00652522    0.02254377
C    0.30793548    1.62503796   -0.02188450   -0.02228364   -0.00593168    0.00538307
C    0.36765774   -1.62178676   -0.03638723    0.01940206   -0.02027188   -0.01582436
C    1.70129102    1.26233186   -0.07071393   -0.00382545   -0.00158781   -0.00571010
C    1.66393576   -1.23755761    0.01433780   -0.02266184    0.00904812   -0.00186421
H    0.13827850    2.71395982   -0.12439113    0.00685803    0.01447512   -0.00161738
H    0.10293377   -2.67677854   -0.04978201   -0.00216991   -0.00086519    0.00334954
H    2.41660707    2.06057815   -0.22154180    0.00345960   -0.01083820   -0.00356001
H    2.29727899   -2.12776836   -0.01492855   -0.01009952   -0.00749577   -0.00072012
C    2.32385850    0.04536873    0.04639108    0.00180875    0.02956690    0.00331470
H    3.43255658   -0.05913764    0.09515466    0.01682967   -0.01138335    0.00397621
   15
   -420.53608155
H   -2.61761861    0.37759124   -0.05275086   -0.00983120   -0.00197555   -0.00286093
O   -2.04720856    1.19645009    0.00961004   -0.02913529   -0.00720221   -0.00245362
O   -1.91729705   -1.26605836   -0.04074550    0.00977052   -0.00289253   -0.00918753
C   -0.73582730    0.74993229    0.06754063    0.05135654    0.00492479    0.00436223
C   -0.78865445   -0.75183372    0.07801917   -0.01310592    0.00993892    0.02377437
C    0.31185455    1.62584501   -0.02126139   -0.01689195   -0.00574472    0.00511730
C    0.37037690   -1.61957732   -0.03597986    0.02445294   -0.02137313   -0.01583272
C    1.70102719    1.25936732   -0.06955706   -0.00590174   -0.00864925   -0.00444376
C    1.66535168   -1.23819558    0.01351797   -0.02260159    0.00550685   -0.00243050
H    0.13046149    2.71760905   -0.12297867    0.00518422    0.01722269   -0.00176246
H    0.08911418   -2.66812578   -0.05286702   -0.00365861    0.00112449    0.00325127
H    2.41678537    2.06545181   -0.22213663    0.00558451   -0.00708375   -0.00421415
H    2.29896129   -2.11963720   -0.01153134   -0.01228126   -0.00334556   -0.00025578
C    2.32270538    0.04455924    0.04505991    0.00079659    0.02869703    0.00319469
H    3.43145261   -0.04211595    0.09063896    0.01625516   -0.00915174    0.00373762
   15
   -420.53609817
H   -2.62608110    0.36904387   -0.05057608   -0.01514913   -0.00840267   -0.00313850
O   -2.04954422    1.19843740    0.00800886   -0.02794766    0.00067777   -0.00231783
O   -1.92034139   -1.26821495   -0.04126964    0.00429616   -0.00547274   -0.00994719
C   -0.73325055    0.74654881    0.06806333    0.05379955    0.00006406    0.00453028
C   -0.78822628   -0.74971219    0.08019419   -0.00984203    0.01303765    0.02479921
C    0.31602842    1.62673656   -0.02071536   -0.01100733   -0.00359463    0.00462220
C    0.37272740   -1.61704559   -0.03533333    0.02855337   -0.02180804   -0.01567493
C    1.70085211    1.25653326   -0.06833292   -0.00758167   -0.01547672   -0.00324347
C    1.66710901   -1.23891700    0.01273484   -0.02226638    0.00210007   -0.00295164
H    0.12171097    2.71818277   -0.12125150    0.00357014    0.01823209   -0.00173961
H    0.07594928   -2.65967092   -0.05653679   -0.00503700    0.00281246    0.00310477
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H    2.30284959   -2.11090293   -0.00808767   -0.01410370    0.00075522    0.00018198
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   15
   -420.53607534
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C    0.32036838    1.62768020   -0.02023896   -0.00481015    0.00044605    0.00391592
C    0.37464743   -1.61418498   -0.03445001    0.03157540   -0.02148590   -0.01534687
C    1.70079084    1.25393231   -0.06705955   -0.00858230   -0.02158155   -0.00219970
C    1.66920290   -1.23967095    0.01199625   -0.02188363   -0.00063644   -0.00340729
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   15
   -420.53609204
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O   -1.92651820   -1.27231462   -0.04197188   -0.00573666   -0.01015312   -0.01123124
C   -0.73054611    0.73985472    0.06890014    0.05424164   -0.00989511    0.00494697
C   -0.78697787   -0.74610020    0.08340811   -0.00258267    0.01805059    0.02614990
C    0.32478100    1.62861504   -0.01982155    0.00148254    0.00618408    0.00303474
C    0.37609142   -1.61100047   -0.03333485    0.03342957   -0.02034494   -0.01484433
C    1.70085830    1.25165631   -0.06575268   -0.00871873   -0.02658975   -0.00136913
C    1.67162791   -1.24041672    0.01130909   -0.02171274   -0.00217394   -0.00379191
H    0.10253615    2.70969809   -0.11689759    0.00091539    0.01494840   -0.00123215
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H    2.31840555   -2.09444104   -0.00136927   -0.01523461    0.00670780    0.00094007
C    2.31911702    0.03965051    0.04077457    0.00574579    0.02113854    0.00344029
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   15
   -420.53625542
H   -2.63301554    0.35526313   -0.04068264   -0.02016215   -0.01622097   -0.00267937
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O   -1.92953698   -1.27420474   -0.04213543   -0.01015726   -0.01214538   -0.01173069
C   -0.73042533    0.73669427    0.06920798    0.05244848   -0.01466746    0.00517784
C   -0.78626722   -0.74468542    0.08442664    0.00126376    0.01987025    0.02644186
C    0.32917128    1.62945473   -0.01944987    0.00768349    0.01328462    0.00202040
C    0.37703148   -1.60750929   -0.03199547    0.03404233   -0.01842023   -0.01417105
C    1.70105644    1.24978070   -0.06442481   -0.00791516   -0.03024730   -0.00079710
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H    2.33026797   -2.08777448    0.00176900   -0.01397818    0.00778821    0.00125856
C    2.31779559    0.03731432    0.03924478    0.00895964    0.01725760    0.00362889
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   15
   -420.53652352
H   -2.62817613    0.35618725   -0.03635258   -0.01799531   -0.01490349   -0.00220696
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O   -1.93244099   -1.27595736   -0.04216601   -0.01410527   -0.01384547   -0.01211950
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C   -0.78557569   -0.74357046    0.08504570    0.00514874    0.02118007    0.02647266
C    0.33344549    1.63009263   -0.01910866    0.01367002    0.02123167    0.00093199
C    0.37745838   -1.60374044   -0.03044203    0.03337554   -0.01581567   -0.01333153
C    1.70137309    1.24836057   -0.06308456   -0.00618084   -0.03239924   -0.00049340
C    1.67746679   -1.24181468    0.01011123   -0.02241746   -0.00071676   -0.00435160
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H    0.03468805   -2.63253024   -0.07637745   -0.00987837    0.00447391    0.00192270
H    2.39769189    2.09636721   -0.21197107    0.00777376    0.00631074   -0.00554199
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C    2.31633896    0.03471778    0.03766013    0.01193578    0.01288311    0.00381436
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   15
   -420.53684012
H   -2.62012252    0.35976741   -0.03162666   -0.01412097   -0.01164877   -0.00163985
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C   -0.73251507    0.73110407    0.06958523    0.04564658   -0.02297570    0.00564380
C   -0.78496200   -0.74277503    0.08526481    0.00901775    0.02192362    0.02624833
C    0.33751341    1.63040927   -0.01878153    0.01931031    0.02938257   -0.00016621
C    0.37738216   -1.59973311   -0.02868721    0.03144141   -0.01267613   -0.01233535
C    1.70178214    1.24742841   -0.06173653   -0.00360071   -0.03299698   -0.00045595
C    1.68089109   -1.24248860    0.00960901   -0.02308604    0.00203584   -0.00454703
H    0.07280563    2.67938042   -0.10896391   -0.00100721   -0.00017315    0.00031130
H    0.02831007   -2.62778791   -0.08236221   -0.01076344    0.00378030    0.00146294
H    2.38930838    2.10045156   -0.20697072    0.00574037    0.00636934   -0.00518889
H    2.36103036   -2.07853129    0.00731515   -0.00780269    0.00596533    0.00180973
C    2.31470310    0.03192693    0.03601784    0.01387487    0.00810312    0.00397428
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   15
   -420.53696971
H   -2.60955174    0.36542033   -0.02660573   -0.00869714   -0.00665623   -0.00104447
O   -2.05659117    1.20858563   -0.00096478   -0.04112676    0.00800399   -0.00440968
O   -1.93773166   -1.27897612   -0.04181194   -0.02036900   -0.01635107   -0.01253839
C   -0.73462310    0.72879953    0.06964762    0.04099944   -0.02621388    0.00586367
C   -0.78448450   -0.74231038    0.08508735    0.01275472    0.02208018    0.02577660
C    0.34128981    1.63028247   -0.01845194    0.02458927    0.03689804   -0.00119809
C    0.37683206   -1.59553451   -0.02674604    0.02827186   -0.00919624   -0.01120282
C    1.70224483    1.24699328   -0.06038131   -0.00034996   -0.03206291   -0.00065987
C    1.68466422   -1.24319428    0.00917548   -0.02355300    0.00558146   -0.00469710
H    0.06314978    2.66797832   -0.10629700   -0.00123190   -0.00595263    0.00083238
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H    2.37990277    2.10340268   -0.20103874    0.00297211    0.00547758   -0.00465110
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C    2.31285960    0.02901394    0.03431550    0.01405698    0.00299158    0.00410268
H    3.37955778    0.09638844    0.04426631   -0.01342508    0.00874566    0.00082724
   15
   -420.53684483
H   -2.59743182    0.37225150   -0.02139602   -0.00219503   -0.00029261   -0.00048085
O   -2.05637019    1.20985267   -0.00231677   -0.04594525    0.00293137   -0.00486913
O   -1.94004738   -1.28021392   -0.04142256   -0.02255930   -0.01711436   -0.01255653
C   -0.73735033    0.72689038    0.06962138    0.03577769   -0.02868251    0.00607124
C   -0.78419957   -0.74217882    0.08452046    0.01625777    0.02161798    0.02506480
C    0.34469474    1.62959973   -0.01810445    0.02958125    0.04286600   -0.00206680
C    0.37585589   -1.59119706   -0.02463564    0.02397093   -0.00554669   -0.00994495
C    1.70271231    1.24704120   -0.05901584    0.00334310   -0.02973084   -0.00106922
C    1.68879275   -1.24398462    0.00881292   -0.02343356    0.00936096   -0.00480270
H    0.05371594    2.65763240   -0.10377861   -0.00149234   -0.01078779    0.00125298
H    0.02147745   -2.62018127   -0.09502786   -0.01183113    0.00197253    0.00040131
H    2.36997106    2.10537889   -0.19427109   -0.00033403    0.00375802   -0.00397569
H    2.39723790   -2.07341129    0.01156270    0.00116598    0.00129211    0.00227494
C    2.31080625    0.02605607    0.03255116    0.01204732   -0.00240360    0.00420717
H    3.37559743    0.11334403    0.03645699   -0.01435135    0.01077241    0.00050194
   15
   -420.53645066
H   -2.58492254    0.37912623   -0.01609847    0.00472202    0.00662644   -0.00000193
O   -2.05562821    1.21108721   -0.00361360   -0.05053369   -0.00292854   -0.00523673
O   -1.94210786   -1.28125791   -0.04089087   -0.02404268   -0.01754884   -0.01244322
C   -0.74061808    0.72541388    0.06950334    0.03021037   -0.03031034    0.00626989
C   -0.78416003   -0.74237335    0.08357485    0.01939713    0.02053644    0.02413704
C    0.34765271    1.62827170   -0.01772599    0.03436151    0.04650083   -0.00270868
C    0.37451846   -1.58677574   -0.02237497    0.01869317   -0.00189024   -0.00860038
C    1.70312905    1.24753725   -0.05763403    0.00720116   -0.02626723   -0.00160884
C    1.69327448   -1.24491613    0.00852291   -0.02241322    0.01283375   -0.00486448
H    0.04455507    2.64920517   -0.10148324   -0.00201914   -0.01397760    0.00150801
H    0.02121370   -2.61699513   -0.10151747   -0.01190615    0.00114126   -0.00018382
H    2.36010299    2.10668738   -0.18678895   -0.00387675    0.00142437   -0.00321695
H    2.41544228   -2.07142193    0.01309267    0.00558553   -0.00094911    0.00246507
C    2.30857347    0.02313471    0.03072322    0.00783437   -0.00796138    0.00430538
H    3.37418940    0.12836129    0.02855718   -0.01314032    0.01270525    0.00018524
   15
   -420.53603784
H   -2.57324925    0.38480917   -0.01079873    0.01095801    0.01305210    0.00035703
O   -2.05431388    1.21235424   -0.00485117   -0.05406694   -0.00825906   -0.00547299
O   -1.94389628   -1.28210314   -0.04021815   -0.02477314   -0.01767254   -0.01220460
C   -0.74434226    0.72439450    0.06929052    0.02446417   -0.03103041    0.00645259
C   -0.78441313   -0.74287766    0.08226452    0.02202574    0.01885944    0.02301365
C    0.35009137    1.62624412   -0.01730690    0.03896874    0.04726916   -0.00309272
C    0.37289935   -1.58232571   -0.01998432    0.01262301    0.00164738   -0.00719728
C    1.70343723    1.24842957   -0.05622781    0.01085599   -0.02205605   -0.00220642
C    1.69809369   -1.24604069    0.00830641   -0.02026478    0.01552515   -0.00488562
H    0.03576427    2.64326346   -0.09945619   -0.00297340   -0.01503084    0.00155761
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H    2.35093209    2.10774315   -0.17872817   -0.00732974   -0.00116214   -0.00243398
H    2.43264933   -2.06927017    0.01417944    0.00942799   -0.00262545    0.00261517
C    2.30622435    0.02033373    0.02883015    0.00187089   -0.01351435    0.00442233
H    3.37512113    0.14109331    0.02062420   -0.01014722    0.01450129   -0.00014796
   15
   -420.53569243
H   -2.56352515    0.38817190   -0.00556163    0.01559297    0.01740070    0.00060659
O   -2.05238811    1.21371326   -0.00602675   -0.05555895   -0.01176955   -0.00559869
O   -1.94540441   -1.28274817   -0.03940710   -0.02470827   -0.01751732   -0.01184616
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C   -0.78499844   -0.74366646    0.08060643    0.02399208    0.01663359    0.02171736
C    0.35194106    1.62350539   -0.01684136    0.04337479    0.04512763   -0.00320892
C    0.37109006   -1.57790031   -0.01748490    0.00600623    0.00496413   -0.00576121
C    1.70358201    1.24965506   -0.05478821    0.01393586   -0.01758480   -0.00279682
C    1.70321782   -1.24739867    0.00816372   -0.01690883    0.01711125   -0.00485975
H    0.02751542    2.63999533   -0.09770659   -0.00437937   -0.01385368    0.00141126
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H    2.44817112   -2.06665726    0.01479608    0.01240689   -0.00351548    0.00271818
C    2.30384820    0.01773676    0.02687018   -0.00512666   -0.01881530    0.00456182
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   15
   -420.53565411
H   -2.55657314    0.38844857   -0.00043296    0.01780204    0.01855356    0.00080376
O   -2.04983465    1.21520315   -0.00713889   -0.05429713   -0.01236058   -0.00565844
O   -1.94663300   -1.28319472   -0.03846177   -0.02383574   -0.01711179   -0.01137373
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C   -0.78594552   -0.74470618    0.07862014    0.02515598    0.01393982    0.02027904
C    0.35313544    1.62008744   -0.01632758    0.04736328    0.04042970   -0.00309409
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C    1.70351720    1.25114673   -0.05330643    0.01610678   -0.01336429   -0.00330093
C    1.70859616   -1.24901376    0.00809445   -0.01235721    0.01735172   -0.00479123
H    0.02006040    2.63919402   -0.09620858   -0.00615745   -0.01080368    0.00110173
H    0.03300583   -2.60829632   -0.12036560   -0.01013019    0.00014525   -0.00190329
H    2.33706047    2.11089467   -0.16141614   -0.01245769   -0.00527733   -0.00113278
H    2.46147368   -2.06342499    0.01492414    0.01435360   -0.00348912    0.00276902
C    2.30154980    0.01542364    0.02484122   -0.01233703   -0.02358949    0.00471154
H    3.38169308    0.15845355    0.00489988   -0.00156704    0.01733128   -0.00086736
   15
   -420.53602645
H   -2.55278644    0.38543686    0.00455048    0.01727671    0.01617820    0.00102861
O   -2.04666799    1.21683025   -0.00818684   -0.05006413   -0.00963891   -0.00572627
O   -1.94759193   -1.28344738   -0.03738750   -0.02217296   -0.01647578   -0.01080933
C   -0.75739303    0.72411885    0.06805636    0.00803664   -0.02770804    0.00694118
C   -0.78727186   -0.74595616    0.07632743    0.02542095    0.01086178    0.01871077
C    0.35361455    1.61606045   -0.01576723    0.05064456    0.03387406   -0.00280648
C    0.36730452   -1.56931951   -0.01224634   -0.00786656    0.01072557   -0.00293204
C    1.70321031    1.25284130   -0.05177494    0.01710855   -0.00984493   -0.00366977
C    1.71416004   -1.25088941    0.00809759   -0.00671562    0.01611371   -0.00468170
H    0.01371604    2.64031964   -0.09490690   -0.00808970   -0.00651361    0.00068805
H    0.04077648   -2.60548435   -0.12609820   -0.00893158    0.00040037   -0.00241839
H    2.33327304    2.11371907   -0.15239767   -0.01346861   -0.00597011   -0.00070462
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C    2.29943724    0.01346624    0.02274103   -0.01901036   -0.02756228    0.00485495
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   15
   -420.53672772
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O   -1.94830002   -1.28351333   -0.03619070   -0.01976606   -0.01564329   -0.01015949
C   -0.76209366    0.72489869    0.06743819    0.00316512   -0.02486092    0.00707270
C   -0.78898139   -0.74737006    0.07375194    0.02472444    0.00752282    0.01704751
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C    1.70264627    1.25468590   -0.05018814    0.01685619   -0.00729817   -0.00390541
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H    2.48022763   -2.05529001    0.01368723    0.01484422   -0.00065651    0.00271841
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   15
   -420.53756220
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C   -0.76684252    0.72605350    0.06671311   -0.00138771   -0.02124981    0.00717603
C   -0.79106355   -0.74889751    0.07091877    0.02305432    0.00403150    0.01531523
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C    0.36399051   -1.56138138   -0.00682932   -0.02088078    0.01529583   -0.00030565
C    1.70182882    1.25664205   -0.04854242    0.01542453   -0.00573269   -0.00403206
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C    2.29615438    0.01084231    0.01831893   -0.02872035   -0.03230188    0.00501141
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   15
   -420.53834053
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O   -2.03410116    1.22209992   -0.01093352   -0.02511587    0.00896312   -0.00632563
O   -1.94908004   -1.28312482   -0.03345976   -0.01309231   -0.01345307   -0.00866173
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C   -0.79349316   -0.75048588    0.06785409    0.02046302    0.00051008    0.01353648
C    0.35035010    1.60137476   -0.01385649    0.05324422    0.01082894   -0.00154519
C    0.36275855   -1.55774255   -0.00410408   -0.02650455    0.01720767    0.00091302
C    1.70077928    1.25868581   -0.04683582    0.01305703   -0.00491481   -0.00408352
C    1.73104599   -1.25777981    0.00852201    0.01493407    0.00382904   -0.00414067
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C    2.29513021    0.01024725    0.01599472   -0.03117417   -0.03290293    0.00497183
H    3.39314574    0.15535406   -0.02415541    0.00927077    0.01700481   -0.00216245
   15
   -420.53895257
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O   -1.94922745   -1.28269519   -0.03194255   -0.00909088   -0.01210973   -0.00784903
C   -0.77621291    0.72925955    0.06493653   -0.00986749   -0.01205605    0.00727652
C   -0.79623113   -0.75208209    0.06458479    0.01704003   -0.00292097    0.01173147
C    0.34765152    1.59599698   -0.01316409    0.05106392    0.00404969   -0.00115629
C    0.36192633   -1.55436371   -0.00139255   -0.03130716    0.01894844    0.00205461
C    1.69953307    1.26080431   -0.04506750    0.01008392   -0.00445481   -0.00410886
C    1.73637640   -1.26029200    0.00879274    0.02274674   -0.00233258   -0.00390424
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H    2.34067223    2.13364071   -0.11542627   -0.00609959    0.00197043   -0.00014856
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C    2.29457524    0.01014825    0.01359547   -0.03188922   -0.03234438    0.00482636
H    3.39260100    0.14664016   -0.03057417    0.00885223    0.01544790   -0.00232095
   15
   -420.53937082
H   -2.56685611    0.34887783    0.02532114   -0.00367298   -0.01438764    0.00319364
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O   -1.94927194   -1.28212834   -0.03033634   -0.00487243   -0.01060372   -0.00700407
C   -0.78070600    0.73117202    0.06388352   -0.01400350   -0.00666926    0.00726174
C   -0.79922585   -0.75363438    0.06113811    0.01290803   -0.00614782    0.00992569
C    0.34418280    1.59055669   -0.01245415    0.04730007   -0.00166832   -0.00083436
C    0.36156631   -1.55127122    0.00128800   -0.03515617    0.02056008    0.00312290
C    1.69813474    1.26299000   -0.04323697    0.00687069   -0.00390759   -0.00415641
C    1.74136338   -1.26276859    0.00912248    0.03014276   -0.00875789   -0.00364178
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H    2.34649465    2.13898143   -0.10608333   -0.00268295    0.00505563   -0.00005787
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C    2.29450039    0.01053705    0.01112339   -0.03092276   -0.03076584    0.00456424
H    3.39048193    0.13515293   -0.03657613    0.00709154    0.01335818   -0.00238506
   15
   -420.53965907
H   -2.57087425    0.34512744    0.02809216   -0.00670146   -0.01785576    0.00357237
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O   -1.94926121   -1.28144136   -0.02865068   -0.00061881   -0.00893198   -0.00615106
C   -0.78498729    0.73318486    0.06272076   -0.01818840   -0.00090004    0.00720131
C   -0.80241505   -0.75509408    0.05754134    0.00821985   -0.00906716    0.00813645
C    0.34000074    1.58514014   -0.01173150    0.04203989   -0.00616366   -0.00059338
C    0.36173654   -1.54848950    0.00392139   -0.03794652    0.02207937    0.00413041
C    1.69663240    1.26523419   -0.04134357    0.00376797   -0.00288996   -0.00422662
C    1.74589578   -1.26511322    0.00950724    0.03658532   -0.01481422   -0.00334810
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H    2.35280124    2.14341825   -0.09673147    0.00065995    0.00771524    0.00010468
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C    2.29489124    0.01139001    0.00858247   -0.02844776   -0.02835309    0.00417922
H    3.38710274    0.12126630   -0.04214956    0.00417547    0.01084602   -0.00234976
   15
   -420.53988403
H   -2.57370346    0.34457080    0.03022156   -0.00858450   -0.01984529    0.00384012
O   -2.01390243    1.22760348   -0.01358374    0.01263761    0.01950527   -0.00669206
O   -1.94924332   -1.28065317   -0.02689524    0.00347834   -0.00712902   -0.00529126
C   -0.78899349    0.73521100    0.06144918   -0.02244523    0.00513097    0.00709803
C   -0.80572809   -0.75641718    0.05382150    0.00316226   -0.01159129    0.00638198
C    0.33518468    1.57981518   -0.01099979    0.03544459   -0.00936279   -0.00043693
C    0.36247917   -1.54604151    0.00649244   -0.03962169    0.02350921    0.00507098
C    1.69507267    1.26752114   -0.03938619    0.00099776   -0.00111035   -0.00433427
C    1.74987677   -1.26723512    0.00994257    0.04157431   -0.01985328   -0.00300847
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H    2.35899500    2.14647734   -0.08739896    0.00360521    0.00962052    0.00031993
H    2.48540606   -2.04592401   -0.00106942    0.00083167    0.01557989    0.00188529
C    2.29571074    0.01267091    0.00597850   -0.02478642   -0.02532412    0.00367513
H    3.38298494    0.10543100   -0.04730114    0.00038620    0.00803508   -0.00223157
   15
   -420.54007503
H   -2.57500503    0.34756698    0.03166155   -0.00925951   -0.02042840    0.00397282
O   -2.00895186    1.22845176   -0.01405623    0.02090788    0.01751316   -0.00647238
O   -1.94926460   -1.27978422   -0.02507976    0.00725546   -0.00522297   -0.00444697
C   -0.79266030    0.73715942    0.06007033   -0.02672718    0.01129073    0.00695798
C   -0.80908871   -0.75756559    0.05000509   -0.00208728   -0.01364413    0.00467771
C    0.32983408    1.57463027   -0.01026138    0.02772411   -0.01131929   -0.00036556
C    0.36381948   -1.54394882    0.00898690   -0.04014227    0.02482470    0.00595453
C    1.69349722    1.26982381   -0.03736329   -0.00124207    0.00157174   -0.00445083
C    1.75323139   -1.26905868    0.01042331    0.04474365   -0.02338634   -0.00259896
H    0.03116027    2.63387666   -0.08303099   -0.00669441    0.00667017   -0.00121476
H    0.13693998   -2.59414009   -0.15007180    0.00365677    0.00310583   -0.00536718
H    2.36454782    2.14781818   -0.07812532    0.00596263    0.01057049    0.00060821
H    2.48322558   -2.05183279   -0.00488606    0.00010505    0.01531279    0.00167412
C    2.29690416    0.01433420    0.00331908   -0.02043023   -0.02190153    0.00307443
H    3.37880367    0.08815069   -0.05205205   -0.00379268    0.00505070   -0.00205368
   15
   -420.54025052
H   -2.57465742    0.35422081    0.03238836   -0.00868328   -0.01963357    0.00396251
O   -2.00423769    1.22910291   -0.01445542    0.02834675    0.01383481   -0.00610797
O   -1.94936774   -1.27885606   -0.02321382    0.01055465   -0.00327253   -0.00362508
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C   -0.81241778   -0.75850835    0.04611788   -0.00733266   -0.01517749    0.00302896
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C    0.36576533   -1.54223127    0.01139138   -0.03951054    0.02598238    0.00677433
C    1.69193981    1.27210155   -0.03527308   -0.00284198    0.00520467   -0.00456380
C    1.75591187   -1.27053080    0.01094322    0.04596384   -0.02515641   -0.00209394
H    0.04143415    2.62640565   -0.08070540   -0.00395992    0.00291010   -0.00108823
H    0.14886796   -2.59516273   -0.14935449    0.00481726    0.00250829   -0.00565948
H    2.36903755    2.14727219   -0.06896164    0.00758601    0.01042974    0.00093138
H    2.48100866   -2.06047377   -0.00900326    0.00058602    0.01338206    0.00140722
C    2.29840641    0.01632824    0.00061319   -0.01597540   -0.01827232    0.00241938
H    3.37530435    0.06995785   -0.05643467   -0.00781247    0.00209264   -0.00183135
   15
   -420.54031933
H   -2.57276517    0.36438883    0.03240398   -0.00681572   -0.01742467    0.00379775
O   -1.99984405    1.22959858   -0.01478545    0.03465158    0.00855628   -0.00561264
O   -1.94959005   -1.27789077   -0.02130672    0.01324926   -0.00133981   -0.00283698
C   -0.79871898    0.74045165    0.05699952   -0.03476984    0.02338387    0.00662281
C   -0.81563623   -0.75922231    0.04218480   -0.01238548   -0.01615312    0.00144746
C    0.31800805    1.56478395   -0.00876751    0.00998603   -0.01237940   -0.00044327
C    0.36830719   -1.54090627    0.01369356   -0.03774199    0.02690434    0.00750567
C    1.69042455    1.27429954   -0.03311392   -0.00374903    0.00971734   -0.00463839
C    1.75789959   -1.27162461    0.01149466    0.04537379   -0.02523649   -0.00147480
H    0.05241875    2.61842048   -0.07818432   -0.00101488   -0.00149116   -0.00092467
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H    2.47867133   -2.07150234   -0.01337273    0.00208893    0.00997159    0.00106876
C    2.30015094    0.01859849   -0.00212925   -0.01210569   -0.01460821    0.00174399
H    3.37319965    0.05138703   -0.06048804   -0.01099694   -0.00080145   -0.00162479
   15
   -420.54017897
H   -2.56966441    0.37767188    0.03173779   -0.00365257   -0.01371088    0.00348989
O   -1.99584212    1.22999863   -0.01505194    0.03945496    0.00172953   -0.00500136
O   -1.94996203   -1.27691018   -0.01936741    0.01525666    0.00049335   -0.00209148
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C   -0.81866786   -0.75969275    0.03822974   -0.01706927   -0.01655012   -0.00006282
C    0.31180010    1.56013955   -0.00801092    0.00058259   -0.01230423   -0.00053780
C    0.37141838   -1.53998767    0.01588237   -0.03488313    0.02751544    0.00813898
C    1.68896515    1.27634973   -0.03088470   -0.00396165    0.01495052   -0.00465226
C    1.75920306   -1.27233849    0.01206826    0.04330148   -0.02396144   -0.00073339
H    0.06358719    2.61070624   -0.07549649    0.00189440   -0.00597041   -0.00076300
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H    2.37381115    2.14081178   -0.05119921    0.00835850    0.00698187    0.00160671
H    2.47594873   -2.08431078   -0.01793354    0.00422376    0.00550210    0.00065506
C    2.30207989    0.02108966   -0.00489809   -0.00939002   -0.01099235    0.00109329
H    3.37305425    0.03295838   -0.06424837   -0.01277886   -0.00354901   -0.00146845
   15
   -420.53980763
H   -2.56592338    0.39340194    0.03044507    0.00072651   -0.00848830    0.00305304
O   -1.99228608    1.23038019   -0.01526181    0.04240892   -0.00644198   -0.00429810
O   -1.95050639   -1.27593503   -0.01740431    0.01651646    0.00214707   -0.00140248
C   -0.80268683    0.74233672    0.05352800   -0.04035899    0.03407171    0.00632479
C   -0.82144202   -0.75991365    0.03427554   -0.02124198   -0.01636360   -0.00149858
C    0.30558309    1.55568169   -0.00724623   -0.00870388   -0.01260088   -0.00061226
C    0.37505573   -1.53948461    0.01794826   -0.03098819    0.02774127    0.00866105
C    1.68756483    1.27817327   -0.02858526   -0.00353872    0.02066111   -0.00457945
C    1.75985314   -1.27269113    0.01265281    0.04016054   -0.02182250    0.00011999
H    0.07441387    2.60405983   -0.07267066    0.00467915   -0.00989050   -0.00064443
H    0.17877389   -2.60037312   -0.14089959    0.00724403    0.00015839   -0.00633858
H    2.37395463    2.13551447   -0.04272138    0.00756975    0.00391617    0.00191124
H    2.47246378   -2.09810229   -0.02261125    0.00650628    0.00051567    0.00017377
C    2.30415266    0.02374708   -0.00768353   -0.00817961   -0.00742441    0.00049790
H    3.37518417    0.01516595   -0.06774315   -0.01282559   -0.00612074   -0.00139155
   15
   -420.53911543
H   -2.56232755    0.41064131    0.02860402    0.00606290   -0.00195247    0.00251408
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   15
   -420.53816350
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   15
   -420.53716606
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   15
   -420.53632453
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   15
   -420.53592359
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O   -1.95601771   -1.27167792   -0.00748425    0.01202645    0.00555642    0.00124329
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C    0.27901187    1.53695634   -0.00328470   -0.04586002   -0.03143268   -0.00039120
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   15
   -420.53608809
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O   -1.95760600   -1.27100447   -0.00552128    0.00935473    0.00517287    0.00164488
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C    0.27538872    1.53432641   -0.00246980   -0.05030167   -0.03696003   -0.00036085
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   15
   -420.53666709
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O   -1.95930004   -1.27038944   -0.00357694    0.00628807    0.00452634    0.00202234
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   15
   -420.53750305
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O   -1.96106513   -1.26982558   -0.00165553    0.00292345    0.00368878    0.00238283
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   15
   -420.53829502
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O   -1.96286320   -1.26930349    0.00023886   -0.00063923    0.00274543    0.00273183
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   15
   -420.53893099
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   15
   -420.53942071
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C    1.74040798   -1.25888183    0.01577017   -0.00126668   -0.02823459    0.00895514
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   15
   -420.53992632
H   -2.66479655    0.49765011   -0.00717016   -0.01931618   -0.01279641    0.00025763
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O   -1.96804796   -1.26788099    0.00572097   -0.01146487    0.00004207    0.00370380
C   -0.78671273    0.70339433    0.02438538    0.01318953    0.00933506    0.00802787
C   -0.82230427   -0.75245862   -0.00632867   -0.01592840    0.02254153   -0.01270623
C    0.27039260    1.53164374    0.00260732   -0.04527268   -0.03341253   -0.00182708
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C    1.73772872   -1.25574817    0.01542659   -0.00451963   -0.02941563    0.00933367
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C    2.34308908    0.05030246   -0.03958415    0.00389477    0.01965125   -0.00601813
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   15
   -420.54050211
H   -2.67268146    0.50457690   -0.01109822   -0.02071763   -0.01333309    0.00002273
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O   -1.96957014   -1.26742075    0.00746908   -0.01476560   -0.00062699    0.00398917
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   15
   -420.54118483
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   15
   -420.54181960
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   15
   -420.54228293
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   15
   -420.54234247
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   15
   -420.54192442
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   15
   -420.54097902
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   15
   -420.53980592
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   15
   -420.53865222
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   15
   -420.53773092
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   15
   -420.53698454
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O   -1.97202577   -1.26238189    0.02215326   -0.01765111    0.00484583    0.00437906
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   15
   -420.53626583
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C   -0.79717202   -0.78519631   -0.02216373    0.02910903    0.01204081   -0.00878465
C    0.30767308    1.54765454    0.01624509    0.03482138    0.02630854   -0.00257262
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   15
   -420.53557364
H   -2.68626962    0.56687089   -0.05345722   -0.00696849   -0.00042127   -0.00168936
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C   -0.77568592    0.65734561   -0.02424598    0.00524320   -0.05333650    0.00041087
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   15
   -420.53487112
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O   -1.96824973   -1.26139454    0.02555170   -0.00580900    0.01014105    0.00352341
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C   -0.79719142   -0.79596827   -0.02248278    0.02950951   -0.00275229   -0.00674801
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C    1.72729434   -1.19883606   -0.00516065   -0.00317141    0.03233978    0.00355631
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   15
   -420.53427895
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O   -1.96679485   -1.26126788    0.02659984   -0.00108705    0.01202331    0.00316065
C   -0.77575812    0.66166031   -0.03249745    0.00614206   -0.04399108   -0.00149094
C   -0.79787026   -0.80134880   -0.02248142    0.02864488   -0.01046335   -0.00564020
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C    0.37660654   -1.60075593    0.03650662   -0.03042127   -0.01138172   -0.00360174
C    1.67585166    1.22731257    0.03556474   -0.00072858   -0.03276000    0.00898203
C    1.72856915   -1.19712633   -0.00751609    0.00316936    0.02963076    0.00226893
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H    2.43783150   -2.02474527    0.00899648    0.00287881    0.00439430   -0.00141752
C    2.37629764    0.04785417   -0.06207857    0.01107913   -0.01817998   -0.00603675
H    3.46696248    0.21109846   -0.08166935    0.00937246    0.01716835    0.00045504
   15
   -420.53387860
H   -2.69834913    0.54708501   -0.06027491   -0.02036060   -0.01394014   -0.00285555
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O   -1.96532781   -1.26127758    0.02761216    0.00380959    0.01390315    0.00276691
C   -0.77592980    0.66485260   -0.03659658    0.00668986   -0.03819503   -0.00244490
C   -0.79898134   -0.80657130   -0.02239480    0.02706518   -0.01803748   -0.00450289
C    0.31164720    1.54179388    0.02209229    0.03663854    0.01306175   -0.00247714
C    0.37191780   -1.60226842    0.03697950   -0.03852287   -0.01030571   -0.00380777
C    1.67612151    1.22794649    0.03688780   -0.00353604   -0.03486349    0.00920399
C    1.72979622   -1.19586385   -0.00990589    0.00934208    0.02630616    0.00103456
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H    2.44362775   -2.00964666    0.01793010    0.00098007    0.00931402   -0.00101757
C    2.37691079    0.04850261   -0.06272458    0.01524813   -0.01854726   -0.00571990
H    3.46148695    0.21235608   -0.08159514    0.00559197    0.01692389    0.00053106
   15
   -420.53376887
H   -2.69581092    0.54470865   -0.06159597   -0.02046874   -0.01457517   -0.00296795
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O   -1.96390402   -1.26144491    0.02859311    0.00874851    0.01572354    0.00235044
C   -0.77620260    0.66862176   -0.04065876    0.00719903   -0.03187383   -0.00338408
C   -0.80050079   -0.81152157   -0.02224011    0.02477829   -0.02522327   -0.00335320
C    0.31121975    1.53971744    0.02364940    0.03336337    0.01062871   -0.00237108
C    0.36781032   -1.60362539    0.03750988   -0.04564420   -0.00899685   -0.00397368
C    1.67644491    1.22910645    0.03807175   -0.00640043   -0.03607266    0.00938448
C    1.73088286   -1.19499905   -0.01231140    0.01485402    0.02293731   -0.00014788
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H    2.44924501   -1.99621552    0.02704773   -0.00070018    0.01361347   -0.00067108
C    2.37729230    0.04943070   -0.06328413    0.02030752   -0.01826823   -0.00537833
H    3.45501735    0.21057275   -0.08161633    0.00095827    0.01621240    0.00058979
   15
   -420.53395637
H   -2.68962062    0.54492766   -0.06238482   -0.01833910   -0.01319956   -0.00290504
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O   -1.96257938   -1.26179050    0.02954740    0.01358656    0.01744532    0.00191837
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C   -0.80239404   -0.81609122   -0.02203471    0.02181214   -0.03180466   -0.00221185
C    0.31028935    1.53747978    0.02524228    0.02882030    0.00862960   -0.00221550
C    0.36439156   -1.60484644    0.03810026   -0.05160664   -0.00759901   -0.00409014
C    1.67686478    1.23081035    0.03911387   -0.00904031   -0.03609126    0.00952255
C    1.73174629   -1.19448172   -0.01471470    0.01923164    0.02010337   -0.00130900
H   -0.05451860    2.57143312    0.10148208   -0.01375919    0.00270636    0.00108088
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C    2.37736635    0.05063431   -0.06376241    0.02568690   -0.01742330   -0.00500487
H    3.44838072    0.20587625   -0.08174378   -0.00400541    0.01511442    0.00063667
   15
   -420.53440893
H   -2.68016134    0.54749572   -0.06265233   -0.01406144   -0.00986637   -0.00267789
O   -2.01201287    1.30517634   -0.01189927   -0.01781277    0.03835579    0.00548687
O   -1.96140863   -1.26233384    0.03047991    0.01817931    0.01902312    0.00148890
C   -0.77708068    0.67750371   -0.04861585    0.00790511   -0.01830393   -0.00518188
C   -0.80461631   -0.82018098   -0.02179584    0.01821812   -0.03758915   -0.00110237
C    0.30892453    1.53511129    0.02686863    0.02318543    0.00692774   -0.00201835
C    0.36175147   -1.60595252    0.03875235   -0.05625647   -0.00626418   -0.00414313
C    1.67742083    1.23305830    0.04001207   -0.01126984   -0.03476686    0.00961297
C    1.73232077   -1.19426956   -0.01709819    0.02210241    0.01824667   -0.00249390
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H    0.17549594   -2.65829199    0.24811575   -0.00118374   -0.00017649    0.00592577
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H    2.46100702   -1.97720710    0.04558320   -0.00169255    0.01827994    0.00006346
C    2.37705254    0.05210076   -0.06416506    0.03063527   -0.01610820   -0.00459416
H    3.44246034    0.19846261   -0.08198590   -0.00860880    0.01375147    0.00066286
   15
   -420.53501234
H   -2.66819842    0.55181354   -0.06243993   -0.00790349   -0.00468093   -0.00229380
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O   -1.96044374   -1.26309275    0.03139552    0.02239020    0.02037787    0.00106992
C   -0.77769658    0.68241167   -0.05248361    0.00804755   -0.01133960   -0.00602006
C   -0.80711336   -0.82370356   -0.02154022    0.01408642   -0.04243186   -0.00005271
C    0.30721015    1.53263799    0.02852548    0.01672897    0.00527522   -0.00180167
C    0.35996022   -1.60696363    0.03946699   -0.05945905   -0.00513670   -0.00412301
C    1.67814653    1.23583023    0.04076499   -0.01290466   -0.03205490    0.00965587
C    1.73256311   -1.19433474   -0.01944386    0.02329523    0.01756162   -0.00376143
H   -0.02815430    2.56354540    0.11434997   -0.00869738   -0.00369470    0.00079949
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H    2.46732230   -1.97246299    0.05486706   -0.00048874    0.01810962    0.00056834
C    2.37627708    0.05381032   -0.06449831    0.03432639   -0.01442850   -0.00413728
H    3.43807382    0.18857525   -0.08234680   -0.01208943    0.01224461    0.00064975
   15
   -420.53564078
H   -2.65483275    0.55695337   -0.06181600   -0.00038107    0.00192372   -0.00180238
O   -2.00962479    1.30402805   -0.01216436   -0.02520799    0.02400509    0.00522032
O   -1.95973236   -1.26408261    0.03229896    0.02608382    0.02148054    0.00067891
C   -0.77843406    0.68749114   -0.05626040    0.00808544   -0.00442599   -0.00680504
C   -0.80982286   -0.82658585   -0.02128371    0.00952352   -0.04622663    0.00092015
C    0.30524342    1.53008532    0.03020960    0.00976895    0.00329875   -0.00159505
C    0.35906611   -1.60789663    0.04024386   -0.06113067   -0.00435990   -0.00401424
C    1.67906646    1.23908522    0.04137198   -0.01381482   -0.02800694    0.00964977
C    1.73245518   -1.19466676   -0.02173254    0.02288751    0.01794096   -0.00512982
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H    2.47371011   -1.97095637    0.06404633    0.00178245    0.01636249    0.00122969
C    2.37498506    0.05573762   -0.06476908    0.03601589   -0.01243112   -0.00363300
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   15
   -420.53615130
H   -2.64140437    0.56173732   -0.06086792    0.00755294    0.00912237   -0.00127081
O   -2.00802464    1.30300150   -0.01238677   -0.02921021    0.01513238    0.00494803
O   -1.95931624   -1.26531580    0.03319467    0.02911854    0.02223788    0.00031978
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C   -0.81267596   -0.82877057   -0.02104097    0.00466901   -0.04889818    0.00179212
C    0.30312928    1.52748365    0.03191790    0.00256994    0.00058267   -0.00142764
C    0.35909431   -1.60876325    0.04108128   -0.06119950   -0.00398142   -0.00380410
C    1.68019436    1.24276227    0.04183311   -0.01394888   -0.02279636    0.00959673
C    1.73200274   -1.19527095   -0.02394353    0.02119811    0.01903784   -0.00659738
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H    2.47976650   -1.97237803    0.07300257    0.00477987    0.01340554    0.00202924
C    2.37315152    0.05785247   -0.06498496    0.03524828   -0.01010476   -0.00308728
H    3.43604629    0.16246923   -0.08340724   -0.01322883    0.00912242    0.00048814
   15
   -420.53653712
H   -2.62932208    0.56488972   -0.05968982    0.01456192    0.01556278   -0.00079969
O   -2.00609432    1.30180273   -0.01266532   -0.03192697    0.00681434    0.00470491
O   -1.95922971   -1.26680096    0.03408672    0.03137837    0.02261085    0.00001872
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C   -0.81559953   -0.83021736   -0.02082519   -0.00029453   -0.05041483    0.00254590
C    0.30097611    1.52487443    0.03364799   -0.00455070   -0.00320584   -0.00137044
C    0.36004590   -1.60956913    0.04197610   -0.05966821   -0.00405238   -0.00349115
C    1.68153215    1.24678286    0.04214920   -0.01326183   -0.01664859    0.00949829
C    1.73123088   -1.19616332   -0.02605474    0.01863475    0.02038488   -0.00810505
H    0.02180061    2.55795360    0.13266158   -0.00041061   -0.01086494    0.00034215
H    0.19916652   -2.66496641    0.26564547    0.00119173   -0.00155072    0.00601683
H    2.33050884    2.13467601    0.07377588    0.00698967    0.00263717   -0.00189542
H    2.48495848   -1.97620319    0.08159144    0.00803875    0.00975014    0.00295609
C    2.37078805    0.06011965   -0.06515421    0.03201471   -0.00740219   -0.00249892
H    3.43860482    0.14681334   -0.08407766   -0.01050858    0.00748994    0.00033929
   15
   -420.53687937
H   -2.61982643    0.56527441   -0.05836501    0.01917871    0.01964392   -0.00052225
O   -2.00380426    1.30052467   -0.01299736   -0.03200113    0.00067599    0.00459389
O   -1.95949830   -1.26854219    0.03497849    0.03273770    0.02253359   -0.00021476
C   -0.78137194    0.70272704   -0.06693053    0.00752779    0.01506032   -0.00883835
C   -0.81851874   -0.83090331   -0.02064774   -0.00517410   -0.05076879    0.00316807
C    0.29889138    1.52231521    0.03539898   -0.01136123   -0.00826690   -0.00144775
C    0.36189776   -1.61031319    0.04292359   -0.05656007   -0.00457176   -0.00308294
C    1.68306954    1.25105441    0.04232173   -0.01182032   -0.00989034    0.00935694
C    1.73017779   -1.19736358   -0.02804342    0.01562806    0.02147491   -0.00957771
H    0.03924438    2.55955975    0.13861277    0.00192381   -0.01080433    0.00036665
H    0.20480801   -2.66605217    0.26730572    0.00173031   -0.00156175    0.00586864
H    2.33825173    2.12749080    0.07861906    0.00644670   -0.00094417   -0.00185770
H    2.48870628   -1.98178087    0.08964760    0.01108222    0.00590574    0.00392985
C    2.36794304    0.06249814   -0.06528573    0.02673324   -0.00422566   -0.00188123
H    3.44302969    0.12981056   -0.08480865   -0.00604547    0.00573727    0.00015226
   15
   -420.53729038
H   -2.61373299    0.56217446   -0.05694360    0.02033723    0.02015937   -0.00046852
O   -2.00115449    1.29923583   -0.01338174   -0.02848406   -0.00205838    0.00469813
O   -1.96013737   -1.27053851    0.03587265    0.03311709    0.02193097   -0.00037683
C   -0.78258374    0.70747769   -0.07023299    0.00708858    0.02084630   -0.00942273
C   -0.82136005   -0.83082303   -0.02051803   -0.00976576   -0.04999103    0.00364831
C    0.29697787    1.51988237    0.03717200   -0.01769448   -0.01448035   -0.00164250
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   15
   -420.53771548
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   15
   -420.53806956
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   15
   -420.53817835
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   15
   -420.53802859
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C    1.69275972    1.27264974    0.04113231   -0.00130445    0.01790633    0.00770986
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   15
   -420.53770435
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C    1.69487119    1.27642218    0.04051849   -0.00061174    0.01949640    0.00702816
C    1.72042654   -1.21105909   -0.03634854    0.00113878    0.00817617   -0.01366377
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   15
   -420.53732764
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C   -0.83357353   -0.81597795   -0.02098883   -0.02160059   -0.02581821    0.00341867
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C    2.34220765    0.07745878   -0.06590112   -0.00870325    0.02543717    0.00142522
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   15
   -420.53699559
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O   -1.97382338   -1.29032278    0.04222269    0.00746889    0.00372592    0.00085723
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   15
   -420.53674979
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O   -1.97658985   -1.29362109    0.04311837    0.00098986   -0.00014297    0.00127027
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C    2.33521872    0.07925110   -0.06618711   -0.00699937    0.03087920    0.00154928
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   15
   -420.53650437
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   15
   -420.53623052
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C   -0.83565457   -0.79741797   -0.02233965   -0.01301693    0.00030435    0.00087826
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   15
   -420.53591176
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C    1.70799442    1.29343583    0.03513329   -0.00363582    0.00862266    0.00034414
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C    2.32537178    0.07843220   -0.06678310    0.00325592    0.03198190    0.00097766
H    3.39542979   -0.04487304   -0.08738992   -0.00934240   -0.01344275   -0.00045710
   15
   -420.53546294
H   -2.60020981    0.50387970   -0.02286733    0.00248140   -0.00272869   -0.00054409
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O   -1.98702474   -1.30636500    0.04650686   -0.02418511   -0.01478047    0.00303960
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C   -0.83536058   -0.78776084   -0.02313639   -0.00693525    0.01326856   -0.00077221
C    0.30851366    1.52928676    0.06072352   -0.01622750   -0.01923634    0.00432796
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   15
   -420.53495779
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   15
   -420.53457506
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   15
   -420.53451139
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   15
   -420.53483040
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   15
   -420.53553444
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   15
   -420.53637624
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   15
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   15
   -420.53752585
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   15
   -420.53768598
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   15
   -420.53774323
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   15
   -420.53786955
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   15
   -420.53814325
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C   -0.83212175   -0.76565478   -0.02352532    0.00043142    0.03671292   -0.00833763
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   15
   -420.53855011
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O   -1.98729113    1.25601945   -0.04258221   -0.00035718    0.01755589    0.00129543
O   -1.98161735   -1.32221418    0.05256871   -0.02462900   -0.02365897    0.00520708
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C    1.71534533   -1.23714147   -0.02512758    0.01585582    0.00257811    0.00113496
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H    3.39915595    0.07234355   -0.08125479    0.01181452    0.00513404    0.00130181
   15
   -420.53886377
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O   -1.97843598   -1.32134101    0.05262619   -0.01982510   -0.02145565    0.00505267
C   -0.74114511    0.68935250   -0.08059687    0.01591609   -0.02466660   -0.01628989
C   -0.83196442   -0.77024973   -0.02213300   -0.00109309    0.02605058   -0.00840311
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C    2.29066127    0.03568870   -0.06889523   -0.03237367   -0.03040617   -0.00470570
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   15
   -420.53896427
H   -2.63738119    0.48455154    0.03124601   -0.01252113   -0.00631830    0.00331945
O   -1.99062307    1.25225313   -0.04610531   -0.01386250    0.01183555    0.00103560
O   -1.97503012   -1.32022472    0.05262637   -0.01458824   -0.01895361    0.00486304
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C   -0.83186667   -0.77318060   -0.02124631   -0.00179000    0.01925139   -0.00829253
C    0.34631476    1.58930941    0.07587242    0.03364949    0.01592231    0.00881398
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C    1.72600488    1.31022110    0.02442656    0.01802041    0.00605411   -0.00602409
C    1.71804888   -1.23847181   -0.02275653    0.03061406   -0.00374047    0.00275968
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C    2.29197045    0.03381387   -0.06870048   -0.02491888   -0.03312110   -0.00515348
H    3.38365138    0.09530819   -0.08245776    0.00145612    0.00803629    0.00169272
   15
   -420.53862457
H   -2.62896865    0.48993761    0.03148386   -0.00660634   -0.00010119    0.00276996
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O   -1.97145914   -1.31889365    0.05257143   -0.00896424   -0.01620801    0.00463663
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C   -0.83174189   -0.77640162   -0.02023434   -0.00247209    0.01169015   -0.00810797
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C    0.35453117   -1.57021249    0.05736791   -0.02490299    0.01061157    0.00988388
C    1.72444948    1.30971714    0.02434736    0.01456261    0.00388308   -0.00609166
C    1.71876060   -1.23907659   -0.02162761    0.03575804   -0.00633721    0.00354351
H   -0.06513580    2.59695453    0.21107013   -0.01231867   -0.00121700    0.00165078
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H    2.41337919   -2.05314971   -0.08063855   -0.00520631    0.01044623   -0.00262784
C    2.29365501    0.03243861   -0.06842781   -0.01632792   -0.03484020   -0.00559736
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   15
   -420.53780394
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O   -1.96778679   -1.31737890    0.05246391   -0.00300717   -0.01329166    0.00438358
C   -0.72708333    0.68730694   -0.07030666    0.02977600   -0.02354014   -0.01306789
C   -0.83157958   -0.77979870   -0.01909985   -0.00322906    0.00357732   -0.00786698
C    0.34388290    1.59498789    0.07551098    0.02657262    0.02416426    0.00868569
C    0.34708798   -1.56742023    0.05627598   -0.03562645    0.01571638    0.00959718
C    1.72267376    1.30915351    0.02436001    0.01120382    0.00250417   -0.00594730
C    1.71893419   -1.23958680   -0.02055234    0.03883361   -0.00793101    0.00438491
H   -0.06603417    2.59187737    0.20955242   -0.01074904   -0.00593214    0.00118869
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H    2.41945678   -2.04617433   -0.09281223   -0.00447396    0.01218627   -0.00313361
C    2.29558607    0.03158891   -0.06807052   -0.00744382   -0.03556390   -0.00602481
H    3.36725664    0.11256846   -0.08487955   -0.01139349    0.00959952    0.00206666
   15
   -420.53661496
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O   -1.99417951    1.24580954   -0.05148751   -0.03903184   -0.00747262    0.00172772
O   -1.96408057   -1.31571348    0.05230669    0.00320330   -0.01027210    0.00410464
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C   -0.83136826   -0.78324952   -0.01784645   -0.00411612   -0.00482952   -0.00758906
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C    0.34018263   -1.56486544    0.05503904   -0.04560367    0.02071747    0.00923861
C    1.72072830    1.30855088    0.02446231    0.00812951    0.00205343   -0.00558135
C    1.71852325   -1.23997852   -0.01954351    0.03971163   -0.00836837    0.00534339
H   -0.06500055    2.58786532    0.20782031   -0.00896284   -0.01044906    0.00075046
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H    2.37991207    2.19210702    0.13139418    0.00374575    0.01310602    0.00418716
H    2.42632091   -2.04136964   -0.10442067   -0.00250712    0.01230496   -0.00375474
C    2.29763064    0.03127569   -0.06762219    0.00069455   -0.03530630   -0.00641337
H    3.36154698    0.11866784   -0.08663186   -0.01666400    0.00995922    0.00221110
   15
   -420.53545076
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O   -1.99460632    1.24372658   -0.05331642   -0.04517199   -0.01289345    0.00185758
O   -1.96041082   -1.31393154    0.05210292    0.00954663   -0.00724947    0.00380840
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C    0.33396557   -1.56262346    0.05366248   -0.05456556    0.02538173    0.00882299
C    1.71865939    1.30791610    0.02464877    0.00547614    0.00253469   -0.00501870
C    1.71751438   -1.24024500   -0.01861567    0.03852613   -0.00776055    0.00644612
H   -0.06235201    2.58572189    0.20595110   -0.00725286   -0.01409605    0.00043700
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H    2.39162609    2.18292564    0.12278646    0.00573113    0.01218629    0.00375435
H    2.43361975   -2.03875948   -0.11535565    0.00053478    0.01097190   -0.00443123
C    2.29966687    0.03149524   -0.06707698    0.00708196   -0.03419327   -0.00673178
H    3.35880740    0.12297660   -0.08878151   -0.01989112    0.01013419    0.00229896
   15
   -420.53460985
H   -2.59554035    0.49898092    0.02876207    0.01511876    0.02253477    0.00034805
O   -1.99452370    1.24178709   -0.05516610   -0.04810303   -0.01533888    0.00165001
O   -1.95684935   -1.31206732    0.05185594    0.01587426   -0.00430096    0.00350798
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C   -0.83074139   -0.78980532   -0.01499979   -0.00660178   -0.02134824   -0.00702717
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C    0.32857192   -1.56076453    0.05215259   -0.06224675    0.02947003    0.00835796
C    1.71650703    1.30724192    0.02491089    0.00334092    0.00390846   -0.00428052
C    1.71592500   -1.24039503   -0.01778545    0.03567646   -0.00644239    0.00766558
H   -0.05839320    2.58609469    0.20400021   -0.00586820   -0.01624609    0.00032058
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H    2.40231765    2.17156601    0.11350452    0.00706552    0.01017180    0.00317744
H    2.44081219   -2.03810913   -0.12549125    0.00425784    0.00857671   -0.00524022
C    2.30159908    0.03223082   -0.06643011    0.01098116   -0.03228897   -0.00694643
H    3.35960942    0.12546190   -0.09134367   -0.02041275    0.01023388    0.00229861
   15
   -420.53432319
H   -2.59216191    0.49297833    0.02771425    0.01433820    0.02124669    0.00048659
O   -1.99389893    1.24001815   -0.05703409   -0.04722249   -0.01404611    0.00100638
O   -1.95346774   -1.31015414    0.05156917    0.02199138   -0.00153089    0.00320592
C   -0.71484225    0.68941063   -0.05391707    0.04333718   -0.01716501   -0.00798512
C   -0.83028817   -0.79266130   -0.01341497   -0.00827772   -0.02885894   -0.00679138
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C    0.32411758   -1.55935024    0.05051638   -0.06841888    0.03279348    0.00785535
C    1.71430351    1.30650772    0.02523754    0.00176958    0.00603279   -0.00340189
C    1.71379762   -1.24044798   -0.01707119    0.03166577   -0.00485477    0.00893559
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H    2.41174778    2.15838871    0.10365171    0.00771065    0.00716720    0.00250716
H    2.44723527   -2.03899507   -0.13468274    0.00819833    0.00564258   -0.00609744
C    2.30336855    0.03345369   -0.06567839    0.01216980   -0.02965438   -0.00702217
H    3.36404549    0.12610601   -0.09431756   -0.01810561    0.01026832    0.00217568
   15
   -420.53452536
H   -2.59131990    0.48320196    0.02657281    0.01049905    0.01642638    0.00103550
O   -1.99274170    1.23840537   -0.05891313   -0.04286478   -0.00930702   -0.00003197
O   -1.95033517   -1.30822332    0.05124601    0.02766484    0.00096363    0.00292266
C   -0.71330223    0.69065351   -0.04946883    0.04589863   -0.01515070   -0.00668604
C   -0.82970949   -0.79508202   -0.01172741   -0.01020828   -0.03547564   -0.00661064
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C    0.32069558   -1.55843061    0.04876144   -0.07286170    0.03518597    0.00732541
C    1.71207265    1.30568154    0.02561548    0.00073815    0.00872165   -0.00243029
C    1.71119226   -1.24042722   -0.01649191    0.02700576   -0.00343921    0.01015222
H   -0.04743839    2.59556659    0.19989126   -0.00468712   -0.01460226    0.00082883
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H    2.41980170    2.14393064    0.09334816    0.00764705    0.00341242    0.00179241
H    2.45218929   -2.04089528   -0.14277644    0.01182337    0.00264362   -0.00693040
C    2.30495687    0.03512409   -0.06482068    0.01099846   -0.02632508   -0.00694403
H    3.37170591    0.12490308   -0.09768129   -0.01337450    0.01019623    0.00193073
   15
   -420.53493940
H   -2.59234052    0.47050194    0.02524122    0.00475643    0.00929563    0.00184115
O   -1.99110041    1.23689618   -0.06079158   -0.03612987   -0.00239310   -0.00131514
O   -1.94751579   -1.30630307    0.05088967    0.03264536    0.00308079    0.00266837
C   -0.71245561    0.69212542   -0.04491948    0.04797468   -0.01309254   -0.00540566
C   -0.82897629   -0.79696777   -0.00993980   -0.01229868   -0.04093320   -0.00650204
C    0.32912949    1.60230488    0.07148523    0.00181112    0.02095174    0.00411259
C    0.31837304   -1.55804182    0.04689573   -0.07545937    0.03659139    0.00678796
C    1.70983006    1.30472316    0.02603012    0.00018767    0.01168064   -0.00142929
C    1.70817883   -1.24035385   -0.01606597    0.02213329   -0.00250633    0.01123955
H   -0.04065601    2.60437162    0.19764216   -0.00481021   -0.01093819    0.00141569
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H    2.42648652    2.12886658    0.08272199    0.00704548   -0.00087883    0.00107022
H    2.45502461   -2.04327652   -0.14962399    0.01479045    0.00000143   -0.00764879
C    2.30638094    0.03719164   -0.06385816    0.00820050   -0.02229518   -0.00671434
H    3.38175086    0.12186622   -0.10139087   -0.00704490    0.00996925    0.00156554
   15
   -420.53527514
H   -2.59421119    0.45614004    0.02357760   -0.00149441    0.00142856    0.00269835
O   -1.98905022    1.23541365   -0.06265507   -0.02834162    0.00508562   -0.00264276
O   -1.94506585   -1.30441737    0.05050302    0.03667726    0.00474264    0.00245480
C   -0.71233355    0.69379531   -0.04028835    0.04939058   -0.01105075   -0.00416029
C   -0.82805709   -0.79823631   -0.00805380   -0.01440235   -0.04501529   -0.00646740
C    0.32624585    1.60212401    0.07049746   -0.00117081    0.01434638    0.00264135
C    0.31718903   -1.55820506    0.04492740   -0.07606856    0.03697656    0.00623569
C    1.70758420    1.30358829    0.02646640   -0.00003827    0.01456026   -0.00044848
C    1.70483062   -1.24024173   -0.01580970    0.01736405   -0.00227807    0.01211152
H   -0.03300439    2.61512787    0.19513665   -0.00515538   -0.00601871    0.00212253
H    0.07052998   -2.61787256    0.05137218   -0.00424330    0.00267807   -0.00150309
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   15
   -420.53553361
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   15
   -420.53581307
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   15
   -420.53633893
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   15
   -420.53725561
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   15
   -420.53861557
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   15
   -420.54025134
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   15
   -420.54185375
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   15
   -420.54311573
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   15
   -420.54370966
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   15
   -420.54352065
H   -2.52771661    0.40827274   -0.02813051    0.01254868    0.00602974    0.00127689
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   15
   -420.54264217
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C   -0.80165433   -0.77064604    0.01943563   -0.00120950    0.00166092   -0.00622726
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   15
   -420.54141315
H   -2.51311729    0.41105065   -0.04417412    0.02133565    0.01523002    0.00057449
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C    2.31994973    0.06489203   -0.04466674    0.03192997    0.03670528   -0.00167193
H    3.37939949   -0.00718239   -0.14752769   -0.01422179   -0.00624720   -0.00054513
   15
   -420.54017632
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O   -1.94752463   -1.28328512    0.04318224   -0.00983739   -0.01387145    0.00193375
C   -0.76200921    0.72243205    0.02036127   -0.03419264    0.00410873    0.00405465
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   15
   -420.53914018
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C   -0.76614834    0.72459482    0.02472682   -0.04179904    0.00546647    0.00416529
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C    0.37770028   -1.60383263    0.01183216    0.04714270   -0.00838039   -0.00350192
C    1.68443455    1.26882546    0.02827161   -0.01233936   -0.01981796    0.00708390
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C    2.31849624    0.06356128   -0.04109852    0.03105293    0.03635959   -0.00054586
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   15
   -420.53835587
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O   -1.94979509   -1.27909619    0.04169613   -0.01814875   -0.01753544    0.00159468
C   -0.76965773    0.72667477    0.02902931   -0.04757583    0.00696630    0.00433446
C   -0.78853439   -0.75393353    0.03237784    0.01223343    0.03010639   -0.00351854
C    0.30340074    1.60008830    0.05816962   -0.01650751    0.02201340   -0.00316882
C    0.38169810   -1.60814900    0.00950278    0.05288830   -0.01295275   -0.00411060
C    1.68419380    1.26682392    0.02775851   -0.00910754   -0.02107584    0.00693289
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   15
   -420.53768984
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O   -1.95064387   -1.27671334    0.04092494   -0.02102729   -0.01884995    0.00140006
C   -0.77245026    0.72864931    0.03326616   -0.05131824    0.00852831    0.00459848
C   -0.78560029   -0.75064541    0.03577521    0.01472251    0.03537346   -0.00264441
C    0.30399326    1.59906142    0.05771271   -0.01459410    0.01955075   -0.00325152
C    0.38489890   -1.61226952    0.00723547    0.05648091   -0.01750938   -0.00464475
C    1.68409014    1.26513986    0.02714076   -0.00537965   -0.02136973    0.00663604
C    1.65447051   -1.21586964   -0.03381609   -0.05204212    0.01030162    0.00127460
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C    2.31522303    0.06004750   -0.03750256    0.01893661    0.03277093    0.00154856
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   15
   -420.53702805
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O   -1.95334977    1.20015519   -0.08671660    0.05975839   -0.01875444   -0.00046771
O   -1.95125490   -1.27411705    0.04013789   -0.02306527   -0.01974925    0.00119136
C   -0.77446945    0.73049494    0.03743333   -0.05294814    0.01007023    0.00498404
C   -0.78288833   -0.74789096    0.03921249    0.01683725    0.03968102   -0.00172146
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C    0.38724843   -1.61612548    0.00503829    0.05786451   -0.02191285   -0.00510338
C    1.68406764    1.26377779    0.02642283   -0.00147522   -0.02075534    0.00621358
C    1.65489658   -1.21303452   -0.03572996   -0.05252197    0.01712949   -0.00005705
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H    2.32184277    2.14792127   -0.06074030   -0.00097424    0.00290532   -0.00396390
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C    2.31310538    0.05753231   -0.03573128    0.01032717    0.02954637    0.00279700
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   15
   -420.53632297
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O   -1.95410076    1.19958684   -0.08785081    0.06404466   -0.01414415   -0.00013657
O   -1.95160499   -1.27129717    0.03933733   -0.02431600   -0.02017733    0.00096746
C   -0.77569055    0.73218843    0.04152498   -0.05253244    0.01152106    0.00550346
C   -0.78043050   -0.74573522    0.04267576    0.01859378    0.04294935   -0.00076170
C    0.30580571    1.59619246    0.05694579   -0.00993646    0.00969884   -0.00308572
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C    1.68406765    1.26272858    0.02561106    0.00228423   -0.01936863    0.00570520
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H    2.30218546    2.15460863   -0.06260976   -0.00509796    0.00192509   -0.00360549
H    2.29088358   -2.12289002   -0.06695392   -0.00669411   -0.01799401    0.00123215
C    2.31083204    0.05457164   -0.03400224    0.00135338    0.02526805    0.00402938
H    3.38897556   -0.03518428   -0.15860298    0.00074105   -0.00911613   -0.00323712
   15
   -420.53568948
H   -2.55566523    0.36126653   -0.10201277   -0.00905170   -0.01202898   -0.00187472
O   -1.95557576    1.19917958   -0.08898336    0.06563682   -0.01026394    0.00008215
O   -1.95167991   -1.26824888    0.03852582   -0.02484547   -0.02009610    0.00072378
C   -0.77611967    0.73370789    0.04553326   -0.05024038    0.01283235    0.00615474
C   -0.77825341   -0.74422755    0.04615052    0.02001403    0.04513230    0.00022181
C    0.30695542    1.59449755    0.05663319   -0.00737315    0.00381894   -0.00277167
C    0.38934211   -1.62278348    0.00088087    0.05435902   -0.02952846   -0.00578305
C    1.68403365    1.26197160    0.02471312    0.00559225   -0.01745330    0.00513288
C    1.65809617   -1.20823149   -0.03953345   -0.04681012    0.02853448   -0.00292388
H    0.12322776    2.67143840    0.03831503    0.00739762    0.00528043    0.00009598
H    0.15862148   -2.68100300   -0.00012244    0.00175574    0.00072825    0.00094589
H    2.28344327    2.16095036   -0.06383069   -0.00903881    0.00086558   -0.00321339
H    2.29301630   -2.12208397   -0.05835701   -0.00658786   -0.01856485    0.00203222
C    2.30853751    0.05123027   -0.03233400   -0.00704602    0.01987888    0.00514793
H    3.39544191   -0.03449469   -0.15916688    0.00622157   -0.00909081   -0.00399174
   15
   -420.53528227
H   -2.56333727    0.35599323   -0.10970223   -0.01273907   -0.01439221   -0.00254242
O   -1.95779280    1.19888957   -0.09011669    0.06447470   -0.00727725    0.00013131
O   -1.95147362   -1.26497311    0.03770612   -0.02470911   -0.01949566    0.00045521
C   -0.77579113    0.73503351    0.04944835   -0.04633022    0.01399165    0.00692265
C   -0.77637852   -0.74340089    0.04962191    0.02110184    0.04619227    0.00121373
C    0.30821651    1.59274448    0.05636232   -0.00474912   -0.00171974   -0.00231000
C    0.38913871   -1.62547091   -0.00106910    0.04987128   -0.03228744   -0.00600461
C    1.68391604    1.26147823    0.02373756    0.00813672   -0.01529836    0.00455773
C    1.66078370   -1.20643554   -0.04137986   -0.04091930    0.03271025   -0.00435267
H    0.11892868    2.67602724    0.02670879    0.00599931    0.00981106   -0.00042470
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H    2.26632184    2.16713272   -0.06447355   -0.01253053    0.00004350   -0.00281130
H    2.29634209   -2.11795619   -0.05012588   -0.00697035   -0.01769321    0.00282479
C    2.30634800    0.04758963   -0.03074341   -0.01419572    0.01345113    0.00607149
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   15
   -420.53524753
H   -2.56873772    0.35329155   -0.11693483   -0.01491948   -0.01539795   -0.00314329
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O   -1.95098760   -1.26147668    0.03688129   -0.02396387   -0.01836789    0.00015777
C   -0.77476367    0.73614777    0.05325865   -0.04111683    0.01500487    0.00778138
C   -0.77482228   -0.74327129    0.05307496    0.02186104    0.04612140    0.00220140
C    0.30954946    1.59101634    0.05612625   -0.00214651   -0.00640233   -0.00173490
C    0.38818302   -1.62767124   -0.00292837    0.04391306   -0.03409837   -0.00615348
C    1.68367660    1.26121626    0.02269308    0.00971588   -0.01321111    0.00399549
C    1.66408794   -1.20513269   -0.04316054   -0.03339794    0.03566773   -0.00571003
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H    2.30092962   -2.11066331   -0.04240256   -0.00782141   -0.01540349    0.00356739
C    2.30437106    0.04374664   -0.02924429   -0.01964680    0.00617072    0.00672651
H    3.40428376   -0.02827572   -0.15803572    0.01348200   -0.00816164   -0.00503662
   15
   -420.53566703
H   -2.57147505    0.35334243   -0.12360324   -0.01551362   -0.01505499   -0.00362270
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O   -1.95023026   -1.25777238    0.03605469   -0.02265677   -0.01670982   -0.00016830
C   -0.77311569    0.73703531    0.05695124   -0.03493991    0.01590206    0.00869737
C   -0.77359616   -0.74383763    0.05649475    0.02228767    0.04491083    0.00316829
C    0.31091500    1.58938358    0.05591632    0.00036871   -0.00991787   -0.00108621
C    0.38656482   -1.62935733   -0.00469469    0.03677645   -0.03481912   -0.00623071
C    1.68329159    1.26115444    0.02158812    0.01021512   -0.01145329    0.00348582
C    1.66789569   -1.20436753   -0.04485505   -0.02467236    0.03732261   -0.00694529
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H    2.23931913    2.17950754   -0.06430202   -0.01729653    0.00009284   -0.00216553
H    2.30693093   -2.10061552   -0.03532019   -0.00905451   -0.01184727    0.00422387
C    2.30268870    0.03981113   -0.02784658   -0.02310130   -0.00173321    0.00711412
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   15
   -420.53648328
H   -2.57144284    0.35608369   -0.12962183   -0.01448169   -0.01332995   -0.00393417
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O   -1.94921642   -1.25387900    0.03523003   -0.02079676   -0.01454684   -0.00051807
C   -0.77094021    0.73768253    0.06051230   -0.02813185    0.01670716    0.00963417
C   -0.77270657   -0.74508163    0.05986669    0.02235238    0.04257562    0.00409659
C    0.31227513    1.58789913    0.05572277    0.00272636   -0.01208777   -0.00040513
C    0.38439164   -1.63051833   -0.00636689    0.02875336   -0.03441132   -0.00624085
C    1.68275344    1.26126637    0.02043041    0.00963004   -0.01016727    0.00302748
C    1.67207560   -1.20416512   -0.04644473   -0.01522382    0.03771728   -0.00802460
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H    0.19857558   -2.69897322   -0.01763287    0.00592618   -0.00145951    0.00059476
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H    2.31456575   -2.08844965   -0.02899660   -0.01052718   -0.00728808    0.00476946
C    2.30135307    0.03590220   -0.02655608   -0.02445317   -0.00993478    0.00721777
H    3.40382575   -0.01623414   -0.15333502    0.01408146   -0.00625032   -0.00520337
   15
   -420.53753343
H   -2.56882672    0.36120415   -0.13493473   -0.01183875   -0.01016291   -0.00405650
O   -1.97339094    1.19839737   -0.09463362    0.03609808   -0.00593625   -0.00178302
O   -1.94796718   -1.24982102    0.03441126   -0.01838059   -0.01191023   -0.00088250
C   -0.76833980    0.73807727    0.06392771   -0.02098721    0.01742604    0.01055517
C   -0.77215445   -0.74696803    0.06317675    0.02201484    0.03915205    0.00497118
C    0.31359431    1.58659569    0.05553538    0.00485980   -0.01281386    0.00024998
C    0.38178442   -1.63116035   -0.00794480    0.02014129   -0.03292965   -0.00618956
C    1.68207090    1.26153264    0.01922686    0.00804910   -0.00936104    0.00261347
C    1.67648554   -1.20453167   -0.04791331   -0.00564634    0.03702802   -0.00892376
H    0.09328562    2.67204416   -0.01792432    0.00138438    0.01457853   -0.00254391
H    0.20632017   -2.70321682   -0.02232161    0.00670508   -0.00281923    0.00048322
H    2.22455583    2.19163514   -0.06255360   -0.01852685    0.00305873   -0.00179479
H    2.32409589   -2.07498006   -0.02352980   -0.01200469   -0.00216109    0.00519080
C    2.30038457    0.03214340   -0.02537440   -0.02367461   -0.01807880    0.00705849
H    3.39978048   -0.00843318   -0.14958204    0.01178507   -0.00503876   -0.00495272
   15
   -420.53855463
H   -2.56410119    0.36813321   -0.13952020   -0.00769792   -0.00551793   -0.00397594
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O   -1.94650998   -1.24562832    0.03360250   -0.01538155   -0.00885494   -0.00124786
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   15
   -420.53926326
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C   -0.77203532   -0.75244611    0.06955945    0.01994920    0.02934830    0.00650007
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   15
   -420.53951056
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C   -0.77243695   -0.75588980    0.07260902    0.01808983    0.02316966    0.00712681
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H    0.07047353    2.64343986   -0.04706253    0.00029080    0.00275602   -0.00297640
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   15
   -420.53926886
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O   -1.94126547   -1.23260933    0.03127600   -0.00268671    0.00236729   -0.00212945
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C   -0.77311130   -0.75968299    0.07555096    0.01559438    0.01633767    0.00765084
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C    1.67852584    1.26396821    0.01407730   -0.00379903   -0.00820397    0.00093282
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C    2.29952779    0.02093570   -0.02163947   -0.00451936   -0.04301449    0.00465469
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   15
   -420.53880088
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C   -0.77402068   -0.76372260    0.07837734    0.01245708    0.00902817    0.00806709
C    0.31861858    1.58250733    0.05438687    0.01047544   -0.00062487    0.00226300
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C    1.69743448   -1.21429389   -0.05304778    0.02211490    0.03029735   -0.01132074
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H    2.40565568   -2.01782240   -0.01109725   -0.00701100    0.01248030    0.00614890
C    2.29970477    0.01956240   -0.02090810    0.00120463   -0.04590747    0.00399128
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   15
   -420.53828486
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C    0.31919046    1.58191178    0.05407238    0.01077059    0.00192270    0.00252443
C    0.36441768   -1.62619999   -0.01552223   -0.02895075   -0.01144292   -0.00515441
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H    0.04696940    2.61094512   -0.07154540    0.00064020   -0.01277988   -0.00230710
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C    2.29986512    0.01888126   -0.02023725    0.00556839   -0.04716466    0.00346327
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   15
   -420.53794454
H   -2.54042559    0.39188863   -0.15432830    0.01446030    0.01973694   -0.00229625
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C   -0.74715702    0.73305859    0.08271036    0.02408198    0.01850797    0.01504564
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C    1.67628785    1.26708038    0.01004944   -0.01223311   -0.00494146   -0.00080207
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C    2.29994370    0.01891130   -0.01961896    0.00790826   -0.04681518    0.00309461
H    3.36011974    0.05926335   -0.10399781   -0.01736124    0.00250156   -0.00124974
   15
   -420.53777196
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C   -0.74487833    0.73119831    0.08454521    0.02882826    0.01755095    0.01540265
C   -0.77763542   -0.77619866    0.08610817   -0.00051863   -0.01376762    0.00871915
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C    1.67585999    1.26829426    0.00871875   -0.01408150   -0.00307810   -0.00146448
C    1.70665482   -1.22580009   -0.05412858    0.01444511    0.02701837   -0.01158973
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C    2.29990557    0.01964723   -0.01904763    0.00795339   -0.04492929    0.00286323
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   15
   -420.53758904
H   -2.54928751    0.37598240   -0.15559355    0.00612170    0.00805102   -0.00318457
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O   -1.93287636   -1.21211831    0.02788151    0.02759399    0.02366883   -0.00207240
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C   -0.77891833   -0.78009397    0.08842468   -0.00547299   -0.02095119    0.00879193
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C    1.70922101   -1.23048065   -0.05413867    0.01010435    0.02431579   -0.01138661
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C    2.29974965    0.02106078   -0.01851968    0.00596784   -0.04164635    0.00270704
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   15
   -420.53725120
H   -2.55579975    0.36525710   -0.15541154    0.00059555    0.00041504   -0.00373774
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O   -1.93185296   -1.20863347    0.02727800    0.03330497    0.02751286   -0.00187727
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C    0.31978558    1.57921570    0.05236029    0.01332614   -0.00368105    0.00518913
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C    1.67565936    1.27082813    0.00613418   -0.01591781    0.00139194   -0.00283468
C    1.71163427   -1.23552740   -0.05397681    0.00588120    0.02043235   -0.01100907
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C    2.29950529    0.02310246   -0.01803265    0.00254798   -0.03710455    0.00254076
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   15
   -420.53662164
H   -2.56242720    0.35445059   -0.15455750   -0.00449982   -0.00672735   -0.00420793
O   -2.02537689    1.20922913   -0.10284930   -0.03570891    0.01063566   -0.01001402
O   -1.93120656   -1.20546039    0.02669580    0.03815148    0.03097344   -0.00168881
C   -0.74088558    0.72412120    0.08863560    0.03844299    0.01182352    0.01611789
C   -0.78116395   -0.78683652    0.09265841   -0.01463713   -0.03342891    0.00886817
C    0.31946303    1.57856945    0.05176849    0.01446339   -0.00823893    0.00626348
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C    1.67591434    1.27208091    0.00490097   -0.01590508    0.00369307   -0.00350609
C    1.71395792   -1.24088163   -0.05364873    0.00222369    0.01537064   -0.01045558
H    0.00737019    2.60174568   -0.10359940   -0.00403190   -0.00818226   -0.00379722
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H    2.32399889    2.15163975   -0.03436465   -0.00097372    0.00430744    0.00013187
H    2.52345659   -2.00570877   -0.03230068    0.02152921    0.00107038    0.00547197
C    2.29922324    0.02570378   -0.01758395   -0.00151767   -0.03146927    0.00229846
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   15
   -420.53582504
H   -2.56825931    0.34483618   -0.15294832   -0.00858210   -0.01256662   -0.00450152
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O   -1.93099183   -1.20263820    0.02613276    0.04179011    0.03392801   -0.00153273
C   -0.74066363    0.72135969    0.08951568    0.03966558    0.00888683    0.01621711
C   -0.78198895   -0.78949556    0.09457437   -0.01816477   -0.03834788    0.00893435
C    0.31892186    1.57804780    0.05108198    0.01556443   -0.01283080    0.00733814
C    0.36114058   -1.61467258   -0.02026740   -0.04392717    0.00609322   -0.00450482
C    1.67640914    1.27327808    0.00372074   -0.01534633    0.00578913   -0.00414498
C    1.71624688   -1.24646696   -0.05316274   -0.00054260    0.00925694   -0.00974801
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H    0.18391744   -2.68099828   -0.08069051    0.00670997    0.00235172    0.00010945
H    2.33969419    2.13740522   -0.03110676    0.00000830    0.00095349    0.00035889
H    2.53389118   -2.00617772   -0.03956233    0.02330738    0.00074830    0.00498420
C    2.29896406    0.02877977   -0.01716995   -0.00549644   -0.02492728    0.00195547
H    3.39209964    0.09787142   -0.06170515    0.00501084    0.00620308   -0.00078793
   15
   -420.53500995
H   -2.57256502    0.33745947   -0.15053029   -0.01131023   -0.01673640   -0.00461480
O   -2.03029833    1.21237775   -0.10301406   -0.03333760    0.02341831   -0.01023637
O   -1.93124978   -1.20020031    0.02558718    0.04392661    0.03628058   -0.00145773
C   -0.74103999    0.71846438    0.09015065    0.03974080    0.00547572    0.01624073
C   -0.78254058   -0.79157611    0.09635520   -0.02061399   -0.04216298    0.00904888
C    0.31814562    1.57771939    0.05028468    0.01645770   -0.01678182    0.00829697
C    0.36285496   -1.61284852   -0.02081349   -0.04226167    0.00850327   -0.00447518
C    1.67713543    1.27438824    0.00260312   -0.01434915    0.00747044   -0.00473971
C    1.71854272   -1.25219120   -0.05252951   -0.00219006    0.00227672   -0.00891379
H   -0.00507701    2.61196357   -0.11229753   -0.00706837    0.00111995   -0.00525777
H    0.17229361   -2.67584611   -0.08555030    0.00551463    0.00333720    0.00013635
H    2.35538850    2.12299901   -0.02791301    0.00094408   -0.00238303    0.00055246
H    2.54015114   -2.00679337   -0.04772023    0.02361062    0.00127609    0.00442897
C    2.29878716    0.03223183   -0.01678536   -0.00881298   -0.01768200    0.00147658
H    3.39979882    0.10272204   -0.05273086    0.00976020    0.00661770   -0.00048385
   15
   -420.53441244
H   -2.57485648    0.33307024   -0.14728472   -0.01252612   -0.01912895   -0.00450225
O   -2.03218572    1.21358725   -0.10292301   -0.03298121    0.02696169   -0.01045233
O   -1.93200445   -1.19817336    0.02505824    0.04436055    0.03796846   -0.00148749
C   -0.74201580    0.71548682    0.09054016    0.03863783    0.00164233    0.01618115
C   -0.78278211   -0.79302065    0.09799912   -0.02176284   -0.04475819    0.00923573
C    0.31712099    1.57764329    0.04936217    0.01699176   -0.01956743    0.00906523
C    0.36520709   -1.61115314   -0.02129195   -0.03953416    0.01098600   -0.00442623
C    1.67807821    1.27538619    0.00155709   -0.01301567    0.00855340   -0.00528013
C    1.72087015   -1.25794905   -0.05176163   -0.00258677   -0.00536855   -0.00798508
H   -0.00952625    2.61719297   -0.11529306   -0.00815259    0.00498339   -0.00581484
H    0.15968117   -2.67128500   -0.09043422    0.00410229    0.00370091    0.00013996
H    2.37091104    2.10901818   -0.02481822    0.00196582   -0.00545759    0.00070629
H    2.54218204   -2.00765062   -0.05667506    0.02242639    0.00262972    0.00384671
C    2.29874230    0.03595069   -0.01642296   -0.01113128   -0.00995291    0.00088073
H    3.40575971    0.10638506   -0.04367040    0.01319995    0.00681042   -0.00009865
   15
   -420.53417686
H   -2.57491475    0.33209856   -0.14323143   -0.01220717   -0.01972013   -0.00419453
O   -2.03369847    1.21449274   -0.10271334   -0.03321929    0.02851639   -0.01071771
O   -1.93326068   -1.19657648    0.02454628    0.04299740    0.03897265   -0.00164180
C   -0.74357441    0.71248484    0.09068511    0.03638820   -0.00251854    0.01604154
C   -0.78269629   -0.79379002    0.09950330   -0.02152172   -0.04606736    0.00949970
C    0.31584005    1.57786122    0.04830294    0.01705113   -0.02085926    0.00955954
C    0.36815567   -1.60962391   -0.02170340   -0.03577888    0.01346698   -0.00438857
C    1.67921758    1.27625570    0.00059082   -0.01148751    0.00891877   -0.00576158
C    1.72323518   -1.26362526   -0.05087307   -0.00174026   -0.01341905   -0.00700191
H   -0.01251408    2.62154129   -0.11724483   -0.00878143    0.00776745   -0.00616577
H    0.14633316   -2.66738048   -0.09534194    0.00248296    0.00343608    0.00008576
H    2.38607668    2.09601257   -0.02184995    0.00317276   -0.00806110    0.00081743
H    2.54019592   -2.00899205   -0.06632256    0.01984043    0.00471717    0.00327822
C    2.29886425    0.03981975   -0.01607377   -0.01223550   -0.00197419    0.00019707
H    3.40936719    0.10882546   -0.03459351    0.01506438    0.00679079    0.00037024
   15
   -420.53436250
H   -2.57279667    0.33465039   -0.13842571   -0.01038603   -0.01848961   -0.00371175
O   -2.03483383    1.21507658   -0.10238209   -0.03406756    0.02805648   -0.01100326
O   -1.93500307   -1.19542098    0.02405305    0.03989058    0.03925223   -0.00192163
C   -0.74568190    0.70952121    0.09058759    0.03307508   -0.00690606    0.01583032
C   -0.78228676   -0.79386449    0.10086369   -0.01989911   -0.04606790    0.00986378
C    0.31430199    1.57839251    0.04709953    0.01655869   -0.02048899    0.00975426
C    0.37164412   -1.60829834   -0.02204854   -0.03112829    0.01586094   -0.00433909
C    1.68053056    1.27699131   -0.00028843   -0.00987639    0.00852169   -0.00617984
C    1.72562516   -1.26909847   -0.04987864    0.00021540   -0.02157339   -0.00601383
H   -0.01392850    2.62451005   -0.11809025   -0.00889379    0.00925167   -0.00626903
H    0.13254215   -2.66408638   -0.10026451    0.00063888    0.00262817   -0.00001846
H    2.40066701    2.08444914   -0.01902837    0.00463451   -0.01004734    0.00089288
H    2.53465545   -2.01119112   -0.07656101    0.01605835    0.00737272    0.00276345
C    2.29916964    0.04371866   -0.01572749   -0.01206247    0.00602371   -0.00054229
H    3.41028701    0.11004625   -0.02558374    0.01524910    0.00656543    0.00087319
   15
   -420.53483355
H   -2.56883004    0.34050465   -0.13295375   -0.00710800   -0.01544152   -0.00309781
O   -2.03558220    1.21534405   -0.10192601   -0.03552892    0.02554762   -0.01129003
O   -1.93719652   -1.19471010    0.02358176    0.03520355    0.03885983   -0.00233103
C   -0.74828837    0.70666213    0.09025082    0.02884302   -0.01140654    0.01555171
C   -0.78157787   -0.79324403    0.10207485   -0.01702674   -0.04477782    0.01031282
C    0.31251431    1.57923153    0.04574901    0.01545991   -0.01843113    0.00963870
C    0.37560219   -1.60721236   -0.02232813   -0.02565553    0.01797651   -0.00428005
C    1.68199281    1.27759896   -0.00107430   -0.00823641    0.00741471   -0.00653898
C    1.72801097   -1.27424581   -0.04879326    0.00293879   -0.02945130   -0.00504572
H   -0.01374960    2.62583353   -0.11781082   -0.00846997    0.00933484   -0.00611293
H    0.11863791   -2.66126006   -0.10518299   -0.00133446    0.00144121   -0.00016534
H    2.41441906    2.07468498   -0.01636716    0.00634391   -0.01135718    0.00093849
H    2.52623598   -2.01472116   -0.08729819    0.01145554    0.01028681    0.00233075
C    2.29965587    0.04752674   -0.01537299   -0.01062113    0.01381515   -0.00129585
H    3.40848588    0.11008798   -0.01673115    0.01375144    0.00614378    0.00137416
   15
   -420.53540741
H   -2.56360245    0.34911339   -0.12692475   -0.00253405   -0.01062832   -0.00242435
O   -2.03592702    1.21532351   -0.10134189   -0.03756234    0.02105058   -0.01154423
O   -1.93978808   -1.19443946    0.02313701    0.02920464    0.03784833   -0.00284193
C   -0.75133005    0.70397549    0.08967899    0.02388124   -0.01589360    0.01521863
C   -0.78061279   -0.79194801    0.10312999   -0.01312965   -0.04228303    0.01083044
C    0.31049364    1.58034728    0.04425313    0.01373714   -0.01476970    0.00922196
C    0.37994735   -1.60639753   -0.02254296   -0.01950752    0.01955647   -0.00423918
C    1.68357956    1.27809519   -0.00176138   -0.00656864    0.00574251   -0.00684194
C    1.73035201   -1.27894878   -0.04763155    0.00592704   -0.03655625   -0.00410918
H   -0.01205333    2.62549664   -0.11643455   -0.00753094    0.00802601   -0.00570657
H    0.10497406   -2.65869094   -0.11007095   -0.00336400    0.00011573   -0.00032800
H    2.42702639    2.06695588   -0.01387457    0.00823237   -0.01200757    0.00096084
H    2.51575875   -2.02010096   -0.09845623    0.00655341    0.01304040    0.00198558
C    2.30030127    0.05112646   -0.01499893   -0.00801610    0.02118571   -0.00202174
H    3.40423187    0.10902610   -0.00812540    0.01067993    0.00555557    0.00183763
   15
   -420.53580971
H   -2.55793302    0.35961337   -0.12045934    0.00303736   -0.00430597   -0.00174095
O   -2.03584538    1.21506578   -0.10062689   -0.04000786    0.01479132   -0.01170888
O   -1.94271005   -1.19459766    0.02272456    0.02224133    0.03630348   -0.00342046
C   -0.75473221    0.70152900    0.08887710    0.01842408   -0.02023933    0.01484988
C   -0.77945007   -0.79001400    0.10402130   -0.00849738   -0.03871162    0.01141356
C    0.30826600    1.58168466    0.04261813    0.01140462   -0.00972037    0.00854070
C    0.38458680   -1.60587751   -0.02269361   -0.01281992    0.02042851   -0.00424982
C    1.68526552    1.27850507   -0.00234508   -0.00481999    0.00369216   -0.00708975
C    1.73260389   -1.28310067   -0.04640770    0.00853248   -0.04229803   -0.00318080
H   -0.00900787    2.62373331   -0.11403412   -0.00613677    0.00544453   -0.00508123
H    0.09191546   -2.65614351   -0.11489863   -0.00537640   -0.00115103   -0.00054009
H    2.43815050    2.06138045   -0.01155472    0.01018694   -0.01208940    0.00096753
H    2.50409650   -2.02781807   -0.10997212    0.00200763    0.01507853    0.00168558
C    2.30106667    0.05440663   -0.01459438   -0.00443584    0.02793103   -0.00268396
H    3.39807455    0.10696619    0.00015058    0.00627011    0.00483349    0.00223107
   15
   -420.53598820
H   -2.55281583    0.37087409   -0.11367863    0.00901401    0.00294565   -0.00116690
O   -2.03530986    1.21464129   -0.09977917   -0.04248542    0.00741578   -0.01175304
O   -1.94588380   -1.19516711    0.02235096    0.01470743    0.03421961   -0.00404043
C   -0.75841265    0.69938819    0.08785072    0.01273026   -0.02430837    0.01445908
C   -0.77815932   -0.78749587    0.10474008   -0.00347211   -0.03419946    0.01201041
C    0.30586662    1.58316774    0.04085427    0.00852001   -0.00362202    0.00764642
C    0.38941954   -1.60566514   -0.02278000   -0.00572903    0.02039439   -0.00429564
C    1.68702414    1.27885929   -0.00282163   -0.00290913    0.00149459   -0.00728656
C    1.73472804   -1.28661542   -0.04513583    0.01011689   -0.04608714   -0.00219582
H   -0.00486255    2.62100477   -0.11072124   -0.00439109    0.00184309   -0.00429415
H    0.07982211   -2.65339414   -0.11963082   -0.00724389   -0.00214663   -0.00071443
H    2.44744203    2.05797494   -0.00940890    0.01204676   -0.01172024    0.00096386
H    2.49205838   -2.03823118   -0.12179107   -0.00154973    0.01583394    0.00135728
C    2.30189838    0.05726547   -0.01414938   -0.00023064    0.03387041   -0.00325132
H    3.39080204    0.10403727    0.00802613    0.00092185    0.00403456    0.00253809
   15
   -420.53585933
H   -2.54931549    0.38160852   -0.10668740    0.01457393    0.00994982   -0.00070735
O   -2.03429302    1.21413272   -0.09879830   -0.04429679    0.00001810   -0.01161545
O   -1.94922417   -1.19612444    0.02202322    0.00694696    0.03179151   -0.00466831
C   -0.76228559    0.69761440    0.08660573    0.00705267   -0.02795232    0.01406384
C   -0.77681618   -0.78446160    0.10527726    0.00164048   -0.02892487    0.01261423
C    0.30333897    1.58470492    0.03897497    0.00519240    0.00302230    0.00661478
C    0.39433868   -1.60575989   -0.02280134    0.00154682    0.01936669   -0.00441133
C    1.68882644    1.27919078   -0.00318809   -0.00076133   -0.00061355   -0.00742868
C    1.73670105   -1.28943631   -0.04383095    0.01023128   -0.04746205   -0.00106775
H    0.00007055    2.61795348   -0.10663652   -0.00244248   -0.00236559   -0.00342314
H    0.06903068   -2.65026542   -0.12423447   -0.00891791   -0.00270168   -0.00088147
H    2.45456857    2.05667490   -0.00743650    0.01364513   -0.01103858    0.00095329
H    2.48027790   -2.05146946   -0.13385248   -0.00365463    0.01484935    0.00089853
C    2.30273346    0.05961337   -0.01365535    0.00406556    0.03883945   -0.00371364
H    3.38336865    0.10038291    0.01544612   -0.00477040    0.00318669    0.00274769
   15
   -420.53562422
H   -2.54841762    0.39057541   -0.09956652    0.01861012    0.01534975   -0.00041723
O   -2.03277511    1.21362267   -0.09768585   -0.04454067   -0.00598624   -0.01129355
O   -1.95264347   -1.19744208    0.02174841   -0.00068718    0.02904712   -0.00527204
C   -0.76626548    0.69626256    0.08514809    0.00162762   -0.03104234    0.01367132
C   -0.77549756   -0.78099069    0.10562376    0.00653748   -0.02305940    0.01319245
C    0.30073315    1.58619653    0.03699567    0.00159366    0.00954890    0.00555593
C    0.39923445   -1.60614619   -0.02275590    0.00880475    0.01729510   -0.00459220
C    1.69063990    1.27953121   -0.00344229    0.00168165   -0.00243680   -0.00751556
C    1.73852126   -1.29154274   -0.04251017    0.00879737   -0.04627152    0.00027697
H    0.00544316    2.61532861   -0.10193560   -0.00047089   -0.00660584   -0.00256615
H    0.05984032   -2.64665811   -0.12868005   -0.01028824   -0.00270857   -0.00100707
H    2.45924446    2.05735934   -0.00563565    0.01483954   -0.01016859    0.00093792
H    2.46913218   -2.06735366   -0.14607291   -0.00418225    0.01197290    0.00023123
C    2.30350777    0.06137537   -0.01310529    0.00776806    0.04271132   -0.00407662
H    3.37678835    0.09615420    0.02237242   -0.01005164    0.00235991    0.00288324
   15
   -420.53546816
H   -2.55083732    0.39682474   -0.09236789    0.02021277    0.01775990   -0.00028041
O   -2.03075418    1.21317814   -0.09644542   -0.04234029   -0.00932689   -0.01083326
O   -1.95605533   -1.19908907    0.02153337   -0.00793006    0.02609520   -0.00583243
C   -0.77027054    0.69537924    0.08348375   -0.00336433   -0.03344930    0.01328157
C   -0.77427726   -0.77717167    0.10577083    0.01099547   -0.01676640    0.01372303
C    0.29810331    1.58754484    0.03493232   -0.00206084    0.01519757    0.00455986
C    0.40399740   -1.60679276   -0.02264094    0.01581886    0.01421474   -0.00484803
C    1.69242754    1.27990794   -0.00358293    0.00444012   -0.00379984   -0.00754460
C    1.74020999   -1.29295242   -0.04119385    0.00612196   -0.04275457    0.00186509
H    0.01090416    2.61388393   -0.09677184    0.00128853   -0.01019681   -0.00180790
H    0.05249679   -2.64257202   -0.13294502   -0.01129657   -0.00211515   -0.00109051
H    2.46125627    2.05987331   -0.00400357    0.01551866   -0.00922146    0.00091693
H    2.45872012   -2.08536875   -0.15833095   -0.00338931    0.00739818   -0.00071094
C    2.30416627    0.06249303   -0.01249368    0.01012959    0.04538462   -0.00437091
H    3.37199977    0.09149985    0.02878019   -0.01409673    0.00158270    0.00297807
   15
   -420.53554175
H   -2.55685212    0.39992906   -0.08511785    0.01880111    0.01660642   -0.00020746
O   -2.02825566    1.21283641   -0.09508218   -0.03720837   -0.00938717   -0.01030295
O   -1.95937776   -1.20103192    0.02138445   -0.01457992    0.02300375   -0.00633594
C   -0.77422541    0.69500070    0.08161861   -0.00782266   -0.03506548    0.01288484
C   -0.77322250   -0.77309944    0.10571050    0.01486828   -0.01022965    0.01418416
C    0.29550446    1.58866534    0.03279984   -0.00556648    0.01922893    0.00371122
C    0.40852174   -1.60765316   -0.02245260    0.02234938    0.01022902   -0.00516166
C    1.69414768    1.28034141   -0.00360957    0.00749025   -0.00457257   -0.00751533
C    1.74180693   -1.29371783   -0.03990599    0.00280722   -0.03746057    0.00365626
H    0.01613920    2.61425592   -0.09128035    0.00263165   -0.01247183   -0.00122107
H    0.04718089   -2.63811341   -0.13701437   -0.01189666   -0.00094201   -0.00112017
H    2.46048270    2.06404750   -0.00253646    0.01561611   -0.00827910    0.00088950
H    2.44890624   -2.10469873   -0.17045772   -0.00177513    0.00165434   -0.00188449
C    2.30467401    0.06292601   -0.01181602    0.01052201    0.04680794   -0.00463910
H    3.36972097    0.08655947    0.03465157   -0.01621048    0.00087570    0.00308163
   15
   -420.53582095
H   -2.56620995    0.40008938   -0.07783077    0.01453602    0.01229753   -0.00011144
O   -2.02533758    1.21259855   -0.09360206   -0.02931156   -0.00654566   -0.00977721
O   -1.96253547   -1.20323560    0.02130733   -0.02050148    0.01983249   -0.00677461
C   -0.77806268    0.69515129    0.07955869   -0.01174559   -0.03581519    0.01246079
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   15
   -420.53608412
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C   -0.78172295    0.69584230    0.07731043   -0.01518122   -0.03566001    0.01199333
C   -0.77183338   -0.76459119    0.10494105    0.02061524    0.00294189    0.01485689
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C    1.69719801    1.28141459   -0.00332346    0.01414597   -0.00404029   -0.00728744
C    1.74492194   -1.29364815   -0.03752501   -0.00304267   -0.02447322    0.00742039
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   15
   -420.53615775
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O   -1.96809718   -1.20828212    0.02138761   -0.02995495    0.01356102   -0.00744479
C   -0.78515411    0.69707136    0.07488091   -0.01825294   -0.03458492    0.01145908
C   -0.77158592   -0.76035396    0.10422179    0.02250162    0.00928685    0.01505116
C    0.28839604    1.59022133    0.02610182   -0.01382984    0.01798177    0.00220266
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C    2.30540407    0.05999761   -0.00934472   -0.00094521    0.04350599   -0.00555869
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   15
   -420.53592656
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O   -1.97039394   -1.21105386    0.02155261   -0.03348530    0.01052129   -0.00767363
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C   -0.77167795   -0.75625674    0.10327507    0.02378842    0.01529817    0.01515500
C    0.28639466    1.59015872    0.02379434   -0.01576813    0.01376806    0.00189335
C    0.42243527   -1.61188521   -0.02086577    0.04007172   -0.01065254   -0.00647344
C    1.69939356    1.28271800   -0.00259764    0.02062473   -0.00072856   -0.00685588
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H    0.03139897    2.63701290   -0.06754650    0.00299953   -0.00360157   -0.00077316
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H    2.43074615    2.09415095    0.00180190    0.01055078   -0.00520549    0.00069789
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C    2.30557450    0.05766778   -0.00835941   -0.00730334    0.03998083   -0.00587686
H    3.38723025    0.06628857    0.05223790   -0.00427192   -0.00126602    0.00407597
   15
   -420.53546679
H   -2.61778891    0.39006852   -0.04889482   -0.01190714   -0.01112409    0.00105406
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O   -1.97231154   -1.21394505    0.02180463   -0.03627810    0.00762508   -0.00784643
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C   -0.77212900   -0.75239027    0.10209934    0.02452905    0.02086138    0.01516089
C    0.28463132    1.58988898    0.02145827   -0.01739411    0.00869338    0.00156085
C    0.42453260   -1.61274567   -0.02023580    0.04202067   -0.01562419   -0.00660696
C    1.70004786    1.28340019   -0.00207751    0.02336963    0.00175886   -0.00657866
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C    2.30585527    0.05473480   -0.00728532   -0.01359881    0.03534927   -0.00613693
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   15
   -420.53498080
H   -2.62825005    0.39018905   -0.04197683   -0.01647545   -0.01398430    0.00141512
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O   -1.97381825   -1.21692287    0.02214561   -0.03838523    0.00491344   -0.00795957
C   -0.79362355    0.70375702    0.06659183   -0.02645428   -0.02614083    0.00937287
C   -0.77295032   -0.74883857    0.10069447    0.02476683    0.02588201    0.01508737
C    0.28313069    1.58948792    0.01909870   -0.01877346    0.00350423    0.00114303
C    0.42599571   -1.61337086   -0.01950612    0.04303830   -0.01980073   -0.00658857
C    1.70034942    1.28405536   -0.00145796    0.02555907    0.00458640   -0.00626894
C    1.75173119   -1.28975828   -0.03428400   -0.00073353   -0.00474520    0.01223686
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H    2.38818937   -2.19132825   -0.22796000    0.00008201   -0.02304400   -0.00817607
C    2.30634062    0.05126855   -0.00611857   -0.01909146    0.02973014   -0.00629838
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   15
   -420.53466779
H   -2.63577145    0.39280344   -0.03531311   -0.01928644   -0.01514613    0.00174147
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O   -1.97489013   -1.21995663    0.02257682   -0.03984725    0.00242547   -0.00801441
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C   -0.77414557   -0.74567744    0.09906160    0.02454387    0.03026714    0.01493236
C    0.28191371    1.58903323    0.01672203   -0.01994127   -0.00117185    0.00061639
C    0.42680907   -1.61369792   -0.01867706    0.04322228   -0.02289771   -0.00637280
C    1.70026535    1.28464099   -0.00074365    0.02705996    0.00754771   -0.00593344
C    1.75353161   -1.28845648   -0.03390317    0.00321353   -0.00288343    0.01240975
H    0.03723466    2.66235527   -0.04831079    0.00092897    0.01049296   -0.00049646
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H    2.37718628   -2.19381110   -0.23319842   -0.00242092   -0.02221876   -0.00826196
C    2.30711299    0.04735383   -0.00485674   -0.02326074    0.02326550   -0.00632960
H    3.41080018    0.05309164    0.05792450    0.00972433   -0.00219694    0.00476381
   15
   -420.53467256
H   -2.63984846    0.39811993   -0.02896169   -0.02018121   -0.01462248    0.00198440
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O   -1.97551059   -1.22301809    0.02309888   -0.04068185    0.00019329   -0.00800392
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C   -0.77571127   -0.74297301    0.09720308    0.02384587    0.03391570    0.01468907
C    0.28099804    1.58859504    0.01433616   -0.02089757   -0.00488158   -0.00000422
C    0.42696990   -1.61368027   -0.01775200    0.04262327   -0.02473086   -0.00591014
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C    1.75528214   -1.28710931   -0.03370941    0.00825190   -0.00247324    0.01210979
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C    2.30823506    0.04308814   -0.00349940   -0.02577797    0.01614842   -0.00621245
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   15
   -420.53507890
H   -2.64032098    0.40604458   -0.02296605   -0.01908753   -0.01241744    0.00211630
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O   -1.97567015   -1.22608200    0.02371168   -0.04089451   -0.00174623   -0.00793674
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C   -0.77763698   -0.74078040    0.09512256    0.02269614    0.03675556    0.01436677
C    0.28039810    1.58822906    0.01195047   -0.02164784   -0.00733044   -0.00070868
C    0.42648715   -1.61329036   -0.01673787    0.04129994   -0.02522284   -0.00522046
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C    1.75690687   -1.28572305   -0.03369819    0.01413522   -0.00346256    0.01135542
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H    2.35503718    2.15147120    0.00454668   -0.00023386    0.00024326    0.00027428
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C    2.30974466    0.03857882   -0.00204832   -0.02645938    0.00859065   -0.00594676
H    3.41935892    0.04617319    0.05751130    0.01307757   -0.00246466    0.00468425
   15
   -420.53570824
H   -2.63738691    0.41618082   -0.01734914   -0.01597109   -0.00852588    0.00209500
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C   -0.77990531   -0.73914246    0.09282484    0.02108180    0.03872177    0.01397529
C    0.28012514    1.58797215    0.00957555   -0.02215312   -0.00837196   -0.00145471
C    0.42538078   -1.61252058   -0.01564508    0.03929449   -0.02449160   -0.00430555
C    1.69753493    1.28554375    0.00191576    0.02660007    0.01531695   -0.00482864
C    1.75831723   -1.28428300   -0.03385818    0.02051927   -0.00561815    0.01020935
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C    2.31165200    0.03393988   -0.00050749   -0.02525215    0.00081908   -0.00553795
H    3.42022268    0.04336905    0.05603313    0.01239737   -0.00250518    0.00445967
   15
   -420.53642235
H   -2.63160536    0.42782799   -0.01210674   -0.01095322   -0.00296964    0.00189053
O   -1.99603228    1.20904117   -0.07356877    0.03846355   -0.01489375   -0.00414159
O   -1.97460436   -1.23213352    0.02520570   -0.03933120   -0.00457716   -0.00760875
C   -0.79924965    0.72171026    0.05012732   -0.03735651   -0.00018611    0.00505789
C   -0.78249184   -0.73808887    0.09031590    0.01897705    0.03975807    0.01350983
C    0.28018688    1.58784007    0.00722265   -0.02244756   -0.00797430   -0.00222109
C    0.42368116   -1.61138178   -0.01448742    0.03659190   -0.02271864   -0.00320680
C    1.69580645    1.28542972    0.00295584    0.02479178    0.01711482   -0.00443875
C    1.75941734   -1.28275710   -0.03417220    0.02691080   -0.00850318    0.00879767
H    0.04263815    2.67000727   -0.02191108    0.00041708    0.01357092    0.00121636
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H    2.32239004    2.17571729    0.00518424   -0.00329953    0.00421183    0.00006295
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C    2.31393891    0.02928854    0.00111692   -0.02220850   -0.00693799   -0.00500393
H    3.41887667    0.04101533    0.05375359    0.01019167   -0.00250648    0.00412835
   15
   -420.53700029
H   -2.62387508    0.43998904   -0.00720218   -0.00437382    0.00400263    0.00149909
O   -1.99488267    1.20874724   -0.07117804    0.03528161   -0.02369994   -0.00321665
O   -1.97339684   -1.23508894    0.02608319   -0.03744853   -0.00545374   -0.00735074
C   -0.79879000    0.72564822    0.04655309   -0.03793942    0.00552075    0.00429667
C   -0.78536465   -0.73763526    0.08760279    0.01633142    0.03983326    0.01297064
C    0.28058775    1.58782690    0.00490331   -0.02252766   -0.00620539   -0.00296997
C    0.42142909   -1.60990040   -0.01328139    0.03322659   -0.02018740   -0.00198863
C    1.69370397    1.28505747    0.00406303    0.02229072    0.01845707   -0.00404206
C    1.76011132   -1.28110258   -0.03461914    0.03269605   -0.01142596    0.00730949
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H    0.12417526   -2.64877998   -0.17046495   -0.00268897   -0.00189052   -0.00341072
H    2.30682550    2.18688840    0.00547639   -0.00452264    0.00637553   -0.00005048
H    2.34133465   -2.15912170   -0.23912425   -0.02027065    0.00096519   -0.00409359
C    2.31655956    0.02474180    0.00281686   -0.01750088   -0.01445416   -0.00436741
H    3.41571577    0.03911233    0.05073216    0.00662836   -0.00247874    0.00370775
   15
   -420.53729393
H   -2.61536951    0.45141953   -0.00256565    0.00298688    0.01169027    0.00096448
O   -1.99413164    1.20872249   -0.06875086    0.03033979   -0.03277325   -0.00226436
O   -1.97176527   -1.23798287    0.02704401   -0.03475632   -0.00593151   -0.00703158
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C   -0.78848367   -0.73778274    0.08469362    0.01310916    0.03894645    0.01236721
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   15
   -420.53738584
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   15
   -420.53755894
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   15
   -420.53798344
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C   -0.79878337   -0.74162857    0.07488571   -0.00033514    0.03092110    0.01020978
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   15
   -420.53876182
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O   -1.96175630   -1.24890267    0.03164004   -0.01542270   -0.00394068   -0.00534702
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C   -0.80230501   -0.74391033    0.07129247   -0.00601991    0.02669481    0.00940550
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   15
   -420.53971884
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O   -1.95865753   -1.25149687    0.03295337   -0.00868932   -0.00257158   -0.00488883
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C   -0.80573512   -0.74659495    0.06755706   -0.01212964    0.02184995    0.00857824
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C    1.75267986   -1.26732875   -0.03910570    0.02749911   -0.00051405    0.00435264
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   15
   -420.54052446
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O   -1.95546063   -1.25406208    0.03432217   -0.00148857   -0.00096366   -0.00444098
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C    1.74963475   -1.26465996   -0.04008763    0.02075686    0.00385046    0.00433765
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C    2.33689423    0.00422344    0.01595145    0.01813381   -0.04660883    0.00070861
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   15
   -420.54094341
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O   -1.95224703   -1.25661651    0.03574136    0.00591934    0.00080593   -0.00402117
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C   -0.81194920   -0.75287300    0.05970978   -0.02469174    0.01082654    0.00691356
C    0.29529987    1.58706402   -0.01132470   -0.01040443    0.00662135   -0.00625822
C    0.39112732   -1.59068978   -0.00407963   -0.00598610   -0.00280887    0.00590300
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   15
   -420.54085614
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C   -0.81454400   -0.75630012    0.05562304   -0.03053601    0.00494389    0.00610130
C    0.29824792    1.58645158   -0.01297106   -0.00619962    0.00233150   -0.00645518
C    0.38693180   -1.58787601   -0.00321230   -0.01079176   -0.00245129    0.00632099
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C    2.34106446    0.00398446    0.01977076    0.01550485   -0.04652180    0.00243166
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   15
   -420.54040685
H   -2.61145655    0.41305580    0.03443836   -0.01396446   -0.01182935    0.00368289
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C   -0.81667806   -0.75980198    0.05144403   -0.03559312   -0.00094799    0.00531179
C    0.30128916    1.58580463   -0.01451987   -0.00152314   -0.00252797   -0.00661827
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   15
   -420.53980923
H   -2.61063054    0.40401622    0.03680994   -0.01625080   -0.01601546    0.00403091
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O   -1.94333338   -1.26441751    0.04025562    0.02610360    0.00603827   -0.00296780
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C    0.30435316    1.58519565   -0.01596868    0.00338456   -0.00719712   -0.00672450
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H    2.48641123   -2.08180434   -0.18187516    0.02075005   -0.01022333   -0.00533783
C    2.34430613    0.00653676    0.02344122    0.01099213   -0.04199173    0.00449751
H    3.43992121    0.04400126   -0.00856557    0.00679554   -0.00073416   -0.00141937
   15
   -420.53933498
H   -2.60690803    0.39783457    0.03845950   -0.01657948   -0.01841117    0.00414198
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O   -1.94085835   -1.26712949    0.04183265    0.03099715    0.00736282   -0.00268036
C   -0.76342852    0.74782546    0.00063480    0.02454439    0.03263357    0.00007880
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C    0.30736599    1.58469448   -0.01731591    0.00828440   -0.01103504   -0.00675401
C    0.37559262   -1.57923893   -0.00120479   -0.02345947   -0.00020184    0.00734797
C    1.65885162    1.25719022    0.02041436   -0.02861400    0.01550228    0.00019073
C    1.73167214   -1.25281213   -0.04581108   -0.00685986    0.00500848   -0.00035638
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H    2.49458494   -2.06993425   -0.17114526    0.02223185   -0.00828605   -0.00450883
C    2.34566041    0.00878456    0.02518243    0.00954618   -0.03816543    0.00560214
H    3.44773939    0.04602979   -0.01423538    0.01116740   -0.00059277   -0.00204346
   15
   -420.53919650
H   -2.60022740    0.39494156    0.03936699   -0.01504571   -0.01899771    0.00402307
O   -2.00403974    1.23799092   -0.03803718    0.00986238    0.01611611   -0.00426923
O   -1.93873363   -1.26992462    0.04344009    0.03447925    0.00829017   -0.00240869
C   -0.76061674    0.74650252   -0.00329426    0.02816354    0.02989169   -0.00021914
C   -0.81964390   -0.76988336    0.03847068   -0.04283878   -0.01686480    0.00309313
C    0.31025388    1.58435857   -0.01856115    0.01291637   -0.01356468   -0.00668850
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C    1.65713375    1.25300152    0.02186805   -0.03264026    0.01255612    0.00042050
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   15
   -420.53945408
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   15
   -420.53997839
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   15
   -420.54051989
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   15
   -420.54085273
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   15
   -420.54079582
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   15
   -420.54038140
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   15
   -420.53987554
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   15
   -420.53953987
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   15
   -420.53949388
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   15
   -420.53962679
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O   -1.93704712   -1.30195606    0.06035532    0.00149157   -0.00723102    0.00244965
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   15
   -420.53965723
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C    1.67560817    1.21270092    0.03679221   -0.01453107   -0.05414718    0.00246431
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H    3.40798119    0.07680813   -0.03420132   -0.01356115    0.00133332   -0.00408486
   15
   -420.53935221
H   -2.56338563    0.42763680    0.02209461    0.00614089   -0.00673513   -0.00014190
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O   -1.93878592   -1.30825328    0.06362862   -0.00809969   -0.01251223    0.00392535
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C   -0.79337126   -0.77892937   -0.01452579    0.02762593   -0.01738012   -0.00678961
C    0.32200599    1.58444672   -0.02715531    0.00672338    0.02830439   -0.00137653
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C    1.68004372    1.21207377    0.03797985   -0.00734873   -0.05771945    0.00265649
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   15
   -420.53866159
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O   -1.93954407   -1.31120382    0.06520266   -0.01212007   -0.01487478    0.00465784
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   15
   -420.53765839
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   15
   -420.53661395
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C   -0.76644432    0.70884346   -0.05838222    0.01068401   -0.02501601   -0.00761340
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C    1.69360008    1.21551385    0.04128889    0.01202729   -0.05865392    0.00333860
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   15
   -420.53579643
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O   -1.94084657   -1.31895300    0.06957688   -0.02071813   -0.02020834    0.00661537
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C    0.31943484    1.57577275   -0.02871690   -0.00241987    0.00817185    0.00084972
C    0.38011748   -1.56555526   -0.01016488    0.01141769   -0.00239996    0.00365498
C    1.69787733    1.21844997    0.04229580    0.01669531   -0.05550511    0.00361473
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   15
   -420.53543509
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O   -1.94084843   -1.32110142    0.07089430   -0.02236424   -0.02130098    0.00715211
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C    0.38212979   -1.56713991   -0.01155004    0.01575944   -0.00811068    0.00327485
C    1.70190365    1.22222344    0.04324804    0.02012348   -0.05081168    0.00391439
C    1.68827408   -1.19143674   -0.04707284   -0.02489321    0.05103643   -0.01270536
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   15
   -420.53564306
H   -2.63382449    0.45729183    0.01330060   -0.01429744   -0.01744972   -0.00085910
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O   -1.94059720   -1.32300851    0.07213066   -0.02335142   -0.02204929    0.00761252
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C    0.31823801    1.57034169   -0.02953974   -0.00578873   -0.00118711    0.00193378
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C    1.70562730    1.22676363    0.04414106    0.02225673   -0.04484714    0.00423549
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H    0.12087664    2.66068078   -0.05581216    0.00358503    0.01477057   -0.00266434
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   15
   -420.53626971
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O   -1.94008171   -1.32466579    0.07328074   -0.02365452   -0.02242585    0.00798186
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C    0.38538174   -1.56987517   -0.01446280    0.02317767   -0.01607898    0.00241872
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C    2.32397831    0.04771350    0.02834981   -0.03023164    0.02338634    0.00847267
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   15
   -420.53709264
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O   -2.00412895    1.26791575    0.01618600    0.00028371    0.01310466    0.00675960
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C   -0.79382298   -0.76316040   -0.04319541    0.03315946    0.01415863   -0.01201083
C    0.31738721    1.56495783   -0.03047845   -0.00836946   -0.00573246    0.00278323
C    0.38650934   -1.57090583   -0.01597735    0.02616716   -0.01792735    0.00186409
C    1.71205590    1.23777074    0.04572991    0.02295511   -0.03041591    0.00490891
C    1.68977225   -1.18874697   -0.04141944   -0.00835438    0.05089287   -0.00993500
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H    2.28893265   -2.10544015    0.02652726   -0.01135793   -0.01016063    0.00287768
C    2.32286140    0.04439150    0.02671308   -0.02981927    0.01347283    0.00709311
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   15
   -420.53772486
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O   -1.93825345   -1.32721719    0.07530634   -0.02192700   -0.02217164    0.00843587
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C   -0.79627481   -0.76155187   -0.04604447    0.03043462    0.01696825   -0.01231235
C    0.31714222    1.56238136   -0.03100790   -0.00936855   -0.00596871    0.00309186
C    0.38724202   -1.57166716   -0.01751989    0.02856286   -0.01836647    0.00119868
C    1.71474983    1.24402026    0.04641559    0.02191301   -0.02261808    0.00524342
C    1.69064863   -1.18942005   -0.03921325   -0.00149193    0.04648212   -0.00865065
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C    2.32219307    0.04086616    0.02496920   -0.02753644    0.00325082    0.00563957
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   15
   -420.53792717
H   -2.64097395    0.53307445    0.00997177    0.00675302    0.01271832   -0.00078334
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O   -1.93696023   -1.32811436    0.07617672   -0.01984179   -0.02150069    0.00850880
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C   -0.79918592   -0.76019913   -0.04870750    0.02697690    0.01914470   -0.01250591
C    0.31703866    1.55989361   -0.03158399   -0.01018156   -0.00496330    0.00331581
C    0.38754362   -1.57215222   -0.01908036    0.03025981   -0.01759799    0.00041310
C    1.71711313    1.25061173    0.04702200    0.02030069   -0.01480595    0.00557026
C    1.69154782   -1.19079423   -0.03687638    0.00515320    0.04068184   -0.00727102
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H    2.26576189   -2.09410617    0.03194016   -0.02238337    0.00285905    0.00132643
C    2.32193917    0.03729143    0.02314007   -0.02368083   -0.00677071    0.00417181
H    3.41593202    0.06572727    0.04001024    0.00417440    0.00553269   -0.00150759
   15
   -420.53779155
H   -2.64282489    0.55023210    0.00953600    0.01299533    0.02060500   -0.00057652
O   -1.99946520    1.26432388    0.02249273   -0.01117620   -0.02087557    0.00619439
O   -1.93544272   -1.32876796    0.07695068   -0.01690460   -0.02048598    0.00847357
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C   -0.80250403   -0.75913500   -0.05118157    0.02279308    0.02062472   -0.01258851
C    0.31708880    1.55747966   -0.03221010   -0.01081131   -0.00297485    0.00346045
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C    1.71916986    1.25742728    0.04754422    0.01838134   -0.00718532    0.00588715
C    1.69237021   -1.19278299   -0.03442964    0.01084790    0.03445903   -0.00588121
H    0.12354159    2.63253178   -0.06619397    0.00720390    0.00423837   -0.00352937
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H    2.25972273   -2.08860075    0.03421593   -0.02664367    0.00895187    0.00057028
C    2.32204195    0.03381826    0.02124781   -0.01870224   -0.01613724    0.00274049
H    3.40916187    0.05911012    0.05001846   -0.00035916    0.00514220   -0.00106245
   15
   -420.53757960
H   -2.64697716    0.56372468    0.00920486    0.01659984    0.02546927   -0.00038309
O   -1.99771645    1.26343061    0.02445039   -0.01234635   -0.02854099    0.00585751
O   -1.93373423   -1.32918952    0.07762862   -0.01311969   -0.01911469    0.00833096
C   -0.79038641    0.71184831   -0.08127138   -0.01783188   -0.00495801   -0.00907659
C   -0.80616594   -0.75838180   -0.05346548    0.01790569    0.02135962   -0.01254757
C    0.31730216    1.55511003   -0.03288848   -0.01124034   -0.00045848    0.00355014
C    0.38676470   -1.57235336   -0.02220733    0.03101664   -0.01350329   -0.00127985
C    1.72094873    1.26435187    0.04797745    0.01640584    0.00010056    0.00618813
C    1.69303071   -1.19529363   -0.03189383    0.01480416    0.02894449   -0.00459556
H    0.12078779    2.62189697   -0.06643296    0.00802086   -0.00103887   -0.00352669
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   15
   -420.53766536
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O   -1.99583112    1.26285706    0.02634158   -0.00975497   -0.03188679    0.00555618
O   -1.93187762   -1.32939460    0.07821220   -0.00853502   -0.01739516    0.00807093
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   15
   -420.53815248
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O   -1.92992487   -1.32940266    0.07870432   -0.00322027   -0.01534414    0.00770469
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C   -0.81421579   -0.75784106   -0.05746704    0.00624869    0.02055495   -0.01210633
C    0.31824009    1.55035538   -0.03440691   -0.01117465    0.00369193    0.00363020
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H    2.27155275   -2.08410096    0.04081656   -0.02672977    0.01303592   -0.00057437
C    2.32371562    0.02534011    0.01540368   -0.00339221   -0.03721331   -0.00118937
H    3.39255634    0.03411058    0.08094642   -0.01254839    0.00325217   -0.00011880
   15
   -420.53881384
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O   -1.92793614   -1.32923693    0.07910914    0.00269579   -0.01299175    0.00723959
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C    0.31896335    1.54790926   -0.03524822   -0.01042238    0.00398112    0.00366351
C    0.38216508   -1.57123735   -0.02672408    0.02488563   -0.00538500   -0.00343215
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H    2.28549128   -2.08741705    0.04316941   -0.02194200    0.00876441   -0.00048262
C    2.32447300    0.02351482    0.01346593   -0.00041908   -0.04131139   -0.00246995
H    3.39067665    0.02443903    0.09136680   -0.01397850    0.00241584    0.00021126
   15
   -420.53929405
H   -2.68851494    0.57459413    0.00845767   -0.00537831    0.00903194   -0.00054353
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O   -1.92597838   -1.32892409    0.07943192    0.00904710   -0.01038423    0.00668613
C   -0.79634859    0.71720927   -0.08790893   -0.02453761    0.01173376   -0.00840670
C   -0.82263543   -0.75852960   -0.06073888   -0.00701774    0.01698092   -0.01120464
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C    0.37982567   -1.57064836   -0.02813890    0.02100815   -0.00308700   -0.00387785
C    1.72584027    1.29103667    0.04873171    0.01074444    0.02481059    0.00729646
C    1.69341203   -1.20929540   -0.02120667    0.00704196    0.02349463   -0.00123175
H    0.09452372    2.58955269   -0.06108169    0.00822230   -0.01411235   -0.00347852
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H    2.30335575   -2.09228737    0.04560701   -0.01548827    0.00286587   -0.00023646
C    2.32523888    0.02231221    0.01156563    0.00078162   -0.04381856   -0.00383039
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   15
   -420.53930730
H   -2.70014095    0.57028184    0.00845168   -0.01391656    0.00203038   -0.00077248
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O   -1.92412346   -1.32849359    0.07967893    0.01561914   -0.00760914    0.00606188
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C   -0.82673698   -0.75927385   -0.06211706   -0.01376775    0.01434873   -0.01062883
C    0.32085926    1.54286626   -0.03709737   -0.00692063   -0.00094430    0.00370190
C    0.37716955   -1.57001207   -0.02949534    0.01637578   -0.00125549   -0.00414316
C    1.72661417    1.29698752    0.04865464    0.01011465    0.02984929    0.00754828
C    1.69308985   -1.21368419   -0.01846230    0.00110653    0.02366463   -0.00063926
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C    2.32599501    0.02177022    0.00972340    0.00027178   -0.04475789   -0.00531246
H    3.39428043    0.00396895    0.11200728   -0.01096317    0.00035860    0.00127015
   15
   -420.53878603
H   -2.70928710    0.56558404    0.00858465   -0.02070872   -0.00358661   -0.00098804
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O   -1.92244569   -1.32797684    0.07985719    0.02217037   -0.00476119    0.00540268
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C    0.32197895    1.54034340   -0.03810573   -0.00412024   -0.00582784    0.00366346
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C    1.72723484    1.30248759    0.04846349    0.00973526    0.03443346    0.00778250
C    1.69275105   -1.21842932   -0.01570833   -0.00492412    0.02264872    0.00000211
H    0.07243005    2.58666441   -0.05464691    0.00509935   -0.00963417   -0.00347952
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H    2.34611555   -2.10243398    0.05055296   -0.00090517   -0.00919126    0.00037830
C    2.32674863    0.02190318    0.00796165   -0.00154996   -0.04421597   -0.00691203
H    3.39922930   -0.00645843    0.12203626   -0.00706903   -0.00089951    0.00204408
   15
   -420.53776935
H   -2.71473971    0.56150836    0.00889551   -0.02510290   -0.00745135   -0.00117422
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O   -1.92101914   -1.32740607    0.07997419    0.02842437   -0.00195752    0.00473703
C   -0.79704320    0.71962618   -0.09154270   -0.02454337    0.02059986   -0.00789093
C   -0.83421831   -0.76136649   -0.06440121   -0.02628772    0.00809237   -0.00933825
C    0.32316023    1.53790966   -0.03916936   -0.00074854   -0.01155587    0.00354056
C    0.37119668   -1.56870105   -0.03201934    0.00531395    0.00097531   -0.00420256
C    1.72770814    1.30746767    0.04815469    0.00951790    0.03849714    0.00800055
C    1.69248594   -1.22351482   -0.01295449   -0.01036870    0.01994676    0.00072812
H    0.05985098    2.58807410   -0.05048957    0.00282809   -0.00532401   -0.00340618
H    0.18345267   -2.63047458    0.15143761    0.00554996   -0.00397630    0.00678071
H    2.33335343    2.21293844    0.15224539   -0.00099707    0.00795968    0.00171607
H    2.36840554   -2.10556434    0.05295279    0.00579959   -0.01364178    0.00061242
C    2.32752651    0.02270306    0.00630448   -0.00404270   -0.04233111   -0.00858352
H    3.40543911   -0.01672135    0.13169539   -0.00237251   -0.00231135    0.00294824
   15
   -420.53653948
H   -2.71571195    0.55874617    0.00941730   -0.02683606   -0.00937424   -0.00130399
O   -1.98476310    1.26677884    0.03786881    0.03850944   -0.00550069    0.00564131
O   -1.91991457   -1.32681299    0.08003746    0.03411763    0.00068188    0.00409525
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C   -0.83740942   -0.76262066   -0.06532656   -0.03153470    0.00479003   -0.00869859
C    0.32435241    1.53565077   -0.04028639    0.00298279   -0.01737263    0.00331263
C    0.36804681   -1.56806029   -0.03318595   -0.00079139    0.00156791   -0.00405283
C    1.72803743    1.31186641    0.04772497    0.00938379    0.04196337    0.00818354
C    1.69237633   -1.22889965   -0.01021178   -0.01477660    0.01539653    0.00156126
H    0.04676646    2.59043577   -0.04572031    0.00031974   -0.00056711   -0.00324700
H    0.19775478   -2.62893997    0.14791190    0.00828800   -0.00145225    0.00623849
H    2.32108094    2.22192255    0.15546038   -0.00315891    0.00721635    0.00164244
H    2.38966656   -2.10626319    0.05524382    0.01145849   -0.01641868    0.00074666
C    2.32836554    0.02414158    0.00477710   -0.00655936   -0.03929412   -0.01024912
H    3.41207452   -0.02656587    0.14082318    0.00243029   -0.00383536    0.00390474
   15
   -420.53532888
H   -2.71189271    0.55764308    0.01017347   -0.02585107   -0.00933521   -0.00137507
O   -1.98449262    1.26790713    0.03926807    0.03701847   -0.00493778    0.00575579
O   -1.91919621   -1.32622739    0.08005421    0.03895008    0.00301530    0.00352105
C   -0.79565166    0.71976067   -0.09336386   -0.02283059    0.02309988   -0.00770740
C   -0.84012496   -0.76394740   -0.06612032   -0.03577815    0.00160078   -0.00811141
C    0.32549938    1.53365378   -0.04145337    0.00681262   -0.02257846    0.00297469
C    0.36490907   -1.56744310   -0.03429133   -0.00703085    0.00206491   -0.00385621
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C    1.69248849   -1.23451515   -0.00749279   -0.01782920    0.00910446    0.00248416
H    0.03362515    2.59290359   -0.04036784   -0.00225772    0.00393147   -0.00299413
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H    2.30937608    2.22960985    0.15838008   -0.00524838    0.00630368    0.00154385
H    2.40888386   -2.10403184    0.05740158    0.01582349   -0.01739104    0.00078355
C    2.32930309    0.02617309    0.00340460   -0.00853490   -0.03533271   -0.01183738
H    3.41828019   -0.03571961    0.14924864    0.00669632   -0.00539936    0.00481525
   15
   -420.53432880
H   -2.70345797    0.55819385    0.01117647   -0.02221524   -0.00737359   -0.00137831
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O   -1.91891872   -1.32567554    0.08003092    0.04270254    0.00489183    0.00305363
C   -0.79443109    0.71931201   -0.09409900   -0.02159076    0.02321891   -0.00768096
C   -0.84230101   -0.76529867   -0.06679133   -0.03880853   -0.00131109   -0.00760712
C    0.32654334    1.53199679   -0.04266520    0.01052274   -0.02664186    0.00252801
C    0.36187758   -1.56685738   -0.03533839   -0.01319768    0.00275566   -0.00365956
C    1.72827281    1.31872182    0.04649257    0.00898815    0.04657756    0.00837973
C    1.69286843   -1.24026627   -0.00481150   -0.01934625    0.00122761    0.00350032
H    0.02088330    2.59467471   -0.03447763   -0.00460294    0.00764202   -0.00265331
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H    2.42527791   -2.09869314    0.05941901    0.01861689   -0.01662000    0.00073226
C    2.33036854    0.02873798    0.00221082   -0.00954610   -0.03069429   -0.01322998
H    3.42329396   -0.04390292    0.15680815    0.00997627   -0.00693078    0.00561556
   15
   -420.53359268
H   -2.69105950    0.56004420    0.01242677   -0.01611708   -0.00347016   -0.00132298
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O   -1.91912446   -1.32517868    0.07997288    0.04516522    0.00623237    0.00272086
C   -0.79288435    0.71851318   -0.09471795   -0.02012310    0.02260648   -0.00769944
C   -0.84389198   -0.76663065   -0.06734719   -0.04046992   -0.00379303   -0.00721465
C    0.32742871    1.53074084   -0.04391513    0.01381792   -0.02923834    0.00199166
C    0.35904558   -1.56631383   -0.03633008   -0.01916951    0.00389958   -0.00350886
C    1.72818507    1.32110908    0.04568698    0.00858524    0.04744783    0.00835815
C    1.69353888   -1.24603433   -0.00218321   -0.01918458   -0.00795339    0.00457435
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H    2.28912632    2.24173899    0.16340249   -0.00865971    0.00469015    0.00137889
H    2.43834322   -2.09038743    0.06130615    0.01981394   -0.01411994    0.00057593
C    2.33157691    0.03176638    0.00121676   -0.00937571   -0.02558764   -0.01437493
H    3.42653002   -0.05084069    0.16335912    0.01197734   -0.00834742    0.00622348
   15
   -420.53308896
H   -2.67578871    0.56249420    0.01391441   -0.00802227    0.00215603   -0.00120951
O   -1.98595713    1.27169253    0.04306855    0.01637346   -0.01179975    0.00610240
O   -1.91984123   -1.32475195    0.07988382    0.04621117    0.00694857    0.00254993
C   -0.79103366    0.71737338   -0.09522044   -0.01841494    0.02130903   -0.00776158
C   -0.84487282   -0.76790590   -0.06779380   -0.04068708   -0.00574598   -0.00695358
C    0.32810592    1.52992496   -0.04519510    0.01648543   -0.03019500    0.00139348
C    0.35650292   -1.56583002   -0.03726865   -0.02468853    0.00569983   -0.00344036
C    1.72796775    1.32278031    0.04475517    0.00800108    0.04721241    0.00823390
C    1.69449730   -1.25168098    0.00037587   -0.01728939   -0.01814835    0.00568610
H   -0.00175461    2.59368611   -0.02134027   -0.00830952    0.01135086   -0.00179440
H    0.23581844   -2.62475595    0.12364420    0.01618738    0.00673871    0.00412277
H    2.28119145    2.24646427    0.16553446   -0.00975409    0.00435698    0.00136113
H    2.44786583   -2.07956289    0.06309133    0.01931541   -0.01001623    0.00032050
C    2.33292544    0.03518136    0.00043972   -0.00790460   -0.02022467   -0.01522290
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   15
   -420.53270181
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O   -1.92108086   -1.32440344    0.07976570    0.04579885    0.00700233    0.00254738
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C   -0.84524025   -0.76909504   -0.06813510   -0.03946450   -0.00708531   -0.00683179
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C    1.72762964    1.32373909    0.04369900    0.00726389    0.04584537    0.00800499
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   15
   -420.53237500
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O   -1.92283872   -1.32413376    0.07961852    0.04397242    0.00639304    0.00271848
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C    0.32868769    1.52964583   -0.04780863    0.01921737   -0.02713377    0.00013352
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C    2.33593499    0.04284573   -0.00041750   -0.00124839   -0.00931098   -0.01587959
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   15
   -420.53215553
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O   -1.92509418   -1.32393602    0.07944036    0.04084727    0.00515925    0.00304957
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C    0.32855122    1.53013649   -0.04912320    0.01905473   -0.02330877   -0.00046487
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C    1.72663678    1.32361855    0.04122904    0.00561051    0.03992304    0.00724221
C    1.69868975   -1.26630505    0.00746967   -0.00248828   -0.05133239    0.00895553
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H    3.41843244   -0.06161196    0.17798365    0.00577196   -0.01159340    0.00608130
   15
   -420.53214208
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O   -1.92781197   -1.32379631    0.07922749    0.03660237    0.00338224    0.00351224
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C   -0.84294088   -0.77199186   -0.06853575   -0.02877273   -0.00729652   -0.00721045
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C    0.35073131   -1.56519953   -0.04049570   -0.03873507    0.01907040   -0.00368318
C    1.72600674    1.32262835    0.03982672    0.00491810    0.03570759    0.00675359
C    1.70027883   -1.26985171    0.00958497    0.00386433   -0.06124142    0.00986331
H   -0.02830846    2.56965050    0.00817695   -0.00921545    0.00204316   -0.00022688
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H    2.45670084   -2.02913334    0.07033032    0.00303259    0.01609816   -0.00130850
C    2.33900115    0.05107519   -0.00032109    0.00909043    0.00122005   -0.01519807
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   15
   -420.53246866
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O   -1.93094418   -1.32369450    0.07897466    0.03147691    0.00113115    0.00408573
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C   -0.84121956   -0.77273028   -0.06845523   -0.02368759   -0.00623079   -0.00751076
C    0.32743646    1.53209474   -0.05172331    0.01562761   -0.01237474   -0.00147619
C    0.35065402   -1.56562123   -0.04116599   -0.03944626    0.02268709   -0.00364577
C    1.72530205    1.32109891    0.03832233    0.00446449    0.03095170    0.00622768
C    1.70181051   -1.27247495    0.01155140    0.00937805   -0.06906567    0.01056001
H   -0.03065876    2.56113048    0.01581192   -0.00809732   -0.00291529   -0.00001873
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H    2.45526729   -2.02063275    0.07253223   -0.00184394    0.02180337   -0.00165062
C    2.34036892    0.05520176    0.00007508    0.01468898    0.00623603   -0.01448136
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   15
   -420.53311232
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O   -1.93443284   -1.32360522    0.07867544    0.02567946   -0.00143332    0.00472154
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C   -0.83914048   -0.77337503   -0.06826111   -0.01828402   -0.00472854   -0.00785091
C    0.32650957    1.53339814   -0.05299356    0.01269486   -0.00620703   -0.00188531
C    0.35117153   -1.56638520   -0.04178133   -0.03883166    0.02569470   -0.00346491
C    1.72452947    1.31910189    0.03672379    0.00433274    0.02589845    0.00569653
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H    2.45414299   -2.01602524    0.07502882   -0.00515561    0.02529294   -0.00182317
C    2.34151520    0.05923425    0.00069005    0.01978630    0.01108812   -0.01364567
H    3.40093469   -0.04856043    0.17756910   -0.00821948   -0.01074859    0.00385656
   15
   -420.53401047
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O   -1.93821241   -1.32349946    0.07832261    0.01944922   -0.00422723    0.00539135
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C   -0.83678509   -0.77394868   -0.06794827   -0.01279771   -0.00291002   -0.00820331
C    0.32539124    1.53479590   -0.05423535    0.00933711   -0.00046039   -0.00226948
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C    1.72369092    1.31671336    0.03503910    0.00457332    0.02079799    0.00519139
C    1.70440304   -1.27452933    0.01500036    0.01368890   -0.07470185    0.01099675
H   -0.03125526    2.54659728    0.03107151   -0.00514268   -0.01281106    0.00019759
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H    2.27541465    2.25224207    0.17225902   -0.00643343    0.00970162    0.00275010
H    2.45391243   -2.01592856    0.07785022   -0.00610056    0.02585033   -0.00176199
C    2.34236377    0.06309927    0.00151135    0.02369094    0.01579204   -0.01281509
H    3.39691313   -0.04022837    0.17585043   -0.01203125   -0.01001147    0.00314981
   15
   -420.53505884
H   -2.60047313    0.50321115    0.03360778    0.00311862   -0.00489814   -0.00234833
O   -1.99134777    1.28879964    0.04990898   -0.00950170    0.01831888    0.00941632
O   -1.94221237   -1.32334575    0.07790864    0.01297943   -0.00708960    0.00605812
C   -0.76933847    0.69987917   -0.09483011    0.00628932   -0.00283863   -0.00919905
C   -0.83423611   -0.77447860   -0.06751140   -0.00740501   -0.00088513   -0.00854431
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C    1.72278275    1.31401016    0.03327586    0.00519254    0.01585953    0.00473413
C    1.70539999   -1.27387632    0.01647637    0.01147367   -0.07165362    0.01065804
H   -0.03002626    2.54234467    0.03865490   -0.00380149   -0.01632830    0.00031681
H    0.17798779   -2.65174986    0.04091054    0.00806997   -0.00770503    0.00214336
H    2.28058793    2.24737264    0.17160168   -0.00535197    0.00993603    0.00295859
H    2.45474387   -2.02044029    0.08098500   -0.00453226    0.02330132   -0.00144218
C    2.34285644    0.06672571    0.00252657    0.02573077    0.02034101   -0.01211335
H    3.39503513   -0.03009565    0.17356189   -0.01429912   -0.00915514    0.00264879
   15
   -420.53614317
H   -2.60059898    0.48822957    0.03747586   -0.00224415   -0.01261141   -0.00243805
O   -1.99134440    1.29108678    0.05034539   -0.00622804    0.02872459    0.00969421
O   -1.94635952   -1.32311168    0.07742598    0.00645434   -0.00990680    0.00668723
C   -0.76646933    0.69734242   -0.09418833    0.01023189   -0.00626788   -0.00939096
C   -0.83157487   -0.77499529   -0.06694538   -0.00225171    0.00123457   -0.00885223
C    0.32278242    1.53754829   -0.05660932    0.00280550    0.00684087   -0.00323913
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C    1.72179563    1.31106676    0.03144096    0.00616362    0.01124467    0.00434311
C    1.70622642   -1.27214426    0.01779166    0.00683929   -0.06510579    0.00998204
H   -0.02810694    2.54100471    0.04617952   -0.00287336   -0.01801504    0.00054958
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H    2.45636014   -2.02910823    0.08437611   -0.00087673    0.01809996   -0.00088795
C    2.34296278    0.07004490    0.00372513    0.02551749    0.02465762   -0.01159179
H    3.39570320   -0.01831551    0.17079286   -0.01460274   -0.00822913    0.00241256
   15
   -420.53717237
H   -2.60034236    0.47549252    0.04178094   -0.00616943   -0.01852671   -0.00238825
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O   -1.95057993   -1.32276539    0.07686752    0.00000838   -0.01255824    0.00725352
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C   -0.82887912   -0.77553068   -0.06624556    0.00255032    0.00335721   -0.00911414
C    0.32138989    1.53879380   -0.05772665    0.00024386    0.00737592   -0.00396931
C    0.35872282   -1.57353683   -0.04378368   -0.02492595    0.02652462   -0.00121220
C    1.72071497    1.30795279    0.02954032    0.00741297    0.00708948    0.00402527
C    1.70695109   -1.26943092    0.01895632    0.00083602   -0.05601398    0.00906061
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H    2.45811851   -2.04100994    0.08792533    0.00389194    0.01117342   -0.00018206
C    2.34268621    0.07299167    0.00509921    0.02295559    0.02863906   -0.01127644
H    3.39896955   -0.00505529    0.16758537   -0.01281701   -0.00721525    0.00244857
   15
   -420.53806981
H   -2.59899941    0.46606091    0.04651431   -0.00843698   -0.02236001   -0.00222142
O   -1.99114610    1.29459504    0.05088768   -0.00336939    0.04296438    0.00972665
O   -1.95480061   -1.32227688    0.07622686   -0.00623563   -0.01494807    0.00773728
C   -0.76124959    0.69260220   -0.09247654    0.01718292   -0.01259527   -0.00966798
C   -0.82622145   -0.77611671   -0.06540800    0.00695539    0.00537822   -0.00931586
C    0.31999290    1.53993042   -0.05878369   -0.00169016    0.00574516   -0.00491739
C    0.36171781   -1.57636433   -0.04421222   -0.01965308    0.02342384   -0.00036908
C    1.71952202    1.30473095    0.02757872    0.00884553    0.00348933    0.00378198
C    1.70766337   -1.26587243    0.01998414   -0.00536769   -0.04546786    0.00800374
H   -0.02276401    2.54787280    0.06084538   -0.00261713   -0.01490649    0.00163400
H    0.12315459   -2.65097162    0.00209977   -0.00071279   -0.00786132    0.00019531
H    2.30121216    2.22237179    0.16633784   -0.00280904    0.00751446    0.00324788
H    2.45917528   -2.05491382    0.09150632    0.00874218    0.00358158    0.00059598
C    2.34206504    0.07550606    0.00664398    0.01837036    0.03209417   -0.01110568
H    3.40451700    0.00950209    0.16393418   -0.00921935   -0.00608207    0.00268825
   15
   -420.53876315
H   -2.59616183    0.46062364    0.05164622   -0.00901813   -0.02405901   -0.00197026
O   -1.99098351    1.29565500    0.05099315   -0.00386787    0.04635226    0.00952306
O   -1.95895083   -1.32161912    0.07549852   -0.01217573   -0.01699944    0.00812714
C   -0.75900377    0.69049420   -0.09140236    0.01990050   -0.01534583   -0.00974085
C   -0.82366841   -0.77678383   -0.06442967    0.01091078    0.00722674   -0.00944827
C    0.31862068    1.54098227   -0.05976616   -0.00302504    0.00237746   -0.00605161
C    0.36500968   -1.57954463   -0.04463518   -0.01418654    0.01916128    0.00048785
C    1.71819524    1.30145564    0.02555988    0.01035127    0.00048265    0.00359872
C    1.70845585   -1.26162710    0.02089099   -0.01078495   -0.03443943    0.00691717
H   -0.01938881    2.55552796    0.06779119   -0.00313274   -0.01058566    0.00249734
H    0.10441864   -2.64775903   -0.01107451   -0.00356673   -0.00625221   -0.00053953
H    2.30927990    2.21105781    0.16342822   -0.00224136    0.00573018    0.00322837
H    2.45866931   -2.06946677    0.09498069    0.01282330   -0.00373609    0.00134078
C    2.34116783    0.07753602    0.00835676    0.01241379    0.03483924   -0.01099092
H    3.41170638    0.02515102    0.15979769   -0.00440983   -0.00475885    0.00301185
   15
   -420.53918529
H   -2.59172471    0.45948723    0.05713221   -0.00794604   -0.02364254   -0.00167041
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   15
   -420.53936822
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O   -1.96677520   -1.31970745    0.07376225   -0.02278223   -0.01988526    0.00859857
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   15
   -420.53930418
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O   -1.99013643    1.29568470    0.05067611   -0.01234664    0.04125827    0.00851037
O   -1.97032918   -1.31842087    0.07274898   -0.02726663   -0.02068873    0.00867561
C   -0.75418227    0.68569771   -0.08729580    0.02411329   -0.02122241   -0.00967054
C   -0.81719838   -0.77953177   -0.06063591    0.01980960    0.01113767   -0.00936821
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C    0.37585077   -1.59048695   -0.04599809    0.00116706    0.00143054    0.00280018
C    1.71319327    1.29171974    0.01918470    0.01387076   -0.00522722    0.00321438
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   15
   -420.53901589
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O   -1.97357447   -1.31690000    0.07163740   -0.03108794   -0.02105290    0.00864922
C   -0.75328457    0.68470666   -0.08563345    0.02424374   -0.02223924   -0.00956599
C   -0.81558746   -0.78076224   -0.05908641    0.02167474    0.01174609   -0.00916520
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C    1.71112660    1.28860058    0.01695995    0.01424632   -0.00628348    0.00305282
C    1.71370278   -1.24099795    0.02361887   -0.01575664    0.00295057    0.00357367
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C    2.33666742    0.08020000    0.01682754   -0.01032897    0.03587262   -0.00914639
H    3.43912960    0.09334210    0.13743435    0.01344112    0.00250965    0.00322311
   15
   -420.53860118
H   -2.56598941    0.49087042    0.08162177    0.01051991   -0.00206258   -0.00099246
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O   -1.97646781   -1.31514056    0.07042781   -0.03415559   -0.02105435    0.00852292
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C   -0.81430349   -0.78216983   -0.05739845    0.02292019    0.01197047   -0.00886952
C    0.31267956    1.54703962   -0.06293989   -0.00647791   -0.01629720   -0.01129636
C    0.38312209   -1.59804545   -0.04709781    0.00963909   -0.01128515    0.00382810
C    1.70884530    1.28557612    0.01468910    0.01401312   -0.00709406    0.00283738
C    1.71562757   -1.23563555    0.02413916   -0.01246271    0.00905064    0.00315829
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C    2.33574508    0.07948258    0.01931544   -0.01306237    0.03349469   -0.00814038
H    3.44162869    0.11015264    0.13034197    0.01507150    0.00457605    0.00278456
   15
   -420.53809343
H   -2.56171549    0.50283888    0.08822715    0.01666071    0.00631048   -0.00111699
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O   -1.97897447   -1.31314259    0.06912164   -0.03639346   -0.02071037    0.00829313
C   -0.75258148    0.68373892   -0.08187683    0.02309840   -0.02269426   -0.00930060
C   -0.81336525   -0.78375797   -0.05557650    0.02349022    0.01181030   -0.00847782
C    0.31174704    1.54881280   -0.06311462   -0.00722215   -0.01679935   -0.01165191
C    0.38657033   -1.60161661   -0.04773084    0.01336522   -0.01686892    0.00416910
C    1.70635292    1.28265874    0.01237544    0.01313255   -0.00774442    0.00254888
C    1.71773886   -1.23040796    0.02461146   -0.00759834    0.01348195    0.00293771
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C    2.33501818    0.07825981    0.02192618   -0.01410152    0.03022668   -0.00693280
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   15
   -420.53755851
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O   -1.98106910   -1.31091001    0.06772148   -0.03775218   -0.02001609    0.00796607
C   -0.75275903    0.68376908   -0.07978654    0.02203907   -0.02210938   -0.00916868
C   -0.81278132   -0.78552425   -0.05362648    0.02335150    0.01127910   -0.00798860
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C    0.38981682   -1.60493380   -0.04842679    0.01680906   -0.02157686    0.00440806
C    1.70366276    1.27985831    0.01002333    0.01161332   -0.00829043    0.00218408
C    1.71996343   -1.22538209    0.02503910   -0.00142431    0.01616386    0.00290749
H    0.02462809    2.61218416    0.09421394   -0.00246280    0.01310691    0.00734744
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H    2.38293721   -2.10850426    0.10768702    0.00019687   -0.01335984    0.00271813
C    2.33450244    0.07658094    0.02464156   -0.01344288    0.02621388   -0.00556850
H    3.43854779    0.14094027    0.11477331    0.01356868    0.00846650    0.00139967
   15
   -420.53714893
H   -2.56296791    0.52215441    0.10206792    0.02374066    0.01778141   -0.00129665
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O   -1.98273632   -1.30845068    0.06623104   -0.03819624   -0.01900670    0.00754920
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C   -0.81254957   -0.78746066   -0.05155579    0.02247839    0.01040539   -0.00740687
C    0.31022215    1.55309879   -0.06293652   -0.00890352   -0.01302399   -0.01134737
C    0.39280949   -1.60792607   -0.04918927    0.01998131   -0.02522598    0.00455664
C    1.70079768    1.27718314    0.00763830    0.00951889   -0.00875126    0.00175967
C    1.72220839   -1.22059861    0.02542259    0.00567892    0.01721059    0.00303563
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H    2.36578644   -2.10205743    0.10741141   -0.00648156   -0.00774393    0.00225771
C    2.33418801    0.07450641    0.02744099   -0.01118395    0.02163457   -0.00409464
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   15
   -420.53691405
H   -2.56973500    0.52747721    0.10933141    0.02237124    0.01814711   -0.00102914
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O   -1.98397111   -1.30577601    0.06465505   -0.03771469   -0.01770598    0.00704298
C   -0.75409333    0.68481360   -0.07519180    0.01924558   -0.01939953   -0.00895102
C   -0.81265681   -0.78955399   -0.04937323    0.02087541    0.00921064   -0.00673722
C    0.30965510    1.55555472   -0.06258827   -0.00975586   -0.00891280   -0.01071489
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C    1.69778921    1.27464022    0.00522681    0.00695756   -0.00912228    0.00127757
C    1.72436701   -1.21607383    0.02576004    0.01314916    0.01703115    0.00327538
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H    2.38739464    2.10755790    0.11230154    0.00634509   -0.00745922    0.00315317
H    2.34980610   -2.09423102    0.10673036   -0.01339203   -0.00114270    0.00172366
C    2.33404101    0.07210525    0.03030229   -0.00755510    0.01668304   -0.00257789
H    3.42604963    0.16568953    0.09821707    0.00622107    0.01139220   -0.00032309
   15
   -420.53676252
H   -2.58047716    0.52958897    0.11677366    0.01739628    0.01470057   -0.00033825
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O   -1.98477893   -1.30290073    0.06299924   -0.03632600   -0.01612252    0.00645979
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C   -0.81307883   -0.79178623   -0.04708889    0.01858387    0.00772715   -0.00599258
C    0.30923545    1.55814402   -0.06207833   -0.01052253   -0.00365459   -0.00982739
C    0.39784627   -1.61273227   -0.05092174    0.02531304   -0.02917572    0.00462355
C    1.69467591    1.27223512    0.00279606    0.00407777   -0.00937974    0.00076265
C    1.72632731   -1.21180599    0.02604795    0.02022917    0.01641474    0.00352839
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C    2.33400702    0.06945210    0.03320258   -0.00294051    0.01152384   -0.00107662
H    3.41775544    0.17511330    0.08994709    0.00101858    0.01233848   -0.00116663
   15
   -420.53663817
H   -2.59431186    0.52909177    0.12427103    0.00972788    0.00868931    0.00074874
O   -1.97794148    1.28176642    0.04575349   -0.01743255    0.00658424    0.00500466
O   -1.98517547   -1.29984280    0.06127022   -0.03408254   -0.01426463    0.00580930
C   -0.75658671    0.68702281   -0.07005542    0.01544782   -0.01498362   -0.00878856
C   -0.81378107   -0.79413497   -0.04471404    0.01567769    0.00597688   -0.00517902
C    0.30897443    1.56078788   -0.06141995   -0.01101596    0.00224267   -0.00878532
C    0.39981009   -1.61448632   -0.05189275    0.02724111   -0.02958460    0.00454112
C    1.69150113    1.26997166    0.00035380    0.00104085   -0.00948958    0.00024021
C    1.72798324   -1.20778719    0.02628260    0.02608042    0.01647982    0.00370082
H    0.06049695    2.60644513    0.08307533    0.00467019   -0.00188605    0.00528625
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H    2.39840082    2.09565725    0.09489990    0.00950131   -0.00675004    0.00321615
H    2.32619905   -2.07914864    0.10453116   -0.02482261    0.01109182    0.00078019
C    2.33401696    0.06662481    0.03611924    0.00209652    0.00629477    0.00035063
H    3.40928245    0.18232112    0.08188584   -0.00451467    0.01292500   -0.00192244
   15
   -420.53647592
H   -2.60988071    0.52704272    0.13162990    0.00085805    0.00181335    0.00209166
O   -1.97506909    1.27963598    0.04479324   -0.00741625    0.01111549    0.00348734
O   -1.98518611   -1.29662330    0.05947535   -0.03106145   -0.01213749    0.00510469
C   -0.75819861    0.68848472   -0.06728732    0.01298972   -0.01232767   -0.00870121
C   -0.81471974   -0.79657377   -0.04226093    0.01226684    0.00399017   -0.00432054
C    0.30887949    1.56339781   -0.06062880   -0.01110910    0.00813252   -0.00768759
C    0.40136277   -1.61579417   -0.05293230    0.02850852   -0.02909690    0.00437263
C    1.68831063    1.26785145   -0.00209210   -0.00200888   -0.00942476   -0.00027383
C    1.72924736   -1.20401960    0.02646152    0.02989858    0.01825578    0.00368263
H    0.06821533    2.60372994    0.07760378    0.00638980   -0.00697376    0.00453993
H    0.03356193   -2.64182291   -0.13328651   -0.01953708    0.00430749   -0.00518595
H    2.40147905    2.09156671    0.08533261    0.01069003   -0.00627873    0.00317115
H    2.32060595   -2.07406049    0.10317888   -0.02769941    0.01435173    0.00059986
C    2.33399554    0.06370237    0.03903074    0.00685426    0.00107984    0.00165466
H    3.40161667    0.18720737    0.07416884   -0.00968225    0.01318432   -0.00254852
   15
   -420.53641758
H   -2.62560727    0.52465779    0.13861083   -0.00778810   -0.00444637    0.00351444
O   -1.97211267    1.27738017    0.04379352    0.00271894    0.01488138    0.00189474
O   -1.98484503   -1.29326634    0.05762260   -0.02736267   -0.00976480    0.00437093
C   -0.76000632    0.69013280   -0.06438771    0.01005744   -0.00948124   -0.00858798
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   15
   -420.53659525
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   15
   -420.53713711
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   15
   -420.53804439
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   15
   -420.53910394
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O   -1.98088722   -1.27903724    0.04979997   -0.00829342    0.00153133    0.00148567
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C   -0.82099296   -0.80896672   -0.02928505   -0.00821728   -0.00846802    0.00008993
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C    1.67364832    1.25927599   -0.01412034   -0.01420274   -0.00689800   -0.00232573
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   15
   -420.54014510
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O   -1.97951991   -1.27543991    0.04778234   -0.00316483    0.00452233    0.00086131
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   15
   -420.54086667
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O   -1.97811655   -1.27189379    0.04575489    0.00180247    0.00742994    0.00030747
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C   -0.82308048   -0.81330581   -0.02401109   -0.01574276   -0.01390303    0.00162935
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   15
   -420.54117120
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   15
   -420.54096438
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   15
   -420.54031192
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   15
   -420.53949971
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C    1.66305516    1.25245335   -0.02740196   -0.01989634   -0.00778664   -0.00326976
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C    2.32689357    0.04430661    0.06639145   -0.01184213   -0.02001921    0.00955100
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   15
   -420.53878486
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O   -1.97237489   -1.25599967    0.03566311    0.01946847    0.01803837   -0.00143472
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C   -0.82346791   -0.81983730   -0.01140548   -0.02512640   -0.02455907    0.00396602
C    0.31142472    1.58117947   -0.04514383    0.02036819   -0.00247644    0.00058927
C    0.39347155   -1.60627663   -0.06840292   -0.00983728   -0.00006112   -0.00373850
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C    1.71991556   -1.20392663    0.02638722   -0.00606071    0.02818823   -0.00052468
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H    2.46028965   -2.03760865    0.06170871    0.01342610   -0.00821860    0.00225123
C    2.32657906    0.04452597    0.06817470   -0.01046761   -0.01633544    0.00978261
H    3.43401053    0.07905744    0.03213373    0.01390551    0.00093514   -0.00443299
   15
   -420.53833578
H   -2.61177341    0.56435447    0.15042522    0.01794195    0.02818097    0.00040552
O   -1.95445777    1.24501190    0.03248118    0.01209672   -0.04038111    0.00136127
O   -1.97176326   -1.25335724    0.03368147    0.02076957    0.01895991   -0.00159519
C   -0.77452299    0.70890997   -0.02064196   -0.03642590    0.01620903   -0.00453650
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   15
   -420.53804997
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   15
   -420.53762000
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   15
   -420.53679449
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   15
   -420.53568916
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   15
   -420.53464156
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   15
   -420.53404394
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   15
   -420.53416392
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   15
   -420.53500212
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   15
   -420.53637181
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   15
   -420.53792564
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C   -0.79725634   -0.80250310    0.01125856    0.00657927   -0.01278117    0.00306113
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   15
   -420.53930399
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H    2.49664568   -2.01663890   -0.02560325    0.01687861    0.00016319   -0.00285641
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   15
   -420.54029378
H   -2.54555952    0.41136244    0.07065792    0.00287361   -0.00508994    0.00213053
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C   -0.79149968   -0.79557466    0.01469177    0.01340812   -0.00629864    0.00288238
C    0.29180174    1.57981701   -0.03004768   -0.02207567    0.00077955    0.01054109
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   15
   -420.54077751
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   15
   -420.54092486
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   15
   -420.54087937
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O   -1.97765792   -1.23501672    0.00626229   -0.02799186    0.00089627   -0.00107218
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   15
   -420.54089258
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H    2.44654963   -2.07940642   -0.04947477    0.01201602   -0.01282191   -0.00507862
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   15
   -420.54103929
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C    1.71509740   -1.23832395    0.02507749   -0.01152520    0.01104259    0.00539542
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   15
   -420.54110805
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C    0.29440466    1.57166788   -0.03023187   -0.02464078   -0.01665710    0.01334323
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   15
   -420.54084082
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O   -1.97362466   -1.23292179   -0.00046443   -0.02975856   -0.00130127   -0.00058806
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C    1.68598404    1.28784351   -0.06237038    0.00258622    0.01003174   -0.00482398
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   15
   -420.54002823
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O   -1.97176212   -1.23237119   -0.00212546   -0.02813989   -0.00128252   -0.00040917
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C   -0.77836156   -0.76799609    0.02676833    0.01530136    0.01618476    0.00209031
C    0.29824779    1.57083150   -0.03190260   -0.02266847   -0.00969126    0.01124730
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C    1.68737361    1.29072993   -0.06349100    0.00144490    0.01172978   -0.00489004
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   15
   -420.53862040
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C   -0.77792502   -0.76528664    0.02811490    0.01327662    0.01739873    0.00189402
C    0.30069171    1.57066243   -0.03300179   -0.02089576   -0.00498309    0.00980102
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C    1.68874139    1.29343919   -0.06453764    0.00027627    0.01328013   -0.00496066
C    1.72355250   -1.23944113    0.02268517    0.02157157    0.00626353    0.00431792
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C    2.30305005    0.04466761    0.07464424   -0.00409978   -0.01313266    0.00514621
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   15
   -420.53691269
H   -2.52672865    0.34048806   -0.04666733   -0.00052055   -0.01513837   -0.00420446
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O   -1.96710693   -1.23122984   -0.00543591   -0.02306602   -0.00050084   -0.00000345
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C   -0.77768915   -0.76283968    0.02943290    0.01120264    0.01812048    0.00166821
C    0.30345070    1.57056881   -0.03424905   -0.01840747   -0.00037783    0.00826634
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C    1.69010495    1.29594763   -0.06550924   -0.00081023    0.01481518   -0.00506069
C    1.72515896   -1.24002898    0.02190961    0.02764919    0.00513490    0.00393478
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H    2.34071596   -2.10206123   -0.05052051   -0.02324427    0.00914414   -0.00305683
C    2.30225343    0.04460475    0.07380055   -0.00095444   -0.01412117    0.00515093
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   15
   -420.53526326
H   -2.53778293    0.33411713   -0.05663156   -0.00525326   -0.01841631   -0.00523106
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O   -1.96437158   -1.23064801   -0.00708990   -0.01987637    0.00029857    0.00020390
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C   -0.77762278   -0.76066613    0.03072567    0.00920874    0.01836470    0.00142878
C    0.30648695    1.57048200   -0.03562140   -0.01504050    0.00331617    0.00680648
C    0.39397510   -1.61635890   -0.06453276    0.03125557   -0.02429800   -0.00897331
C    1.69148054    1.29823198   -0.06640427   -0.00169422    0.01640085   -0.00520623
C    1.72635006   -1.24069646    0.02107445    0.03152271    0.00561519    0.00362894
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C    2.30147206    0.04475464    0.07287901    0.00154199   -0.01451929    0.00513045
H    3.37368290    0.10344228    0.14190336   -0.00925103    0.00552605    0.00225985
   15
   -420.53403770
H   -2.54790726    0.33103882   -0.06565531   -0.00888015   -0.02013958   -0.00613847
O   -1.99539758    1.21372638    0.02051993   -0.00608399    0.02633689   -0.00082332
O   -1.96141101   -1.23006980   -0.00874619   -0.01641769    0.00135838    0.00039668
C   -0.74235468    0.69135775    0.08447739    0.01997714   -0.02155435    0.01133438
C   -0.77769585   -0.75876972    0.03199684    0.00738801    0.01816106    0.00116964
C    0.30974938    1.57034704   -0.03709691   -0.01066899    0.00538713    0.00555633
C    0.39101825   -1.61747768   -0.06257011    0.02836411   -0.02837096   -0.00846401
C    1.69288141    1.30026826   -0.06722052   -0.00229438    0.01807723   -0.00541015
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H   -0.01508729    2.56825540   -0.22550261    0.00132682   -0.01716435   -0.00146099
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H    2.32787089   -2.11475017   -0.04562285   -0.02487178    0.00802154   -0.00270736
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   15
   -420.53339320
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O   -1.99584844    1.21059037    0.02043076   -0.00346744    0.02425622   -0.00052949
O   -1.95826435   -1.22950721   -0.01040696   -0.01279773    0.00266638    0.00056413
C   -0.74538106    0.69215082    0.08800408    0.01480805   -0.02177626    0.01244905
C   -0.77788092   -0.75714738    0.03325034    0.00580212    0.01753382    0.00089881
C    0.31317186    1.57013313   -0.03865678   -0.00527460    0.00541354    0.00458858
C    0.38763368   -1.61816872   -0.06047961    0.02451210   -0.03144315   -0.00785710
C    1.69431658    1.30203114   -0.06795488   -0.00256504    0.01983188   -0.00567267
C    1.72728808   -1.24232804    0.01924276    0.03239042    0.01184369    0.00320023
H   -0.01568153    2.56777665   -0.22268081    0.00096090   -0.01723282   -0.00118170
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H    2.32814964   -2.12337424   -0.04243125   -0.02242735    0.00395784   -0.00269345
C    2.29982256    0.04570893    0.07080455    0.00296299   -0.01372597    0.00490168
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   15
   -420.53334253
H   -2.56299209    0.33573536   -0.08027185   -0.01220135   -0.01908331   -0.00727072
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O   -1.95497264   -1.22897495   -0.01207409   -0.00908576    0.00414310    0.00069682
C   -0.74863050    0.69327253    0.09134259    0.00892995   -0.02151482    0.01353080
C   -0.77815410   -0.75578971    0.03449023    0.00450100    0.01653074    0.00063413
C    0.31667294    1.56983984   -0.04028637    0.00102808    0.00340117    0.00389339
C    0.38387951   -1.61838585   -0.05827045    0.01983160   -0.03328975   -0.00714861
C    1.69579012    1.30349412   -0.06860339   -0.00248613    0.02162848   -0.00599097
C    1.72702098   -1.24338491    0.01825285    0.03013201    0.01646627    0.00295271
H   -0.01643944    2.57036881   -0.21964144   -0.00006341   -0.01515084   -0.00124848
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H    2.33244370   -2.13268962   -0.03875461   -0.01844235   -0.00156661   -0.00269178
C    2.29893331    0.04650140    0.06965513    0.00157862   -0.01258321    0.00465084
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   15
   -420.53368354
H   -2.56735833    0.34331919   -0.08566229   -0.01166815   -0.01624863   -0.00739306
O   -1.99665246    1.20354221    0.02026955   -0.00034313    0.01462465   -0.00050302
O   -1.95157790   -1.22848982   -0.01374909   -0.00534381    0.00577109    0.00079130
C   -0.75201431    0.69471894    0.09447658    0.00249516   -0.02076649    0.01456295
C   -0.77849565   -0.75468155    0.03572053    0.00347003    0.01518194    0.00037706
C    0.32015780    1.56949712   -0.04197508    0.00791314   -0.00024576    0.00339510
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C    1.69730082    1.30463015   -0.06916127   -0.00206013    0.02337788   -0.00634859
C    1.72629948   -1.24469043    0.01721847    0.02688132    0.02083327    0.00257806
H   -0.01717825    2.57566365   -0.21637378   -0.00161277   -0.01134750   -0.00156649
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H    2.34004484   -2.14171680   -0.03459455   -0.01356958   -0.00755683   -0.00262101
C    2.29802163    0.04748358    0.06843550   -0.00098039   -0.01097644    0.00432600
H    3.36853749    0.15072308    0.14770654   -0.00857085    0.01154732    0.00228540
   15
   -420.53418974
H   -2.56964603    0.35380509   -0.08972693   -0.00957379   -0.01177477   -0.00715871
O   -1.99704080    1.19973927    0.02019727   -0.00012815    0.00708149   -0.00085297
O   -1.94812254   -1.22807023   -0.01543302   -0.00159398    0.00748252    0.00084811
C   -0.75543540    0.69647876    0.09739046   -0.00429890   -0.01954640    0.01552626
C   -0.77888998   -0.75380256    0.03694510    0.00269603    0.01352340    0.00014403
C    0.32352277    1.56915927   -0.04371520    0.01498412   -0.00485129    0.00296444
C    0.37555436   -1.61730867   -0.05354094    0.00868933   -0.03266069   -0.00535230
C    1.69884230    1.30541293   -0.06962313   -0.00132216    0.02494822   -0.00672389
C    1.72517203   -1.24630953    0.01614531    0.02320757    0.02405394    0.00203186
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H   -0.06697865   -2.59992801   -0.17492553   -0.02071782    0.01255667   -0.00012857
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H    2.35008516   -2.14939020   -0.02996459   -0.00844607   -0.01312298   -0.00242720
C    2.29712565    0.04863096    0.06715063   -0.00427630   -0.00884441    0.00392545
H    3.37179742    0.15797583    0.14816730   -0.00538665    0.01272569    0.00246026
   15
   -420.53467375
H   -2.57023185    0.36638741   -0.09250807   -0.00597167   -0.00564608   -0.00654532
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O   -1.94464911   -1.22773554   -0.01712656    0.00215078    0.00921145    0.00088363
C   -0.75879135    0.69853359    0.10006970   -0.01119632   -0.01789573    0.01641350
C   -0.77932533   -0.75312771    0.03816745    0.00213832    0.01158666   -0.00006063
C    0.32666148    1.56889495   -0.04550008    0.02179823   -0.00965438    0.00248489
C    0.37115135   -1.61602409   -0.05104778    0.00258481   -0.03006228   -0.00424375
C    1.70040346    1.30581891   -0.06998336   -0.00033118    0.02617610   -0.00707827
C    1.72369363   -1.24829015    0.01504167    0.01955210    0.02549684    0.00129849
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H    2.43205928    2.09915670   -0.20602242    0.00850126   -0.00698992   -0.00267181
H    2.36164947   -2.15471760   -0.02489974   -0.00356855   -0.01758884   -0.00209172
C    2.29629460    0.04991143    0.06580643   -0.00780911   -0.00620078    0.00351288
H    3.37602150    0.16294127    0.14818471   -0.00181001    0.01363171    0.00267051
   15
   -420.53495595
H   -2.56976218    0.37996584   -0.09411435   -0.00107384    0.00189478   -0.00563271
O   -1.99780041    1.19200205    0.02008963   -0.00288408   -0.01287563   -0.00238049
O   -1.94120010   -1.22750527   -0.01883008    0.00590805    0.01088020    0.00088793
C   -0.76197822    0.70085850    0.10250088   -0.01791613   -0.01585646    0.01721804
C   -0.77979316   -0.75262775    0.03939066    0.00172428    0.00941645   -0.00021666
C    0.32947142    1.56877600   -0.04732239    0.02792506   -0.01398181    0.00187257
C    0.36670949   -1.61428676   -0.04849061   -0.00369147   -0.02603080   -0.00299850
C    1.70196943    1.30582976   -0.07023662    0.00081882    0.02687761   -0.00738633
C    1.72191922   -1.25065375    0.01391859    0.01621129    0.02483755    0.00039312
H   -0.01632073    2.60020774   -0.20457701   -0.00688727    0.00343471   -0.00266646
H   -0.05407865   -2.60640873   -0.18704399   -0.01865446    0.00943411   -0.00134119
H    2.43277508    2.09689728   -0.19881011    0.00725124   -0.00864613   -0.00212348
H    2.37386440   -2.15690096   -0.01946044    0.00071509   -0.02054729   -0.00161750
C    2.29558134    0.05128506    0.06440908   -0.01109936   -0.00305017    0.00312503
H    3.38057273    0.16545823    0.14772115    0.00166451    0.01419060    0.00287786
   15
   -420.53507045
H   -2.56910946    0.39319228   -0.09470951    0.00450272    0.01015443   -0.00450766
O   -1.99814078    1.18829321    0.02007148   -0.00543251   -0.02417026   -0.00343294
O   -1.93781811   -1.22739833   -0.02054365    0.00966788    0.01244723    0.00087448
C   -0.76489482    0.70342279    0.10467182   -0.02412568   -0.01350848    0.01794483
C   -0.78028713   -0.75226995    0.04061706    0.00137299    0.00707104   -0.00031546
C    0.33186049    1.56886729   -0.04917282    0.03295738   -0.01735098    0.00108974
C    0.36232353   -1.61215732   -0.04588823   -0.01003115   -0.02079354   -0.00164136
C    1.70352297    1.30543513   -0.07037829    0.00200612    0.02685831   -0.00761996
C    1.71989905   -1.25339018    0.01278975    0.01338877    0.02195556   -0.00065446
H   -0.01396188    2.60833782   -0.19976312   -0.00808631    0.00729826   -0.00274703
H   -0.04249268   -2.61236125   -0.19279752   -0.01731391    0.00667439   -0.00211193
H    2.43218450    2.09618798   -0.19121475    0.00605395   -0.00986221   -0.00164078
H    2.38596244   -2.15541020   -0.01373128    0.00416942   -0.02179792   -0.00104178
C    2.29503511    0.05270420    0.06296443   -0.01374786    0.00060499    0.00277858
H    3.38483191    0.16542528    0.14674028    0.00461208    0.01441396    0.00302736
   15
   -420.53512469
H   -2.56926211    0.40459720   -0.09449288    0.00970717    0.01791263   -0.00339990
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O   -1.93454579   -1.22743245   -0.02226714    0.01341680    0.01386898    0.00084911
C   -0.76744761    0.70619102    0.10657154   -0.02952867   -0.01091609    0.01859926
C   -0.78080184   -0.75201891    0.04184817    0.00100183    0.00460653   -0.00035607
C    0.33375286    1.56921934   -0.05103949    0.03664239   -0.01942770    0.00011707
C    0.35808918   -1.60971460   -0.04326113   -0.01633582   -0.01465692   -0.00021254
C    1.70504619    1.30463548   -0.07040488    0.00315742    0.02596297   -0.00775869
C    1.71767568   -1.25645595    0.01167091    0.01119683    0.01691586   -0.00179997
H   -0.01015551    2.61517108   -0.19445765   -0.00873570    0.00995252   -0.00261681
H   -0.02779365   -2.61950828   -0.19817012   -0.01567883    0.00343016   -0.00293872
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H    2.39732420   -2.15002064   -0.00781553    0.00663431   -0.02128862   -0.00039623
C    2.29469562    0.05411370    0.06147767   -0.01548578    0.00465811    0.00251440
H    3.38827238    0.16280360    0.14521521    0.00675331    0.01421577    0.00311629
   15
   -420.53533635
H   -2.57113851    0.41280796   -0.09365975    0.01324064    0.02356990   -0.00259224
O   -1.99861101    1.18181488    0.02016331   -0.00890541   -0.04302619   -0.00520495
O   -1.93142561   -1.22762372   -0.02400027    0.01710957    0.01510700    0.00081939
C   -0.76955524    0.70912409    0.10819012   -0.03384804   -0.00816236    0.01918576
C   -0.78133160   -0.75183750    0.04308458    0.00053988    0.00212557   -0.00032207
C    0.33509305    1.56986336   -0.05290774    0.03879012   -0.02005299   -0.00102523
C    0.35410162   -1.60705092   -0.04063082   -0.02250054   -0.00800526    0.00122891
C    1.70652182    1.30344447   -0.07031427    0.00418331    0.02409529   -0.00780150
C    1.71528212   -1.25977508    0.01057935    0.00972708    0.00989456   -0.00299487
H   -0.00478510    2.62023276   -0.18868415   -0.00878820    0.01120082   -0.00227149
H   -0.01027620   -2.62727001   -0.20301240   -0.01371732   -0.00000123   -0.00381608
H    2.42789852    2.10017578   -0.17520566    0.00443756   -0.01031667   -0.00094022
H    2.40750718   -2.14082376   -0.00182895    0.00801516   -0.01904338    0.00028208
C    2.29458895    0.05545242    0.05995278   -0.01614488    0.00899796    0.00234226
H    3.39051152    0.15762847    0.14313032    0.00789387    0.01361843    0.00312097
   15
   -420.53583381
H   -2.57535655    0.41682580   -0.09235222    0.01390440    0.02577569   -0.00231345
O   -1.99870350    1.17925642    0.02029295   -0.00765524   -0.04752780   -0.00545925
O   -1.92849942   -1.22798614   -0.02574268    0.02068339    0.01612532    0.00077637
C   -0.77115269    0.71218049    0.10951869   -0.03687412   -0.00533094    0.01971115
C   -0.78186934   -0.75168831    0.04432576   -0.00006852   -0.00028015   -0.00020614
C    0.33584878    1.57080873   -0.05476033    0.03928673   -0.01915719   -0.00229703
C    0.35045401   -1.60426637   -0.03801901   -0.02843871   -0.00124188    0.00261612
C    1.70793439    1.30189034   -0.07010580    0.00505916    0.02125388   -0.00775923
C    1.71274058   -1.26324170    0.00953308    0.00901340    0.00114904   -0.00419479
H    0.00215902    2.62329955   -0.18250454   -0.00824291    0.01097032   -0.00173047
H    0.00970530   -2.63503341   -0.20716766   -0.01138390   -0.00329027   -0.00466570
H    2.42449162    2.10495191   -0.16691822    0.00418709   -0.00937713   -0.00072343
H    2.41626404   -2.12822134    0.00410706    0.00824283   -0.01520258    0.00095008
C    2.29472502    0.05665492    0.05839238   -0.01567912    0.01347106    0.00226000
H    3.39134513    0.15000672    0.14048454    0.00795941    0.01266468    0.00305328
   15
   -420.53659076
H   -2.58202861    0.41626073   -0.09061923    0.01123237    0.02403657   -0.00263938
O   -1.99871167    1.17723310    0.02048400   -0.00367334   -0.04774566   -0.00515121
O   -1.92580763   -1.22853125   -0.02749387    0.02403934    0.01689462    0.00071328
C   -0.77219433    0.71531750    0.11054931   -0.03849172   -0.00251078    0.02017099
C   -0.78240586   -0.75153511    0.04556995   -0.00083898   -0.00249601    0.00000106
C    0.33601248    1.57204195   -0.05657808    0.03815513   -0.01678702   -0.00366031
C    0.34723594   -1.60146268   -0.03544661   -0.03398891    0.00521570    0.00388654
C    1.70927063    1.30001591   -0.06978008    0.00580662    0.01755138   -0.00765636
C    1.71006189   -1.26672404    0.00855017    0.00903087   -0.00894201   -0.00534263
H    0.01057868    2.62441225   -0.17601523   -0.00711445    0.00929860   -0.00105387
H    0.03173013   -2.64221170   -0.21048432   -0.00866336   -0.00612650   -0.00542969
H    2.42032611    2.11140528   -0.15850005    0.00427879   -0.00769804   -0.00055937
H    2.42355373   -2.11290206    0.00987268    0.00733569   -0.00998128    0.00157331
C    2.29509681    0.05765380    0.05679771   -0.01411269    0.01789388    0.00227009
H    3.39076073    0.14011050    0.13729142    0.00698681    0.01136446    0.00286713
   15
   -420.53736056
H   -2.59068047    0.41141635   -0.08840452    0.00571147    0.01899325   -0.00343618
O   -1.99868022    1.17574791    0.02073308    0.00251030   -0.04427480   -0.00441578
O   -1.92338819   -1.22926779   -0.02925312    0.02704758    0.01739615    0.00062053
C   -0.77265574    0.71849260    0.11127505   -0.03865492    0.00021223    0.02055912
C   -0.78292957   -0.75134453    0.04681400   -0.00173874   -0.00441603    0.00030773
C    0.33560114    1.57352736   -0.05834047    0.03549190   -0.01308396   -0.00505481
C    0.34453108   -1.59873701   -0.03293277   -0.03898532    0.01100940    0.00496948
C    1.71051917    1.29787687   -0.06933861    0.00649185    0.01320280   -0.00752052
C    1.70724591   -1.27007020    0.00764790    0.00964211   -0.01984364   -0.00639089
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   15
   -420.53778768
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O   -1.99867816    1.17476281    0.02103209    0.00969173   -0.03849190   -0.00350519
O   -1.92127513   -1.23020137   -0.03101937    0.02957975    0.01758564    0.00047301
C   -0.77253440    0.72166471    0.11169005   -0.03740938    0.00275559    0.02086059
C   -0.78342689   -0.75108766    0.04805326   -0.00272540   -0.00593908    0.00072114
C    0.33465480    1.57520932   -0.06002645    0.03149978   -0.00833336   -0.00642780
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C    1.71166954    1.29553865   -0.06878343    0.00720038    0.00849383   -0.00737775
C    1.70428382   -1.27311619    0.00684211    0.01049475   -0.03086347   -0.00730825
H    0.03094727    2.62220471   -0.16261000   -0.00346801    0.00231107    0.00052303
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   15
   -420.53765170
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O   -1.91949705   -1.23133411   -0.03279096    0.03149092    0.01743463    0.00028229
C   -0.77184905    0.72479546    0.11178975   -0.03486662    0.00506750    0.02106424
C   -0.78388300   -0.75074160    0.04928147   -0.00371262   -0.00697126    0.00124788
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C    0.34095135   -1.59385429   -0.02814244   -0.04657042    0.01948640    0.00639144
C    1.71271099    1.29307203   -0.06811666    0.00798092    0.00375674   -0.00726212
C    1.70116341   -1.27569638    0.00614663    0.01104687   -0.04117928   -0.00807665
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H    2.43903353   -2.06080344    0.02510249    0.00023991    0.00944044    0.00291528
C    2.29732188    0.05878521    0.05180078   -0.00460124    0.02880324    0.00271014
H    3.38303279    0.09930317    0.12480418   -0.00056633    0.00629659    0.00199520
   15
   -420.53704278
H   -2.61756394    0.38150774   -0.07734388   -0.01519554   -0.00179932   -0.00600052
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O   -1.91807553   -1.23266424   -0.03456566    0.03266470    0.01691096   -0.00000785
C   -0.77063796    0.72784994    0.11157110   -0.03118501    0.00710541    0.02115639
C   -0.78428306   -0.75029082    0.05049068   -0.00462476   -0.00743896    0.00188775
C    0.33141260    1.57886902   -0.06308797    0.02078639    0.00230635   -0.00882937
C    0.34019061   -1.59182501   -0.02588739   -0.04874051    0.02181460    0.00667812
C    1.71363158    1.29054816   -0.06734005    0.00890931   -0.00065096   -0.00718233
C    1.69787716   -1.27765596    0.00557308    0.01062479   -0.04986259   -0.00869703
H    0.05376371    2.61847018   -0.14957746    0.00098359   -0.00687866    0.00200592
H    0.12966012   -2.65698632   -0.21304651    0.00477371   -0.00903161   -0.00674921
H    2.39533147    2.14662197   -0.12405960    0.00536559    0.00271352    0.00006221
H    2.44346813   -2.04525578    0.02922167   -0.00191759    0.01489704    0.00318501
C    2.29827446    0.05835772    0.05005684   -0.00089116    0.03102753    0.00290108
H    3.37996648    0.08300503    0.11984549   -0.00355763    0.00445912    0.00167024
   15
   -420.53621939
H   -2.62268276    0.37054219   -0.07167711   -0.01997568   -0.00697626   -0.00628823
O   -1.99962149    1.17413087    0.02213426    0.02556682   -0.02026809   -0.00186381
O   -1.91702376   -1.23418586   -0.03634019    0.03299151    0.01601447   -0.00038301
C   -0.76895648    0.73079734    0.11103275   -0.02658350    0.00886825    0.02111380
C   -0.78461334   -0.74972833    0.05167122   -0.00538880   -0.00729353    0.00264260
C    0.32927780    1.58068760   -0.06442735    0.01481834    0.00679957   -0.00972277
C    0.34016522   -1.59012393   -0.02373296   -0.04960541    0.02278437    0.00667490
C    1.71441727    1.28803341   -0.06645479    0.00997921   -0.00445605   -0.00714918
C    1.69443224   -1.27886457    0.00513087    0.00856737   -0.05614410   -0.00918934
H    0.06510917    2.61803534   -0.14353786    0.00301210   -0.01069630    0.00255118
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H    2.38674997    2.15543035   -0.11539816    0.00505411    0.00506857    0.00030486
H    2.44823068   -2.03236535    0.03276808   -0.00288963    0.01865449    0.00341236
C    2.29924115    0.05746221    0.04826906    0.00235366    0.03233003    0.00306719
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   15
   -420.53553482
H   -2.62423432    0.36080920   -0.06488364   -0.02277253   -0.01054782   -0.00620052
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O   -1.91634542   -1.23588879   -0.03811029    0.03242049    0.01474519   -0.00085552
C   -0.76687391    0.73361097    0.11017532   -0.02128083    0.01036443    0.02093115
C   -0.78486240   -0.74905633    0.05281168   -0.00594193   -0.00651238    0.00350075
C    0.32691889    1.58240524   -0.06561998    0.00890331    0.00975792   -0.01036609
C    0.34088811   -1.58876581   -0.02167912   -0.04903500    0.02248104    0.00640559
C    1.71505192    1.28558500   -0.06546140    0.01118072   -0.00740195   -0.00715603
C    1.69086034   -1.27922784    0.00482748    0.00442428   -0.05952598   -0.00957675
H    0.07591821    2.61950566   -0.13795486    0.00465495   -0.01307226    0.00291041
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H    2.37726510    2.16333408   -0.10679218    0.00429891    0.00691385    0.00058772
H    2.45348956   -2.02280250    0.03570029   -0.00222521    0.02029953    0.00363312
C    2.30017330    0.05607907    0.04643497    0.00474755    0.03264549    0.00318405
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   15
   -420.53519711
H   -2.62171636    0.35295165   -0.05697853   -0.02348518   -0.01248719   -0.00578671
O   -2.00158570    1.17498585    0.02298676    0.02635425   -0.01330051   -0.00224814
O   -1.91603401   -1.23775866   -0.03987063    0.03094145    0.01312830   -0.00142228
C   -0.76447015    0.73626818    0.10900160   -0.01549875    0.01162079    0.02060114
C   -0.78502186   -0.74828663    0.05389909   -0.00626382   -0.00510802    0.00445994
C    0.32442500    1.58397788   -0.06665618    0.00329331    0.01065611   -0.01073997
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C    1.71551744    1.28324728   -0.06435978    0.01246968   -0.00933382   -0.00719113
C    1.68722411   -1.27869472    0.00466876   -0.00182116   -0.05993393   -0.00986684
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H    0.19639462   -2.65216417   -0.20257529    0.01428968   -0.00180810   -0.00571473
H    2.36701325    2.17000183   -0.09829229    0.00307378    0.00814723    0.00089590
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C    2.30103509    0.05420354    0.04455281    0.00597986    0.03197445    0.00324104
H    3.37622418    0.03060850    0.10337215   -0.00829398   -0.00094009    0.00091954
   15
   -420.53534133
H   -2.61500036    0.34731916   -0.04803585   -0.02211630   -0.01282871   -0.00509302
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O   -1.91607279   -1.23977715   -0.04161474    0.02859953    0.01121056   -0.00209854
C   -0.76183237    0.73874993    0.10751658   -0.00945060    0.01265900    0.02012733
C   -0.78508693   -0.74744040    0.05491897   -0.00631563   -0.00313302    0.00549621
C    0.32188073    1.58539215   -0.06753027   -0.00184523    0.00932743   -0.01087517
C    0.34452128   -1.58704445   -0.01785379   -0.04340923    0.01888138    0.00526016
C    1.71579437    1.28104937   -0.06314941    0.01379928   -0.01017231   -0.00724085
C    1.68361748   -1.27725871    0.00465910   -0.00974706   -0.05765523   -0.01004372
H    0.09484069    2.62949211   -0.12838140    0.00651075   -0.01180359    0.00307246
H    0.21421071   -2.64922194   -0.19692077    0.01668286    0.00142573   -0.00516581
H    2.35621449    2.17521272   -0.08995382    0.00141011    0.00869461    0.00121326
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C    2.30180803    0.05184572    0.04262172    0.00594627    0.03035657    0.00323675
H    3.37773544    0.01305474    0.09749891   -0.00758513   -0.00266773    0.00078017
   15
   -420.53578143
H   -2.60432889    0.34397229   -0.03817939   -0.01882556   -0.01156631   -0.00418873
O   -2.00471679    1.17646424    0.02394436    0.01946850   -0.01161813   -0.00344895
O   -1.91643528   -1.24192258   -0.04333500    0.02549351    0.00905266   -0.00285382
C   -0.75905174    0.74104055    0.10572740   -0.00335688    0.01348862    0.01951603
C   -0.78505684   -0.74654740    0.05585566   -0.00611166   -0.00067490    0.00659954
C    0.31936381    1.58666788   -0.06824023   -0.00654098    0.00602826   -0.01080609
C    0.34734667   -1.58662763   -0.01606516   -0.03846598    0.01627610    0.00451868
C    1.71586267    1.27900394   -0.06182958    0.01511846   -0.00992361   -0.00728375
C    1.68015932   -1.27495355    0.00480111   -0.01858487   -0.05324249   -0.01007416
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H    2.46960096   -2.01520312    0.04040285    0.00827355    0.01404240    0.00431981
C    2.30249243    0.04902999    0.04064175    0.00476902    0.02784973    0.00318523
H    3.38059619   -0.00401913    0.09148467   -0.00577405   -0.00436692    0.00068390
   15
   -420.53632445
H   -2.59029563    0.34268352   -0.02757002   -0.01376101   -0.00871114   -0.00317479
O   -2.00663583    1.17740424    0.02447818    0.01363469   -0.01285164   -0.00418729
O   -1.91708641   -1.24417040   -0.04502282    0.02177908    0.00668201   -0.00367447
C   -0.75622020    0.74312755    0.10364329    0.00260795    0.01408805    0.01878558
C   -0.78493455   -0.74564463    0.05669253   -0.00569457    0.00214827    0.00773556
C    0.31694522    1.58785407   -0.06878695   -0.01078555    0.00141381   -0.01061198
C    0.35075215   -1.58645693   -0.01434481   -0.03228259    0.01367965    0.00375966
C    1.71570249    1.27710735   -0.06039963    0.01635320   -0.00869395   -0.00730527
C    1.67698220   -1.27184523    0.00509521   -0.02745742   -0.04730173   -0.00991942
H    0.10919118    2.64753898   -0.12099247    0.00670724   -0.00349909    0.00276096
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H    2.33423839    2.18099269   -0.07398811   -0.00294813    0.00778565    0.00181793
H    2.47299851   -2.01846227    0.04046896    0.01267860    0.00997513    0.00446885
C    2.30310581    0.04579424    0.03861366    0.00270222    0.02448223    0.00310194
H    3.38448512   -0.02030778    0.08534732   -0.00317920   -0.00600038    0.00060323
   15
   -420.53673781
H   -2.57380639    0.34294140   -0.01638992   -0.00728390   -0.00440811   -0.00211547
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O   -1.91798420   -1.24649392   -0.04666896    0.01763298    0.00422149   -0.00452095
C   -0.75342778    0.74500179    0.10127527    0.00829771    0.01448383    0.01796396
C   -0.78472635   -0.74477463    0.05741242   -0.00510499    0.00519924    0.00888424
C    0.31468925    1.58901953   -0.06917327   -0.01463809   -0.00374603   -0.01034659
C    0.35464450   -1.58649348   -0.01268138   -0.02508291    0.01145173    0.00304051
C    1.71529526    1.27534124   -0.05885928    0.01741123   -0.00667069   -0.00728367
C    1.67421925   -1.26802294    0.00553903   -0.03554462   -0.04035777   -0.00955386
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H    0.24850561   -2.64395791   -0.17474716    0.02023841    0.00826853   -0.00381327
H    2.32384195    2.18172290   -0.06646927   -0.00539863    0.00651919    0.00207681
H    2.47412341   -2.02351738    0.03973201    0.01642161    0.00589006    0.00451645
C    2.30367892    0.04218927    0.03653868    0.00015025    0.02032521    0.00300675
H    3.38894083   -0.03551725    0.07910156   -0.00020582   -0.00755191    0.00051859
   15
   -420.53692304
H   -2.55601674    0.34397624   -0.00482797    0.00001775    0.00095922   -0.00112760
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O   -1.91908180   -1.24886525   -0.04826380    0.01326121    0.00172189   -0.00539225
C   -0.75076033    0.74665730    0.09863572    0.01358441    0.01466050    0.01707768
C   -0.78444109   -0.74398333    0.05799800   -0.00441733    0.00833146    0.01001719
C    0.31265416    1.59024132   -0.06940319   -0.01811664   -0.00866431   -0.01004325
C    0.35891516   -1.58670396   -0.01106401   -0.01710966    0.00986379    0.00239611
C    1.71462510    1.27367538   -0.05720888    0.01818957   -0.00412629   -0.00720724
C    1.67199199   -1.26359118    0.00612703   -0.04220480   -0.03282484   -0.00896444
H    0.11874875    2.66799200   -0.11558497    0.00628782    0.00676141    0.00233161
H    0.25283992   -2.64475090   -0.16588909    0.02014218    0.00847469   -0.00360341
H    2.31441685    2.18128368   -0.05932367   -0.00780969    0.00495615    0.00229552
H    2.47230815   -2.02963862    0.03818379    0.01904510    0.00219694    0.00444058
C    2.30424989    0.03827789    0.03441822   -0.00250165    0.01543064    0.00290878
H    3.39343439   -0.04936882    0.07276294    0.00270992   -0.00895921    0.00041166
   15
   -420.53690081
H   -2.53823072    0.34483312    0.00693903    0.00734898    0.00663137   -0.00028988
O   -2.01299051    1.18122789    0.02639577   -0.00867360   -0.02233158   -0.00598720
O   -1.92032982   -1.25125614   -0.04979749    0.00887765   -0.00075694   -0.00625557
C   -0.74829769    0.74809142    0.09573800    0.01838578    0.01461973    0.01615851
C   -0.78408901   -0.74331793    0.05843219   -0.00372480    0.01139387    0.01110803
C    0.31089252    1.59159303   -0.06948127   -0.02119751   -0.01268584   -0.00974501
C    0.36344391   -1.58706447   -0.00948294   -0.00863422    0.00900483    0.00182599
C    1.71368040    1.27207171   -0.05544957    0.01856799   -0.00140114   -0.00706900
C    1.67040055   -1.25866345    0.00685031   -0.04696424   -0.02500281   -0.00816144
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H    0.25355736   -2.64705104   -0.15638040    0.01941001    0.00740496   -0.00351611
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H    2.46708441   -2.03616522    0.03583802    0.02027679   -0.00081474    0.00423448
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   15
   -420.53685822
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O   -1.92167870   -1.25363850   -0.05126024    0.00467311   -0.00316023   -0.00709707
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   15
   -420.53695429
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O   -1.92308091   -1.25598511   -0.05264251    0.00081671   -0.00544357   -0.00789880
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C   -0.78322477   -0.74254628    0.05878156   -0.00265495    0.01678940    0.01306610
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C    0.37276113   -1.58819247   -0.00639546    0.00869016    0.00891750    0.00074747
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H    0.12467871    2.68821402   -0.11054894    0.00576738    0.01530647    0.00185579
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C    2.30632443    0.02549322    0.02779851   -0.00802867   -0.00284387    0.00263005
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   15
   -420.53734051
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O   -1.92449282   -1.25827011   -0.05393524   -0.00256809   -0.00757517   -0.00865187
C   -0.74282279    0.75108644    0.08563460    0.02944988    0.01338431    0.01343889
C   -0.78272865   -0.74252135    0.05866717   -0.00240023    0.01889945    0.01389843
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C    1.70918381    1.26724471   -0.04954393    0.01618403    0.00439046   -0.00629400
C    1.66998951   -1.24208742    0.00969730   -0.04756330   -0.00180257   -0.00479144
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C    2.30722893    0.02118818    0.02551051   -0.00850835   -0.00970825    0.00251837
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   15
   -420.53795391
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O   -1.92587610   -1.26046935   -0.05512987   -0.00540455   -0.00953793   -0.00934932
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C   -0.78219599   -0.74278155    0.05834279   -0.00233674    0.02050095    0.01460847
C    0.30740664    1.59917736   -0.06835753   -0.02849080   -0.01302886   -0.00894016
C    0.38155963   -1.58986010   -0.00335244    0.02464038    0.00887487   -0.00049458
C    1.70717098    1.26553364   -0.04737914    0.01400465    0.00469206   -0.00593481
C    1.67131691   -1.23635386    0.01081549   -0.04313168    0.00535654   -0.00349906
H    0.12338368    2.68892578   -0.10891122    0.00566738    0.01339042    0.00169256
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H    2.29482686    2.17067749   -0.03033514   -0.01308013    0.00098125    0.00290046
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C    2.30826118    0.01703006    0.02318446   -0.00824547   -0.01669630    0.00238212
H    3.40198127   -0.09080291    0.04051019    0.00636860   -0.01236876   -0.00043255
   15
   -420.53857577
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O   -1.92719860   -1.26256062   -0.05621851   -0.00766279   -0.01129323   -0.00998469
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C   -0.78162784   -0.74335103    0.05779769   -0.00240648    0.02152975    0.01518938
C    0.30756334    1.60162441   -0.06773279   -0.02870672   -0.00872688   -0.00887433
C    0.38545945   -1.59089568   -0.00182459    0.03142563    0.00801694   -0.00127002
C    1.70494719    1.26375277   -0.04512469    0.01117048    0.00407899   -0.00553195
C    1.67329406   -1.23070070    0.01198659   -0.03674002    0.01207103   -0.00220843
H    0.12120250    2.68554009   -0.10855624    0.00567662    0.01015884    0.00165205
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H    2.29776248    2.16790398   -0.02603639   -0.01204999    0.00193649    0.00297678
H    2.39157847   -2.06173298    0.01413342    0.00497284   -0.00167247    0.00182679
C    2.30941729    0.01312428    0.02082244   -0.00731545   -0.02360327    0.00221156
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   15
   -420.53895241
H   -2.48609202    0.31057198    0.07515228    0.01492191   -0.00150451    0.00330765
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O   -1.92843470   -1.26452399   -0.05719394   -0.00935453   -0.01284023   -0.01055659
C   -0.74129187    0.75227215    0.07370016    0.03479209    0.01108500    0.01089079
C   -0.78102326   -0.74424528    0.05702310   -0.00249894    0.02193798    0.01563464
C    0.30815314    1.60420168   -0.06697383   -0.02815139   -0.00301040   -0.00884280
C    0.38888549   -1.59205142   -0.00027742    0.03713433    0.00628113   -0.00214392
C    1.70255519    1.26191118   -0.04278664    0.00778520    0.00267839   -0.00508803
C    1.67582491   -1.22522956    0.01319114   -0.02884837    0.01841035   -0.00096422
H    0.11799933    2.68034242   -0.10849884    0.00569627    0.00574894    0.00162722
H    0.19603804   -2.67140147   -0.08622844    0.00539035   -0.00956129   -0.00263172
H    2.30285844    2.16477498   -0.02227341   -0.01040016    0.00335452    0.00304302
H    2.37048548   -2.06522032    0.00840905   -0.00102817    0.00072545    0.00127459
C    2.31068335    0.00957500    0.01842703   -0.00585277   -0.03021094    0.00199938
H    3.39719987   -0.09232833    0.02792087    0.00149184   -0.01184061   -0.00073169
   15
   -420.53888386
H   -2.48853404    0.30070374    0.08515180    0.01115812   -0.00804913    0.00426398
O   -2.02246986    1.19830156    0.03328156   -0.01876127    0.00713172   -0.00714306
O   -1.92956515   -1.26634200   -0.05804971   -0.01053566   -0.01411444   -0.01104643
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C   -0.78038094   -0.74547043    0.05601230   -0.00250232    0.02170453    0.01594113
C    0.30916761    1.60682336   -0.06608115   -0.02677926    0.00362957   -0.00883300
C    0.39175185   -1.59330104    0.00130224    0.04154269    0.00360344   -0.00309706
C    1.70004595    1.26002978   -0.04037172    0.00401617    0.00072579   -0.00459739
C    1.67879099   -1.22003650    0.01441037   -0.02010869    0.02453330    0.00019836
H    0.11377129    2.67412009   -0.10873479    0.00568390    0.00061527    0.00161677
H    0.18013686   -2.67229046   -0.07258529    0.00238487   -0.01071593   -0.00209060
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H    2.34957703   -2.06884148    0.00245463   -0.00703972    0.00336333    0.00076348
C    2.31203755    0.00648187    0.01600144   -0.00410551   -0.03629900    0.00174357
H    3.39416643   -0.08986296    0.02181078   -0.00165769   -0.01128613   -0.00082872
   15
   -420.53842918
H   -2.49298591    0.29227131    0.09438355    0.00742020   -0.01365965    0.00522731
O   -2.02286720    1.20109880    0.03456884   -0.01656153    0.01439627   -0.00742793
O   -1.93057649   -1.26800019   -0.05878026   -0.01128324   -0.01509945   -0.01144745
C   -0.74284937    0.75220509    0.06489967    0.03422113    0.00929566    0.00913120
C   -0.77970109   -0.74702294    0.05476062   -0.00224183    0.02081269    0.01611205
C    0.31058590    1.60938987   -0.06505494   -0.02450920    0.01052020   -0.00881185
C    0.39399183   -1.59460412    0.00292877    0.04455693    0.00001588   -0.00409722
C    1.69747624    1.25813774   -0.03788734    0.00004181   -0.00150444   -0.00405516
C    1.68206104   -1.21521442    0.01562672   -0.01127861    0.03070303    0.00126512
H    0.10852128    2.66778852   -0.10926164    0.00558269   -0.00462081    0.00158882
H    0.16380567   -2.67126530   -0.05856741   -0.00041953   -0.01079352   -0.00145476
H    2.31827143    2.15641276   -0.01639866   -0.00592690    0.00646855    0.00311467
H    2.32992888   -2.07306314   -0.00363792   -0.01253994    0.00566527    0.00029604
C    2.31345380    0.00393665    0.01354952   -0.00235681   -0.04162785    0.00144619
H    3.39143109   -0.08536701    0.01584926   -0.00477093   -0.01060547   -0.00088447
   15
   -420.53772558
H   -2.49877934    0.28627881    0.10267540    0.00406123   -0.01794221    0.00610581
O   -2.02307642    1.20373412    0.03594027   -0.01459831    0.02007688   -0.00759723
O   -1.93146013   -1.26948744   -0.05938105   -0.01169410   -0.01573807   -0.01173892
C   -0.74440816    0.75195386    0.06028565    0.03246076    0.00840849    0.00818408
C   -0.77898777   -0.74888934    0.05326550   -0.00162450    0.01928726    0.01615222
C    0.31237359    1.61179803   -0.06389557   -0.02128139    0.01682212   -0.00873609
C    0.39555988   -1.59590648    0.00461723    0.04610310   -0.00434856   -0.00509023
C    1.69490593    1.25626847   -0.03534171   -0.00395967   -0.00374829   -0.00345483
C    1.68550236   -1.21085701    0.01682404   -0.00307511    0.03721369    0.00224615
H    0.10226917    2.66227920   -0.11007426    0.00528390   -0.00917785    0.00152190
H    0.14754548   -2.66831282   -0.04428854   -0.00290857   -0.00978175   -0.00076337
H    2.32778881    2.15062658   -0.01429959   -0.00349035    0.00764074    0.00310113
H    2.31252265   -2.07829231   -0.00978440   -0.01696428    0.00706670   -0.00013879
C    2.31490606    0.00201963    0.01107579   -0.00093469   -0.04597350    0.00111107
H    3.38954779   -0.07896304    0.01004644   -0.00740622   -0.00984821   -0.00090204
   15
   -420.53707888
H   -2.50531098    0.28349403    0.10987061    0.00124277   -0.02073088    0.00682104
O   -2.02311978    1.20614330    0.03739775   -0.01291538    0.02396802   -0.00761029
O   -1.93221135   -1.27079652   -0.05984881   -0.01185495   -0.01601639   -0.01190509
C   -0.74645648    0.75157545    0.05554795    0.02966416    0.00756123    0.00718359
C   -0.77825046   -0.75104666    0.05152632   -0.00055001    0.01715867    0.01606708
C    0.31448179    1.61395359   -0.06260423   -0.01703033    0.02170257   -0.00855909
C    0.39643277   -1.59714239    0.00638263    0.04612085   -0.00925043   -0.00602890
C    1.69239530    1.25445560   -0.03274393   -0.00781668   -0.00578462   -0.00279608
C    1.68899171   -1.20706281    0.01798748    0.00389657    0.04419068    0.00316350
H    0.09507087    2.65840154   -0.11116021    0.00464913   -0.01230360    0.00139115
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H    2.33793627    2.14347289   -0.01275811   -0.00116993    0.00825683    0.00304096
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C    2.31637319    0.00079624    0.00858529   -0.00012480   -0.04911466    0.00074743
H    3.38898486   -0.07078729    0.00440559   -0.00914550   -0.00902698   -0.00089026
   15
   -420.53667329
H   -2.51207619    0.28442083    0.11584004   -0.00088766   -0.02208562    0.00734457
O   -2.02301642    1.20828226    0.03894134   -0.01149947    0.02603893   -0.00740826
O   -1.93282822   -1.27192430   -0.06018163   -0.01185056   -0.01590065   -0.01194629
C   -0.74895207    0.75108261    0.05070171    0.02585928    0.00679479    0.00612371
C   -0.77750546   -0.75346274    0.04954434    0.00102553    0.01447328    0.01587434
C    0.31684618    1.61578350   -0.06118365   -0.01174049    0.02454382   -0.00823909
C    0.39661018   -1.59823814    0.00823908    0.04464113   -0.01438440   -0.00687161
C    1.69000253    1.25272974   -0.03010393   -0.01139024   -0.00743951   -0.00207946
C    1.69242407   -1.20393717    0.01910313    0.00929788    0.05150553    0.00405146
H    0.08704085    2.65670989   -0.11249501    0.00358638   -0.01343294    0.00115422
H    0.11696696   -2.65753512   -0.01544443   -0.00675934   -0.00489609    0.00060522
H    2.34829829    2.13484261   -0.01176336    0.00088144    0.00818934    0.00293167
H    2.28734921   -2.09251165   -0.02192292   -0.02140639    0.00558095   -0.00104960
C    2.31784316    0.00031378    0.00608351   -0.00010450   -0.05087636    0.00036658
H    3.39005090   -0.06098709   -0.00107523   -0.00968256   -0.00815759   -0.00086214
   15
   -420.53667998
H   -2.51869178    0.28930301    0.12049128   -0.00225666   -0.02204748    0.00761178
O   -2.02278235    1.21012739    0.04056876   -0.01036904    0.02635631   -0.00699541
O   -1.93331077   -1.27287206   -0.06037905   -0.01171874   -0.01541331   -0.01184776
C   -0.75183751    0.75048687    0.04576295    0.02112044    0.00614810    0.00500983
C   -0.77677654   -0.75609700    0.04732249    0.00308892    0.01126467    0.01557352
C    0.31938692    1.61724504   -0.05963868   -0.00548928    0.02512232   -0.00775108
C    0.39611434   -1.59911662    0.01019924    0.04174806   -0.01934351   -0.00756915
C    1.68778147    1.25111577   -0.02743256   -0.01453780   -0.00861072   -0.00131087
C    1.69571792   -1.20159017    0.02015752    0.01301392    0.05871801    0.00493096
H    0.07837219    2.65740583   -0.11403565    0.00202970   -0.01240345    0.00078750
H    0.10333833   -2.65058109   -0.00112488   -0.00801791   -0.00147964    0.00120131
H    2.35850736    2.12474892   -0.01129562    0.00255335    0.00736405    0.00277159
H    2.28038116   -2.10123348   -0.02775023   -0.02139359    0.00266628   -0.00157912
C    2.31931570    0.00059871    0.00357620   -0.00088346   -0.05112236   -0.00002207
H    3.39284090   -0.04971911   -0.00640087   -0.00890741   -0.00723085   -0.00083210
   15
   -420.53696180
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   15
   -420.53752578
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   15
   -420.53813612
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   15
   -420.53866685
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   15
   -420.53899573
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   15
   -420.53929789
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   15
   -420.53948955
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   15
   -420.53974004
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   15
   -420.54012437
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C   -0.77741804   -0.77998867    0.01768315    0.02468308   -0.02683364    0.00950574
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   15
   -420.54058806
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O   -1.93193762   -1.27521764   -0.05579655    0.00129070    0.00073187   -0.00586378
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C   -0.77899804   -0.78146286    0.01350627    0.02436178   -0.03001953    0.00853626
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   15
   -420.54097809
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O   -1.93149425   -1.27515548   -0.05483676    0.00430731    0.00246465   -0.00510635
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   15
   -420.54103137
H   -2.62936933    0.45472892    0.09229442   -0.00259842    0.00761699    0.00288896
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O   -1.93109984   -1.27512120   -0.05381903    0.00743960    0.00409155   -0.00436008
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C   -0.78324032   -0.78301437    0.00478090    0.02086768   -0.03424585    0.00645042
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C    1.68275633    1.24228803    0.00247361   -0.01103055   -0.01735218    0.00878775
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C    2.34106765    0.04407797   -0.02468556    0.01425875    0.02727943   -0.00522631
H    3.42584316    0.12399078   -0.05822579    0.00112726    0.00773335   -0.00072227
   15
   -420.54070715
H   -2.64553790    0.45814569    0.08565802   -0.00950474    0.00183453    0.00283135
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   15
   -420.54007336
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   15
   -420.53938642
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   15
   -420.53887154
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   15
   -420.53872083
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O   -1.93105176   -1.27594957   -0.04815565    0.01965591    0.00930484   -0.00075807
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C    1.68972626    1.24753823    0.01054881   -0.00040334   -0.02577875    0.01189153
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   15
   -420.53887150
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   15
   -420.53915638
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O   -1.93242470   -1.27695399   -0.04577383    0.02063436    0.00922311    0.00057819
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   15
   -420.53937979
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C    1.69424044    1.25513013    0.01331330    0.00805970   -0.01891576    0.01269196
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   15
   -420.53934171
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O   -1.93472299   -1.27837148   -0.04341797    0.01875625    0.00766087    0.00184997
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C   -0.81089368   -0.76599910   -0.03716944   -0.01695420   -0.00888241   -0.00565689
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   15
   -420.53900344
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   15
   -420.53849470
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O   -1.93786305   -1.28013165   -0.04114584    0.01444306    0.00477123    0.00306798
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C    2.34084831    0.05398074   -0.04214259    0.00590399    0.02148906   -0.00328575
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   15
   -420.53807185
H   -2.63254914    0.53707360   -0.00636562    0.01491123    0.02122995    0.00083866
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O   -1.93969192   -1.28110157   -0.04005856    0.01162926    0.00295224    0.00366366
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C   -0.81787676   -0.75543509   -0.05040642   -0.02369316    0.01091529   -0.01032185
C    0.28668619    1.57115826   -0.01188457   -0.03208856   -0.01519176    0.00293298
C    0.38267031   -1.58078327    0.08747399   -0.02048593    0.00402035    0.01026138
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H    2.52904009   -2.07007221    0.04346863    0.01898661    0.00000674   -0.00068104
C    2.33939446    0.05190617   -0.04331444    0.00322831    0.01634402   -0.00284427
H    3.43734836    0.13586609   -0.09162632    0.00846796    0.00837356   -0.00114694
   15
   -420.53793185
H   -2.62684027    0.53765816   -0.01538481    0.01633756    0.02113366    0.00068134
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O   -1.94165245   -1.28210485   -0.03901282    0.00853939    0.00098302    0.00424348
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   15
   -420.53809175
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   15
   -420.53837108
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   15
   -420.53846736
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O   -1.94796708   -1.28508805   -0.03619002   -0.00124748   -0.00514336    0.00589823
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C    1.69810008    1.28194313    0.01233117    0.02105449    0.02075609    0.01143839
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   15
   -420.53822268
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O   -1.95009310   -1.28599648   -0.03537474   -0.00439601   -0.00702759    0.00639994
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C    0.28142359    1.55206138   -0.00371689   -0.04438737   -0.01391660    0.00086601
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C    2.33179653    0.03937172   -0.04864425    0.00043181   -0.00810204   -0.00111851
H    3.42272075    0.07317760   -0.09887124    0.00230881    0.00130039   -0.00113774
   15
   -420.53758571
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C    0.28230687    1.54900758   -0.00214603   -0.04338744   -0.00989812    0.00061929
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C    1.69607696    1.28690620    0.01027929    0.01730856    0.02455916    0.01060675
C    1.75061623   -1.28571620    0.00376166    0.00848756   -0.03306390   -0.00914143
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H    2.46575285   -2.09252757    0.10521663   -0.00033116    0.00411849    0.00223789
C    2.33026885    0.03695085   -0.04964080    0.00115077   -0.01226281   -0.00084216
H    3.41694417    0.05879510   -0.09967383   -0.00076180   -0.00040499   -0.00105689
   15
   -420.53677310
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O   -1.95416197   -1.28755560   -0.03396710   -0.01021191   -0.01015506    0.00727397
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C    0.28384438    1.54610355   -0.00058463   -0.04091825   -0.00601065    0.00045208
C    0.41666277   -1.58861062    0.10580208    0.02373372   -0.00075153    0.01800866
C    1.69465703    1.28884309    0.00900953    0.01434310    0.02521044    0.01007809
C    1.75313132   -1.28176154    0.00298235    0.01311981   -0.02847502   -0.01016102
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C    2.32872408    0.03471502   -0.05062464    0.00166047   -0.01612508   -0.00055888
H    3.41130353    0.04448694   -0.10028660   -0.00375244   -0.00213155   -0.00096690
   15
   -420.53596878
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O   -1.99476944    1.27934837    0.08537520    0.01017074    0.02718235    0.01716339
O   -1.95603891   -1.28817089   -0.03338463   -0.01282888   -0.01128792    0.00762447
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C    1.69302093    1.29039947    0.00758749    0.01079285    0.02531509    0.00946696
C    1.75544877   -1.27737792    0.00235672    0.01715064   -0.02264137   -0.01120572
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C    2.32715486    0.03272261   -0.05160007    0.00163230   -0.01965983   -0.00025377
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   15
   -420.53540786
H   -2.62515879    0.49352186   -0.07360376   -0.01070892   -0.01833424   -0.00875332
O   -1.99409505    1.28210562    0.08519988    0.01013269    0.02886976    0.01746920
O   -1.95777053   -1.28865846   -0.03288858   -0.01522319   -0.01206852    0.00790269
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C   -0.81952335   -0.74180431   -0.07955612   -0.01656111    0.04715768   -0.01988880
C    0.28870818    1.54052937    0.00252032   -0.03116595   -0.00200154    0.00004790
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C    1.69122213    1.29157349    0.00602242    0.00680794    0.02509081    0.00877242
C    1.75750773   -1.27265346    0.00190054    0.02046569   -0.01561918   -0.01227233
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C    2.32556197    0.03102699   -0.05257173    0.00077484   -0.02283412    0.00008904
H    3.40247505    0.01732357   -0.10100224   -0.00795962   -0.00544111   -0.00084738
   15
   -420.53506757
H   -2.62006850    0.49656811   -0.07564554   -0.00847246   -0.01692222   -0.00870812
O   -1.99353422    1.28453742    0.08482690    0.00860286    0.02842056    0.01724301
O   -1.95932970   -1.28900947   -0.03248211   -0.01737326   -0.01247558    0.00811084
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C   -0.81810853   -0.74340909   -0.08144871   -0.01388676    0.04649228   -0.02024185
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C    0.42778187   -1.59208640    0.10988310    0.03621933   -0.01204597    0.02039540
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C    2.32395856    0.02967610   -0.05354477   -0.00107701   -0.02558174    0.00046960
H    3.40003669    0.00506284   -0.10112676   -0.00859962   -0.00697779   -0.00083056
   15
   -420.53489928
H   -2.61347611    0.50263389   -0.07612756   -0.00460870   -0.01363092   -0.00816845
O   -1.99306970    1.28664873    0.08425871    0.00568561    0.02592246    0.01651893
O   -1.96069207   -1.28921928   -0.03216755   -0.01923534   -0.01250597    0.00823252
C   -0.77768859    0.70445684   -0.06911262    0.01280140   -0.00693479   -0.01236233
C   -0.81648404   -0.74571554   -0.08303546   -0.01097031    0.04476301   -0.02042833
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C    0.43046661   -1.59296490    0.11064165    0.03869724   -0.01663679    0.02097177
C    1.68738168    1.29278857    0.00250625   -0.00193820    0.02447719    0.00717535
C    1.76066173   -1.26261951    0.00156116    0.02489972    0.00085829   -0.01442417
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C    2.32237262    0.02871136   -0.05452497   -0.00391144   -0.02781720    0.00088732
H    3.39913020   -0.00594309   -0.10110128   -0.00811684   -0.00842042   -0.00084737
   15
   -420.53468774
H   -2.60607358    0.51112923   -0.07514584    0.00063127   -0.00861893   -0.00719125
O   -1.99266859    1.28846766    0.08350357    0.00156546    0.02156649    0.01531087
O   -1.96183655   -1.28928761   -0.03194630   -0.02077546   -0.01214784    0.00827273
C   -0.78033652    0.70430802   -0.06904341    0.00682635   -0.00551984   -0.01180561
C   -0.81469389   -0.74869754   -0.08431354   -0.00788417    0.04200375   -0.02044955
C    0.29918909    1.53252449    0.00719573   -0.00526005   -0.01008810   -0.00181873
C    0.43256725   -1.59359200    0.11108334    0.04034887   -0.02109274    0.02137773
C    1.68547184    1.29283860    0.00057926   -0.00636813    0.02435452    0.00630667
C    1.76168940   -1.25755796    0.00171029    0.02624904    0.00932403   -0.01537368
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H    2.24453492    2.23822661    0.03343519   -0.00737835    0.01376702    0.00056310
H    2.39644902   -2.13116091    0.15230286   -0.00910332   -0.00687230    0.00530297
C    2.32084679    0.02816647   -0.05551860   -0.00752810   -0.02943936    0.00132903
H    3.39967036   -0.01543496   -0.10092293   -0.00662872   -0.00973746   -0.00088658
   15
   -420.53430496
H   -2.59879819    0.52115800   -0.07287439    0.00679737   -0.00230535   -0.00587958
O   -1.99228447    1.29004326    0.08257507   -0.00341092    0.01575997    0.01373318
O   -1.96274569   -1.28921850   -0.03181881   -0.02194005   -0.01142927    0.00823439
C   -0.78308728    0.70424238   -0.06879579    0.00052530   -0.00385501   -0.01117955
C   -0.81278464   -0.75231345   -0.08528262   -0.00471007    0.03828598   -0.02030744
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C    0.43405877   -1.59390085    0.11120205    0.04125248   -0.02498063    0.02157035
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   15
   -420.53370504
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O   -1.96340634   -1.28902004   -0.03178465   -0.02267374   -0.01038384    0.00811914
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   15
   -420.53310709
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O   -1.96381024   -1.28870404   -0.03184253   -0.02292927   -0.00906406    0.00793813
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C   -0.80880013   -0.76120954   -0.08630490    0.00150626    0.02836675   -0.01953923
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C    2.31719786    0.02924015   -0.05864656   -0.01923835   -0.02972204    0.00258709
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   15
   -420.53273610
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O   -1.96395452   -1.28828546   -0.03199038   -0.02267456   -0.00749663    0.00768800
C   -0.79101025    0.70427681   -0.06708121   -0.01732308    0.00228321   -0.00900442
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C    0.43478626   -1.59241952    0.10961342    0.04062418   -0.02895629    0.02028014
C    1.67940053    1.28933548   -0.00794826   -0.02043049    0.02502999    0.00280276
C    1.76171899   -1.23979898    0.00472500    0.02812347    0.03205248   -0.01664499
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C    2.31648683    0.03050542   -0.05975930   -0.02204749   -0.02807658    0.00291489
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   15
   -420.53290167
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O   -1.96384207   -1.28778203   -0.03222538   -0.02189348   -0.00573266    0.00738329
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C   -0.80490303   -0.77180883   -0.08614853    0.00700587    0.01596587   -0.01816618
C    0.31615262    1.52323394    0.01577355    0.03982439   -0.02778573   -0.00659534
C    0.43379011   -1.59105692    0.10845742    0.03955448   -0.02683765    0.01906935
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C    1.76067064   -1.23641121    0.00610720    0.02787464    0.03313859   -0.01604882
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   15
   -420.53368703
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C   -0.80309300   -0.77751855   -0.08565288    0.00937378    0.00915991   -0.01727200
C    0.31821214    1.52249034    0.01773699    0.04434169   -0.02760965   -0.00700860
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C    1.67801713    1.28533153   -0.01251890   -0.02334224    0.02409351    0.00111949
C    1.75920118   -1.23352202    0.00773162    0.02735218    0.03217641   -0.01506867
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H    2.38112542   -2.12813520    0.16642587   -0.00777871   -0.01342521    0.00578437
C    2.31608698    0.03426788   -0.06212060   -0.02429215   -0.02215281    0.00334753
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   15
   -420.53490769
H   -2.61036441    0.55615907   -0.04416886    0.01306722    0.00903139   -0.00283022
O   -1.98765334    1.29778360    0.07432404   -0.00730786    0.00507556    0.00842889
O   -1.96288820   -1.28660228   -0.03294247   -0.01882518   -0.00176745    0.00662681
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C   -0.80142441   -0.78336649   -0.08489623    0.01150393    0.00213111   -0.01626052
C    0.31960399    1.52216227    0.01980598    0.04660310   -0.02586195   -0.00708409
C    0.43002825   -1.58717773    0.10530639    0.03594960   -0.01780438    0.01548117
C    1.67784536    1.28277873   -0.01483593   -0.02357354    0.02260100    0.00026340
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H    2.38350369   -2.11891054    0.16489514   -0.00808639   -0.01115193    0.00510578
C    2.31643186    0.03667567   -0.06337568   -0.02352045   -0.01801998    0.00344171
H    3.41331026   -0.02406148   -0.09496525    0.00557840   -0.01245088   -0.00068167
   15
   -420.53626357
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O   -1.96208150   -1.28597087   -0.03341599   -0.01663047    0.00036881    0.00618578
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C    1.67802910    1.27988531   -0.01715689   -0.02305766    0.02020265   -0.00062890
C    1.75503479   -1.22915383    0.01164239    0.02543707    0.02495863   -0.01207449
H   -0.07719597    2.53820436    0.22071593   -0.01823898    0.00302119    0.00568894
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C    2.31713089    0.03935516   -0.06468270   -0.02154186   -0.01326938    0.00345407
H    3.41267015   -0.01617314   -0.09349954    0.00474413   -0.01157281   -0.00051141
   15
   -420.53747883
H   -2.63759932    0.55206866   -0.03071592   -0.00221366   -0.00309948   -0.00390577
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O   -1.96108647   -1.28534369   -0.03395965   -0.01408761    0.00255971    0.00571494
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C   -0.79863738   -0.79505112   -0.08266264    0.01518090   -0.01209786   -0.01393495
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C    0.42410644   -1.58224162    0.10122492    0.02949371   -0.00484316    0.01075025
C    1.67856065    1.27668760   -0.01946828   -0.02186332    0.01683800   -0.00157096
C    1.75236691   -1.22756671    0.01388365    0.02395963    0.01951522   -0.01021038
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H    2.39269547   -2.09500794    0.15923115   -0.00875160   -0.00470215    0.00334791
C    2.31815439    0.04223474   -0.06604185   -0.01853646   -0.00807125    0.00338861
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   15
   -420.53834273
H   -2.65133085    0.55030092   -0.02298046   -0.00926595   -0.00824379   -0.00402756
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O   -1.95993188   -1.28474558   -0.03456811   -0.01128326    0.00478506    0.00522322
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C   -0.79757464   -0.80067296   -0.08122081    0.01680820   -0.01905600   -0.01266325
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C    2.31945721    0.04523603   -0.06745216   -0.01477225   -0.00261024    0.00325428
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   15
   -420.53885840
H   -2.66341543    0.54999543   -0.01452487   -0.01485475   -0.01190319   -0.00379974
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O   -1.95864947   -1.28420171   -0.03523582   -0.00829889    0.00699940    0.00472024
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C   -0.79676589   -0.80600699   -0.07958756    0.01831354   -0.02574744   -0.01134887
C    0.31832396    1.52415418    0.02907826    0.03423765   -0.00617843   -0.00393752
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C    1.68058643    1.26959640   -0.02400473   -0.01775247    0.00749323   -0.00358945
C    1.74597622   -1.22518631    0.01879830    0.01937105    0.00767823   -0.00612977
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H    2.35720833    2.11014386    0.08208302    0.00271645   -0.00649867    0.00313928
H    2.40811820   -2.06774241    0.15116683   -0.00826509    0.00203348    0.00147111
C    2.32098292    0.04827667   -0.06891159   -0.01063029    0.00293068    0.00305745
H    3.40692850    0.01907394   -0.08868922   -0.00148102   -0.00727862    0.00007730
   15
   -420.53907295
H   -2.67285310    0.55180767   -0.00538860   -0.01853957   -0.01387538   -0.00328488
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O   -1.95727302   -1.28373720   -0.03595707   -0.00519947    0.00917307    0.00421739
C   -0.79740892    0.70065182   -0.05732198   -0.02930711    0.01312449   -0.00417948
C   -0.79623387   -0.81095222   -0.07778276    0.01966968   -0.03205336   -0.01001377
C    0.31652631    1.52510558    0.03158586    0.02744572   -0.00030212   -0.00264936
C    0.41209371   -1.57454171    0.09398340    0.01320949    0.01424585    0.00316956
C    1.68201857    1.26584377   -0.02619930   -0.01494573    0.00186258   -0.00464077
C    1.74232307   -1.22421552    0.02141033    0.01600349    0.00243306   -0.00413438
H   -0.04121128    2.51422053    0.24799475   -0.00843452   -0.01681411    0.00250669
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H    2.36957420    2.10000142    0.08395022    0.00499577   -0.00671408    0.00346592
H    2.41808949   -2.05436002    0.14665512   -0.00705342    0.00458535    0.00064333
C    2.32266938    0.05127313   -0.07041720   -0.00653347    0.00836151    0.00280643
H    3.40497899    0.03382632   -0.08706618   -0.00390934   -0.00542815    0.00027460
   15
   -420.53916602
H   -2.67898372    0.55608996    0.00433478   -0.02010994   -0.01401994   -0.00252098
O   -1.98144668    1.30200254    0.06251751    0.02004781    0.02775475    0.00639235
O   -1.95583765   -1.28337664   -0.03672617   -0.00204633    0.01124807    0.00372670
C   -0.79618468    0.69940505   -0.05574416   -0.02745394    0.01241910   -0.00397349
C   -0.79599900   -0.81541346   -0.07582654    0.02082635   -0.03784169   -0.00869104
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C    0.40756947   -1.57228370    0.09142339    0.00631768    0.01913529    0.00089310
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   15
   -420.53919047
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   15
   -420.53917195
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   15
   -420.53895204
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   15
   -420.53833798
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   15
   -420.53724835
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C    1.69346454    1.24575486   -0.03739590    0.00859697   -0.02818373   -0.00925376
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C    2.33349125    0.06417050   -0.08015750    0.00000844    0.02956797    0.00026056
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   15
   -420.53577559
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   15
   -420.53428287
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   15
   -420.53319876
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O   -1.94645068   -1.28660010   -0.04399590    0.02061497    0.01938020    0.00082835
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C    2.33889043    0.06521875   -0.08517494   -0.00404942    0.02788835   -0.00175531
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   15
   -420.53278262
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O   -1.94602607   -1.28794269   -0.04498274    0.02240211    0.01885627    0.00058314
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   15
   -420.53302327
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C   -0.81054358   -0.82040292   -0.05177954    0.00409165   -0.04319743   -0.00056263
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   15
   -420.53372252
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C    2.34476594    0.06256185   -0.08995006   -0.00191278    0.01838131   -0.00405700
H    3.43813576    0.18074726   -0.07959372    0.00678998    0.01539427    0.00207974
   15
   -420.53462241
H   -2.67010722    0.58995505    0.12235598   -0.00754673    0.00085694    0.00439497
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C   -0.81571589   -0.81251517   -0.04661150   -0.00432953   -0.03078215   -0.00015973
C    0.29112819    1.53962506    0.06626810   -0.04130020   -0.01306907    0.00105758
C    0.37243187   -1.57267062    0.06536800   -0.03158743    0.01468009   -0.00930323
C    1.70044607    1.24008010   -0.04438985    0.02541989   -0.02706814   -0.00841134
C    1.69980316   -1.20466773    0.05208332   -0.02499237   -0.00650666    0.01235360
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   15
   -420.53558292
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   15
   -420.53654868
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   15
   -420.53747124
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C    1.69816673    1.24416679   -0.04539860    0.01796142   -0.02170890   -0.00683256
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   15
   -420.53842644
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C    1.69680008    1.24621972   -0.04551680    0.01358111   -0.02022902   -0.00614728
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   15
   -420.53935783
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C   -0.82665250   -0.78677215   -0.03368871   -0.01702752    0.01006567    0.00068801
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   15
   -420.54028981
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C    1.69801219   -1.19045760    0.05784269   -0.01007918    0.01175085    0.01030308
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   15
   -420.54106353
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C    1.69842824   -1.18830477    0.05819755   -0.00896823    0.01841656    0.00919163
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   15
   -420.54151654
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O   -1.95768902   -1.31232578   -0.05569988    0.00268481   -0.00933278   -0.00198522
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C    1.69007332    1.25727038   -0.04518883   -0.00829619   -0.01369348   -0.00233969
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   15
   -420.54141647
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   15
   -420.54079024
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O   -1.96165934   -1.31680632   -0.05746116   -0.00514460   -0.01550471   -0.00250140
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C    1.68711658    1.26413852   -0.04475095   -0.01906466   -0.00839009    0.00006202
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H    2.34242326   -2.07274886    0.14546165   -0.00485726   -0.00882108    0.00089949
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   15
   -420.53983549
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O   -1.96357902   -1.31879994   -0.05830071   -0.00865471   -0.01823928   -0.00276876
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C   -0.83194463   -0.76173424   -0.01859250   -0.01351157    0.04598326    0.00227139
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H    2.33238485   -2.08545549    0.15062618   -0.00521135   -0.01236309    0.00177516
C    2.35804129    0.04465022   -0.10072194    0.01345657   -0.02114416   -0.01041203
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   15
   -420.53876114
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O   -1.96540088   -1.32058694   -0.05910886   -0.01176581   -0.02068075   -0.00303850
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C   -0.83201957   -0.75959409   -0.01617324   -0.01234481    0.04798194    0.00249258
C    0.33163427    1.55466940    0.09250449    0.02427492   -0.00056784    0.00820446
C    0.38601637   -1.59836710    0.05672700    0.02057195   -0.03609102   -0.00182000
C    1.68530208    1.27150508   -0.04431664   -0.02768798   -0.00132832    0.00242809
C    1.70224220   -1.18371113    0.05827229   -0.00271716    0.04524777    0.00301705
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C    2.35749211    0.04450160   -0.10072152    0.01028401   -0.02054407   -0.01045817
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   15
   -420.53784361
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O   -1.96708970   -1.32213962   -0.05988253   -0.01442150   -0.02281371   -0.00330882
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C   -0.83190775   -0.75817780   -0.01379162   -0.01126020    0.04866182    0.00267423
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   15
   -420.53705111
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C    1.68514510    1.27894779   -0.04402738   -0.03298394    0.00659352    0.00442443
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   15
   -420.53645615
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C    1.68579637    1.28254997   -0.04397578   -0.03421758    0.01035515    0.00520571
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   15
   -420.53606116
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O   -1.97108385   -1.32516905   -0.06196739   -0.01956454   -0.02716521   -0.00396446
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C   -0.83060965   -0.75827945   -0.00689633   -0.00835038    0.04329187    0.00291353
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C    1.68696385    1.28599615   -0.04400270   -0.03451754    0.01364619    0.00583728
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   15
   -420.53589816
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O   -1.97199294   -1.32558120   -0.06257537   -0.02043246   -0.02787632   -0.00408623
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C   -0.82990509   -0.75967354   -0.00468509   -0.00729232    0.03935683    0.00288043
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C    1.70685973   -1.19474212    0.05707637    0.00968461    0.02937698    0.00051571
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   15
   -420.53597791
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O   -1.97267055   -1.32567750   -0.06313706   -0.02096614   -0.02819030   -0.00413977
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C    1.69085347    1.29223419   -0.04432836   -0.03268071    0.01785577    0.00671357
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C    2.35192201    0.04906452   -0.09743108    0.00743685   -0.00500451   -0.00993762
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   15
   -420.53626440
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O   -1.97311059   -1.32545440   -0.06365187   -0.02120900   -0.02809550   -0.00411026
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C    1.69354802    1.29496256   -0.04464039   -0.03072325    0.01856458    0.00699479
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H    2.30367266   -2.09701469    0.17174202   -0.01664384   -0.00175674    0.00418310
C    2.35068287    0.05036260   -0.09634758    0.01007249   -0.00187263   -0.00984546
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   15
   -420.53674410
H   -2.58524966    0.42748011    0.06559281   -0.01276095   -0.01823358    0.00674320
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O   -1.97331028   -1.32491298   -0.06412011   -0.02120331   -0.02758973   -0.00399982
C   -0.75768448    0.72496116    0.03911321   -0.00804708    0.03100926   -0.00218328
C   -0.82720931   -0.76711937    0.00169386   -0.00289114    0.02294645    0.00246649
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C    1.69670638    1.29741133   -0.04505809   -0.02818208    0.01837900    0.00719290
C    1.70820777   -1.20719726    0.05621578    0.01609596    0.00562337    0.00073325
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C    2.34929098    0.05168934   -0.09511528    0.01306670    0.00102719   -0.00973392
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   15
   -420.53731674
H   -2.58117983    0.42338761    0.05151587   -0.01166760   -0.01724400    0.00586468
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O   -1.97326966   -1.32405896   -0.06454305   -0.02096229   -0.02668412   -0.00381205
C   -0.75766757    0.72774009    0.04347648   -0.00845923    0.03593014   -0.00150315
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C    1.70820720   -1.21167998    0.05590863    0.01668430   -0.00129985    0.00074152
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C    2.34770158    0.05300087   -0.09373586    0.01599875    0.00366733   -0.00958692
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   15
   -420.53796132
H   -2.57503190    0.42237701    0.03638553   -0.00903225   -0.01469166    0.00483054
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O   -1.97299148   -1.32290259   -0.06492282   -0.02048528   -0.02539702   -0.00355883
C   -0.75752305    0.72997687    0.04786244   -0.00863583    0.03994828   -0.00078989
C   -0.82515824   -0.77395621    0.00575675    0.00126586    0.00960462    0.00196913
C    0.34363200    1.55870172    0.10017797    0.02357586    0.00719659    0.00807074
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C    1.70425296    1.30149128   -0.04622098   -0.02152324    0.01609028    0.00729687
C    1.70795583   -1.21614469    0.05559041    0.01605815   -0.00686003    0.00063607
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C    2.34587094    0.05425727   -0.09221159    0.01838759    0.00603138   -0.00936277
H    3.41172170   -0.07837941   -0.21088317   -0.00612311   -0.01445816    0.00035865
   15
   -420.53868077
H   -2.56727699    0.42398949    0.02038602   -0.00504247   -0.01062321    0.00375671
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O   -1.97248119   -1.32145844   -0.06526229   -0.01974056   -0.02376304   -0.00324380
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C    1.70854058    1.30315644   -0.04696770   -0.01744652    0.01450230    0.00715483
C    1.70746323   -1.22050754    0.05526272    0.01414752   -0.01091086    0.00041911
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C    2.34376347    0.05542278   -0.09054597    0.01977204    0.00813426   -0.00898049
H    3.40554139   -0.07413520   -0.21961460   -0.00843605   -0.01365839    0.00027198
   15
   -420.53937106
H   -2.55863056    0.42749547    0.00370920    0.00005543   -0.00523803    0.00275271
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O   -1.97174725   -1.31974501   -0.06556502   -0.01868741   -0.02183049   -0.00288108
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C   -0.82318646   -0.78137092    0.00970125    0.00593476   -0.00433914    0.00133810
C    0.33950148    1.56031519    0.10028999    0.00882840    0.01124791    0.00813773
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C    1.71309138    1.30460227   -0.04782239   -0.01287536    0.01295790    0.00684123
C    1.70675816   -1.22470706    0.05492878    0.01107070   -0.01362117    0.00013690
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H    2.32173319    2.19719636   -0.22918069   -0.00034180    0.00524226   -0.00497067
H    2.36663192   -2.07305212    0.16086489   -0.00702603    0.00304024    0.00471771
C    2.34135874    0.05646560   -0.08874486    0.01977022    0.01000473   -0.00837906
H    3.40086300   -0.06743519   -0.22839359   -0.00957196   -0.01263993    0.00006229
   15
   -420.53999121
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   15
   -420.54033710
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   15
   -420.54031969
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C   -0.75496385    0.73147275    0.06973626   -0.00410767    0.04360149    0.00333557
C   -0.82097484   -0.79175255    0.01548089    0.01133695   -0.02376215    0.00020767
C    0.33249237    1.56171903    0.09952375   -0.00684442   -0.00548176    0.00900544
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C    1.72759499    1.30783458   -0.05097078    0.00371851    0.01028858    0.00461000
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   15
   -420.53997773
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O   -1.96687891   -1.31067309   -0.06649599   -0.01050460   -0.01226276   -0.00113331
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C   -0.82054942   -0.79462041    0.01739330    0.01198526   -0.02919747   -0.00020114
C    0.33026911    1.56220620    0.09900351   -0.01077054   -0.01412305    0.00947815
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C    2.32911783    0.05889451   -0.08042639    0.00556175    0.01506389   -0.00341777
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   15
   -420.53931434
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C   -0.75336739    0.72742166    0.07822389    0.00050356    0.03758906    0.00530737
C   -0.82030420   -0.79704777    0.01930875    0.01180587   -0.03385565   -0.00061117
C    0.32820842    1.56290613    0.09833998   -0.01445512   -0.02212758    0.00993426
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C    1.73712156    1.30918557   -0.05343580    0.01666419    0.01076483    0.00204376
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C    2.32567147    0.05897048   -0.07816213    0.00007863    0.01547996   -0.00172452
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   15
   -420.53849035
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O   -1.96362686   -1.30518966   -0.06686388   -0.00393860   -0.00711832   -0.00012875
C   -0.75256241    0.72451893    0.08235490    0.00302803    0.03322862    0.00637303
C   -0.82023643   -0.79896435    0.02123344    0.01074213   -0.03760204   -0.00102109
C    0.32636607    1.56393858    0.09752635   -0.01797280   -0.02847830    0.01029944
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C    1.74155653    1.30961973   -0.05472478    0.02332808    0.01157225    0.00052085
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H    2.46693478   -2.05139369    0.11962477    0.01858889   -0.00535586    0.00455737
C    2.32222356    0.05881300   -0.07587178   -0.00518753    0.01545446   -0.00002664
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   15
   -420.53758448
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O   -1.96191460   -1.30231221   -0.06704277   -0.00024316   -0.00460606    0.00039677
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C    0.32479518    1.56539886    0.09655717   -0.02126372   -0.03255948    0.01051892
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C    1.74563893    1.30987866   -0.05602155    0.02985988    0.01259184   -0.00108175
C    1.70056969   -1.24709759    0.05263464   -0.01227557   -0.02592142    0.00120514
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C    2.31885326    0.05842242   -0.07358095   -0.00982483    0.01497361    0.00158595
H    3.40030267    0.02832174   -0.28356144    0.00723504    0.00017484   -0.00584774
   15
   -420.53665524
H   -2.55083985    0.41979812   -0.13854052    0.00347611   -0.00051569   -0.00351404
O   -1.98011008    1.22567121   -0.02066566    0.00222066   -0.00451537   -0.00264993
O   -1.96019968   -1.29938246   -0.06722615    0.00354881   -0.00216646    0.00091666
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C   -0.82055572   -0.80105456    0.02513489    0.00607963   -0.04193625   -0.00176093
C    0.32354536    1.56734823    0.09542918   -0.02420038   -0.03402770    0.01055616
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C    1.70013540   -1.24899078    0.05228621   -0.01234848   -0.02900741    0.00194349
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H    2.48054475   -2.03791259    0.09890014    0.01935319   -0.00183045    0.00337431
C    2.31563035    0.05780600   -0.07131387   -0.01353795    0.01403973    0.00301418
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   15
   -420.53578116
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O   -1.95852494   -1.29642802   -0.06741991    0.00726879    0.00015144    0.00141627
C   -0.75056079    0.71312642    0.09410198    0.00905017    0.01552093    0.00977054
C   -0.82087259   -0.80116285    0.02712280    0.00272629   -0.04236851   -0.00205341
C    0.32266088    1.56980872    0.09414184   -0.02664653   -0.03273927    0.01038925
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C    1.75235834    1.30980958   -0.05854165    0.04146182    0.01452020   -0.00424035
C    1.69988643   -1.25044513    0.05190833   -0.01128875   -0.03230629    0.00273632
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H    2.48212649   -2.03049604    0.08757106    0.01776517    0.00118701    0.00269162
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   15
   -420.53509197
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O   -1.95693242   -1.29347513   -0.06762968    0.01073032    0.00230313    0.00187152
C   -0.75013213    0.70873146    0.09774531    0.00993948    0.00833948    0.01090797
C   -0.82123016   -0.80063202    0.02914166   -0.00105206   -0.04158166   -0.00226359
C    0.32217859    1.57276080    0.09269772   -0.02849857   -0.02867682    0.00999879
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C    1.69980693   -1.25141104    0.05148906   -0.00922482   -0.03558304    0.00352653
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C    2.30983412    0.05595799   -0.06693369   -0.01760558    0.01101306    0.00513392
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   15
   -420.53460793
H   -2.57315597    0.40206620   -0.18637932   -0.01038219   -0.01489303   -0.00865502
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O   -1.95546122   -1.29054818   -0.06786060    0.01375358    0.00424613    0.00225388
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C    0.32212646    1.57614323    0.09110269   -0.02968867   -0.02193993    0.00938806
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C    2.30732225    0.05477201   -0.06485256   -0.01789746    0.00904678    0.00576425
H    3.38650448    0.09047197   -0.29648391    0.00692359    0.00972171   -0.00742021
   15
   -420.53435429
H   -2.57780979    0.40055931   -0.19960347   -0.01238278   -0.01662811   -0.00984360
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O   -1.95414549   -1.28766915   -0.06811699    0.01617628    0.00591975    0.00253905
C   -0.74972550    0.69968006    0.10452070    0.00955508   -0.00721475    0.01305595
C   -0.82183711   -0.79771913    0.03328332   -0.00894659   -0.03635995   -0.00235773
C    0.32252243    1.57985439    0.08936597   -0.03020073   -0.01271758    0.00855887
C    0.35297894   -1.55668034    0.04349302   -0.03391163    0.03983080   -0.00000280
C    1.75761277    1.30806262   -0.06179613    0.05138285    0.01415581   -0.00775617
C    1.70002187   -1.25168638    0.05047958   -0.00331486   -0.04066365    0.00492541
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H    2.44586675    2.11819918   -0.25502732    0.00398527   -0.00864725   -0.00263682
H    2.46987140   -2.01221589    0.05115413    0.00751573    0.01245353    0.00083562
C    2.30507980    0.05344951   -0.06285826   -0.01716164    0.00687752    0.00611444
H    3.37944235    0.10266317   -0.29644277    0.00424259    0.01159905   -0.00714813
   15
   -420.53427441
H   -2.58025789    0.40202051   -0.21106247   -0.01276793   -0.01659624   -0.01054078
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O   -1.95301258   -1.28485699   -0.06840209    0.01786511    0.00728680    0.00270553
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   15
   -420.53433916
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   15
   -420.53446806
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O   -1.95136238   -1.27949110   -0.06906441    0.01877273    0.00892120    0.00264251
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   15
   -420.53465607
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C   -0.75043727    0.68384911    0.11559404    0.00236569   -0.03778744    0.01646615
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   15
   -420.53487846
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O   -1.95055176   -1.27452431   -0.06984463    0.01647680    0.00901183    0.00206554
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C   -0.82017022   -0.78224264    0.04418016   -0.02094936   -0.00630023   -0.00014039
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C    2.29718267    0.04598017   -0.05426403   -0.00791234   -0.00479820    0.00561771
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   15
   -420.53524817
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C   -0.81898269   -0.77844581    0.04640317   -0.02117722    0.00115967    0.00069719
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   15
   -420.53566823
H   -2.56417967    0.45059582   -0.24323264    0.01191611    0.01541814   -0.00346455
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O   -1.95047952   -1.26996114   -0.07071716    0.01174195    0.00769850    0.00111639
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C   -0.81747581   -0.77466637    0.04861555   -0.02073322    0.00851123    0.00161967
C    0.33695926    1.60154651    0.07453236   -0.00817069    0.04407199    0.00106204
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C    2.29506720    0.04325083   -0.05144076   -0.00897758   -0.00911074    0.00596572
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   15
   -420.53613354
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O   -1.95065745   -1.26781477   -0.07117523    0.00880889    0.00664921    0.00056028
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   15
   -420.53657886
H   -2.56555011    0.45804255   -0.24546755    0.01566534    0.02178668   -0.00189620
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C   -0.81353898   -0.76759761    0.05295188   -0.01824232    0.02187808    0.00359549
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   15
   -420.53693149
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   15
   -420.53709436
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O   -1.95164800   -1.26177080   -0.07256115   -0.00062011    0.00272437   -0.00118838
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C   -0.80850617   -0.76183551    0.05707087   -0.01428213    0.03197348    0.00555844
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C    2.29286961    0.03962877   -0.04694076   -0.02226820   -0.01399211    0.00779913
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   15
   -420.53701973
H   -2.58599488    0.44248772   -0.24532252    0.00128829    0.00860926   -0.00659361
O   -2.00402806    1.20522225   -0.02998575   -0.02365848   -0.01342702   -0.00705087
O   -1.95201178   -1.25983850   -0.07300500   -0.00363512    0.00136384   -0.00176703
C   -0.75205075    0.68301362    0.12528318   -0.00483503   -0.05224057    0.02058845
C   -0.80565029   -0.75964329    0.05901169   -0.01191794    0.03538786    0.00647903
C    0.35155310    1.60144969    0.06309453    0.03393629    0.00726538   -0.00301204
C    0.39140638   -1.60721613    0.03522943    0.02342885   -0.02224912   -0.01096850
C    1.71795320    1.29007653   -0.06350791    0.00582950    0.00057481   -0.00782432
C    1.70312774   -1.21864661    0.03579228   -0.00568333    0.03638796    0.01176154
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H    2.36818535   -2.10578951   -0.08314901    0.00143835   -0.01680499   -0.00639626
C    2.29302070    0.03922181   -0.04609392   -0.02540238   -0.01389297    0.00796329
H    3.37395990    0.06080251   -0.22296898    0.00324610    0.00464654   -0.00443337
   15
   -420.53674981
H   -2.59474204    0.43279619   -0.24338230   -0.00552082    0.00210268   -0.00869599
O   -2.00354617    1.20486853   -0.02994997   -0.01786390   -0.00771423   -0.00517525
O   -1.95233449   -1.25792171   -0.07342883   -0.00647546    0.00005515   -0.00233542
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   15
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   15
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   15
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   15
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   15
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   15
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   15
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   15
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   15
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   15
   -420.53144285
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   15
   -420.53127838
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   15
   -420.53144122
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   15
   -420.53191377
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   15
   -420.53266253
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   15
   -420.53354359
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   15
   -420.53450748
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O   -1.96095018   -1.17832575   -0.04272124   -0.01758703    0.00491914   -0.01043427
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   15
   -420.53533379
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O   -1.95731236   -1.18024791   -0.04447534   -0.01456217    0.00628886   -0.01006275
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   15
   -420.53600025
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   15
   -420.53636565
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O   -1.94958270   -1.18432243   -0.04764665   -0.00700120    0.00914288   -0.00906277
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C   -0.77733570   -0.71237191    0.05533309    0.00187323    0.00285106    0.01423500
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   15
   -420.53647132
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C   -0.78190768   -0.70886131    0.05655202   -0.00549108    0.00627907    0.01421948
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   15
   -420.53631771
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O   -1.94154168   -1.18881107   -0.05040761    0.00220838    0.01183513   -0.00783253
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C    0.35384830   -1.58078826    0.01221807    0.00788053    0.00975943   -0.00758164
C    1.72534539    1.23142202    0.02725040    0.01596499   -0.00515635    0.01256037
C    1.69645318   -1.29851113    0.01658046    0.00435428   -0.00697721    0.00915818
H    0.15123875    2.70663161   -0.00361727    0.00121744   -0.00389429    0.00456309
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   15
   -420.53598274
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O   -1.93753206   -1.19124916   -0.05165125    0.00717851    0.01299521   -0.00716523
C   -0.77926183    0.78782916    0.06537003    0.00107264   -0.00211843    0.01546606
C   -0.79069084   -0.70217417    0.05834750   -0.02012640    0.01266418    0.01382105
C    0.34462156    1.64596201   -0.05028948    0.01477109    0.03182483   -0.02240088
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   15
   -420.53552089
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O   -1.93360390   -1.19383453   -0.05281362    0.01218010    0.01398748   -0.00648918
C   -0.77742932    0.78512956    0.06601407    0.00445956   -0.00731750    0.01525347
C   -0.79468119   -0.69909405    0.05893008   -0.02701984    0.01552898    0.01345290
C    0.34498142    1.64773944   -0.04876424    0.01673059    0.03359986   -0.02137234
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C    1.72627531    1.22281110    0.02529406    0.01762280   -0.01823107    0.01069130
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H    0.14925854    2.71560610   -0.02908534    0.00027240   -0.00017792    0.00331945
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H    3.40147375   -0.07136973   -0.04555367   -0.00166660   -0.00642407    0.00045696
   15
   -420.53500966
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O   -1.92981373   -1.19657837   -0.05390237    0.01701114    0.01475262   -0.00581558
C   -0.77566440    0.78254006    0.06642758    0.00798099   -0.01207108    0.01496453
C   -0.79826369   -0.69624843    0.05930936   -0.03333623    0.01814285    0.01300169
C    0.34508875    1.64900999   -0.04691613    0.01833554    0.03443523   -0.02012020
C    0.35329185   -1.58482570    0.01781932    0.00433667    0.00181272   -0.00634907
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H    0.14814966    2.72032883   -0.04277317   -0.00026258    0.00239630    0.00257747
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C    2.31767799   -0.01348331   -0.05272331   -0.00304995    0.02075137   -0.01353847
H    3.40405150   -0.06948476   -0.05070010   -0.00067380   -0.00656031    0.00018436
   15
   -420.53448052
H   -2.57022982    0.28177306   -0.04540271    0.00305129    0.00725807   -0.00073608
O   -2.09108253    1.14888583   -0.00277383   -0.03742928   -0.03820792   -0.00387945
O   -1.92621618   -1.19948931   -0.05492514    0.02145978    0.01524643   -0.00516337
C   -0.77402026    0.78013237    0.06661490    0.01155770   -0.01626582    0.01460755
C   -0.80134321   -0.69367676    0.05949215   -0.03882221    0.02048462    0.01248555
C    0.34491935    1.64976075   -0.04476407    0.01952008    0.03455098   -0.01865043
C    0.35294584   -1.58629235    0.01988726    0.00238705   -0.00256046   -0.00586536
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C    1.70162945   -1.30388981    0.01343207    0.00969491   -0.00792707    0.00747387
H    0.14708662    2.72461875   -0.05692377   -0.00075935    0.00505377    0.00174244
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C    2.31889659   -0.01136119   -0.05228223   -0.00395261    0.02531811   -0.01280188
H    3.40675004   -0.06642131   -0.05587951    0.00035511   -0.00651993   -0.00010243
   15
   -420.53396216
H   -2.58572334    0.29153242   -0.05586646   -0.00018818    0.00496106   -0.00134084
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O   -1.92286151   -1.20257289   -0.05588930    0.02530844    0.01543002   -0.00455629
C   -0.77255079    0.77796984    0.06658145    0.01506205   -0.01981756    0.01417981
C   -0.80383703   -0.69141446    0.05948622   -0.04326269    0.02256189    0.01192753
C    0.34445537    1.64998967   -0.04233028    0.02022356    0.03419453   -0.01697288
C    0.35256407   -1.58771971    0.02204386    0.00017778   -0.00740166   -0.00535872
C    1.72565921    1.21216505    0.02118866    0.01872607   -0.03390406    0.00751131
C    1.70260236   -1.30494788    0.01234378    0.01057430   -0.00845352    0.00686677
H    0.14615788    2.72800196   -0.07138633   -0.00117430    0.00747535    0.00081761
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C    2.32017453   -0.00962077   -0.05164765   -0.00450275    0.02896707   -0.01201398
H    3.40938599   -0.06218685   -0.06104034    0.00129175   -0.00629000   -0.00039820
   15
   -420.53352936
H   -2.60117496    0.30040872   -0.06608789   -0.00396088    0.00196399   -0.00203377
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O   -1.91979318   -1.20583115   -0.05680173    0.02834891    0.01524019   -0.00401298
C   -0.77130884    0.77610606    0.06633369    0.01838767   -0.02264483    0.01367830
C   -0.80567830   -0.68949298    0.05929994   -0.04643527    0.02437688    0.01135654
C    0.34368615    1.64970183   -0.03964009    0.02043799    0.03359550   -0.01512032
C    0.35217979   -1.58903504    0.02428145   -0.00216042   -0.01233433   -0.00483020
C    1.72489251    1.20954705    0.01957142    0.01866448   -0.03698904    0.00644953
C    1.70341569   -1.30587801    0.01115175    0.01119788   -0.00906019    0.00619859
H    0.14543591    2.73004684   -0.08599515   -0.00142020    0.00939358   -0.00016610
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H    2.37860694   -2.16398297    0.00763990    0.00108189   -0.00229404    0.00149169
C    2.32151992   -0.00831699   -0.05083146   -0.00453858    0.03152342   -0.01119348
H    3.41179223   -0.05682284   -0.06612947    0.00203008   -0.00586574   -0.00069562
   15
   -420.53317890
H   -2.61591313    0.30893360   -0.07594284   -0.00777324   -0.00118694   -0.00278351
O   -2.09669815    1.16281258   -0.00008901   -0.03543305   -0.02655792   -0.00191590
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C   -0.77034454    0.77458370    0.06587922    0.02141900   -0.02467297    0.01310230
C   -0.80681918   -0.68793977    0.05894195   -0.04819230    0.02593831    0.01078686
C    0.34260853    1.64890613   -0.03672146    0.02014493    0.03290556   -0.01312974
C    0.35182813   -1.59016438    0.02659204   -0.00445964   -0.01685763   -0.00427265
C    1.72384392    1.20748660    0.01785661    0.01834411   -0.03867523    0.00542460
C    1.70406009   -1.30667113    0.00986605    0.01150415   -0.00968543    0.00547913
H    0.14496704    2.73041065   -0.10057361   -0.00150720    0.01062564   -0.00117085
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H    2.39865987    2.06420104    0.07250740   -0.00177429    0.00214953    0.00365588
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C    2.32293316   -0.00748837   -0.04984605   -0.00395252    0.03286001   -0.01035814
H    3.41383699   -0.05040537   -0.07109346    0.00249129   -0.00525335   -0.00098569
   15
   -420.53300136
H   -2.62925671    0.31766645   -0.08529668   -0.01123979   -0.00396003   -0.00354396
O   -2.09774988    1.16812230    0.00086024   -0.03410975   -0.02238862   -0.00113276
O   -1.91464222   -1.21285848   -0.05849503    0.03146235    0.01362769   -0.00318301
C   -0.76970365    0.77343337    0.06522674    0.02407146   -0.02585938    0.01244933
C   -0.80723327   -0.68677842    0.05842084   -0.04842362    0.02723983    0.01024024
C    0.34122701    1.64761291   -0.03360440    0.01935677    0.03224400   -0.01105393
C    0.35154363   -1.59103993    0.02896717   -0.00654171   -0.02047979   -0.00367219
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C    1.70453097   -1.30731789    0.00849756    0.01146017   -0.01025799    0.00471795
H    0.14476788    2.72887251   -0.11494147   -0.00141418    0.01105444   -0.00215709
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H    2.39881443    2.06099433    0.07216781   -0.00160464    0.00160416    0.00389548
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C    2.32440537   -0.00715502   -0.04870404   -0.00270382    0.03290888   -0.00951976
H    3.41543781   -0.04304461   -0.07588026    0.00264115   -0.00446522   -0.00125904
   15
   -420.53312659
H   -2.64058637    0.32710095   -0.09401397   -0.01399197   -0.00596023   -0.00422844
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O   -1.91259476   -1.21660924   -0.05928531    0.03138235    0.01216762   -0.00290290
C   -0.76942614    0.77267296    0.06438613    0.02627345   -0.02617110    0.01171252
C   -0.80691710   -0.68602859    0.05774488   -0.04709360    0.02826343    0.00972385
C    0.33955337    1.64583209   -0.03032023    0.01812206    0.03166731   -0.00895409
C    0.35135756   -1.59160750    0.03139776   -0.00824065   -0.02274355   -0.00301764
C    1.72092500    1.20511789    0.01419563    0.01681162   -0.03766522    0.00351102
C    1.70482904   -1.30780968    0.00705778    0.01102314   -0.01072280    0.00392524
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H    2.39177195   -2.15321135    0.00654402    0.00156530    0.00051370    0.00187459
C    2.32591766   -0.00731768   -0.04741808   -0.00081237    0.03167412   -0.00868941
H    3.41656762   -0.03488218   -0.08044079    0.00248397   -0.00352380   -0.00150669
   15
   -420.53355646
H   -2.64941161    0.33759395   -0.10197209   -0.01573500   -0.00692136   -0.00478342
O   -2.09870400    1.17946477    0.00278870   -0.03240446   -0.01616891    0.00031304
O   -1.91090233   -1.22049775   -0.06004252    0.03023948    0.01030435   -0.00273638
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C   -0.80589074   -0.68570570    0.05692186   -0.04424799    0.02897825    0.00924161
C    0.33760630    1.64357232   -0.02690067    0.01646582    0.03117777   -0.00687106
C    0.35129547   -1.59183320    0.03387391   -0.00944603   -0.02335452   -0.00229865
C    1.71907788    1.20479451    0.01227838    0.01556278   -0.03509624    0.00262370
C    1.70496095   -1.30813957    0.00555868    0.01017008   -0.01101258    0.00311080
H    0.14507649    2.71994180   -0.14234832   -0.00067571    0.00931523   -0.00391976
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H    2.39563504   -2.14957337    0.00553135    0.00178156    0.00141445    0.00195878
C    2.32744158   -0.00795776   -0.04600073    0.00162691    0.02922570   -0.00787019
H    3.41725402   -0.02608714   -0.08473052    0.00206601   -0.00246005   -0.00172283
   15
   -420.53429038
H   -2.65542281    0.34931754   -0.10907147   -0.01626133   -0.00673496   -0.00515066
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O   -1.90955198   -1.22450293   -0.06076866    0.02810933    0.00812150   -0.00265180
C   -0.77008674    0.77232742    0.06218636    0.02914805   -0.02416843    0.00999063
C   -0.80419707   -0.68582049    0.05595906   -0.03999879    0.02934137    0.00880083
C    0.33541068    1.64084115   -0.02337715    0.01447730    0.03067184   -0.00484357
C    0.35137548   -1.59170785    0.03638472   -0.01010997   -0.02225970   -0.00151541
C    1.71699589    1.20500039    0.01032139    0.01397993   -0.03138489    0.00178210
C    1.70493959   -1.30830321    0.00401256    0.00890350   -0.01108301    0.00228776
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H    2.39917606   -2.14618799    0.00416638    0.00208809    0.00218635    0.00201938
C    2.32894042   -0.00903841   -0.04446437    0.00446804    0.02569423   -0.00706469
H    3.41757123   -0.01685056   -0.08871056    0.00145977   -0.00130256   -0.00190276
   15
   -420.53526030
H   -2.65852455    0.36223568   -0.11524696   -0.01555961   -0.00530548   -0.00526992
O   -2.09817846    1.19155654    0.00470505   -0.03311936   -0.01409271    0.00121108
O   -1.90851972   -1.22859997   -0.06146464    0.02516134    0.00565329   -0.00264180
C   -0.77106827    0.77271211    0.06085322    0.02977185   -0.02191749    0.00901023
C   -0.80190015   -0.68637842    0.05486318   -0.03450774    0.02929791    0.00838632
C    0.33299653    1.63764636   -0.01978030    0.01220419    0.03003812   -0.00289316
C    0.35160771   -1.59124781    0.03891839   -0.01028566   -0.01963854   -0.00068542
C    1.71470293    1.20567973    0.00833742    0.01207671   -0.02677626    0.00097444
C    1.70478409   -1.30829960    0.00243185    0.00725718   -0.01090418    0.00146473
H    0.14583821    2.70447601   -0.16696299    0.00061458    0.00471608   -0.00519301
H    0.00085745   -2.61019374   -0.01467770   -0.00356749    0.00730286   -0.00254119
H    2.40204090    2.04687054    0.06348222   -0.00083155   -0.00227054    0.00442489
H    2.40234004   -2.14319288    0.00243821    0.00247828    0.00276730    0.00205598
C    2.33037148   -0.01050643   -0.04282120    0.00750673    0.02125478   -0.00626611
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   15
   -420.53632432
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O   -1.90777231   -1.23276095   -0.06213060    0.02158409    0.00299390   -0.00268599
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C   -0.79908271   -0.68737880    0.05364046   -0.02799644    0.02881335    0.00798940
C    0.33039809    1.63399780   -0.01613961    0.00973698    0.02907756   -0.00102679
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   15
   -420.53737054
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O   -1.90726934   -1.23695581   -0.06276606    0.01758634    0.00025759   -0.00276087
C   -0.77438087    0.77442773    0.05779441    0.02936021   -0.01527319    0.00684210
C   -0.79584293   -0.68881425    0.05229692   -0.02070178    0.02784434    0.00760519
C    0.32765254    1.62991023   -0.01248330    0.00715622    0.02758026    0.00077215
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C    2.33284769   -0.01432670   -0.03926267    0.01332097    0.01051477   -0.00466390
H    3.41743463    0.01138705   -0.09849806   -0.00039220    0.00236454   -0.00225045
   15
   -420.53824177
H   -2.65268405    0.40460123   -0.12825202   -0.00699672    0.00493114   -0.00414710
O   -2.09451230    1.21094291    0.00747895   -0.03849022   -0.01797762    0.00115070
O   -1.90696568   -1.24115362   -0.06337019    0.01338650   -0.00244899   -0.00284941
C   -0.77670571    0.77565844    0.05610150    0.02833176   -0.01108993    0.00567691
C   -0.79229076   -0.69067008    0.05083839   -0.01288773    0.02637390    0.00722074
C    0.32479883    1.62540658   -0.00883864    0.00453327    0.02532876    0.00253617
C    0.35322185   -1.58833018    0.04653031   -0.00932290   -0.00686351    0.00179406
C    1.70686681    1.20982204    0.00234352    0.00480776   -0.01033300   -0.00127203
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C    2.33380542   -0.01651712   -0.03737157    0.01569980    0.00466369   -0.00384426
H    3.41739398    0.02024280   -0.10097367   -0.00068274    0.00354060   -0.00231352
   15
   -420.53889265
H   -2.64739273    0.41789037   -0.13096934   -0.00302409    0.00901611   -0.00349673
O   -2.09244798    1.21778637    0.00837546   -0.04035133   -0.01984143    0.00091535
O   -1.90681388   -1.24532375   -0.06394200    0.00919458   -0.00504317   -0.00293087
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C   -0.78854407   -0.69292408    0.04927069   -0.00481374    0.02441116    0.00682678
C    0.32187651    1.62052109   -0.00523230    0.00194479    0.02216070    0.00429223
C    0.35404988   -1.58705865    0.04902968   -0.00900761   -0.00257896    0.00250995
C    1.70405766    1.21162862    0.00036928    0.00207308   -0.00485207   -0.00195461
C    1.70338035   -1.30672226   -0.00399113   -0.00154838   -0.00793771   -0.00165528
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H    2.40962717   -2.13671376   -0.00817004    0.00451916    0.00327233    0.00194770
C    2.33452640   -0.01877800   -0.03542237    0.01752746   -0.00121778   -0.00300287
H    3.41747200    0.02846201   -0.10303320   -0.00070659    0.00465032   -0.00236693
   15
   -420.53941248
H   -2.64155124    0.42956627   -0.13305680    0.00056113    0.01242726   -0.00288321
O   -2.08992668    1.22485418    0.00926146   -0.04139931   -0.02091423    0.00078432
O   -1.90676654   -1.24943687   -0.06448059    0.00519014   -0.00743751   -0.00298770
C   -0.78261488    0.77855233    0.05247638    0.02466759   -0.00166931    0.00326982
C   -0.78472461   -0.69554660    0.04759979    0.00326127    0.02198298    0.00641843
C    0.31892465    1.61530177   -0.00169089   -0.00053757    0.01800770    0.00607383
C    0.35501432   -1.58574732    0.05149120   -0.00888264    0.00104936    0.00313547
C    1.70121717    1.21350901   -0.00157546   -0.00066040    0.00027746   -0.00258821
C    1.70300060   -1.30599338   -0.00556294   -0.00377172   -0.00688112   -0.00235981
H    0.14356366    2.65969866   -0.21097947    0.00352720   -0.00644601   -0.00709127
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H    2.40805977    2.03889856    0.03492621    0.00276094   -0.00470796    0.00415640
H    2.40964767   -2.13658171   -0.01172170    0.00491698    0.00304947    0.00185539
C    2.33498306   -0.02102063   -0.03342775    0.01872994   -0.00693664   -0.00214903
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   15
   -420.53982185
H   -2.63579832    0.43902637   -0.13462108    0.00325468    0.01440323   -0.00250558
O   -2.08693703    1.23215794    0.01013837   -0.04108242   -0.02055738    0.00087925
O   -1.90677838   -1.25346587   -0.06498532    0.00153243   -0.00957001   -0.00300830
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C    0.31598074    1.60981129    0.00175864   -0.00286925    0.01294100    0.00788429
C    0.35611335   -1.58445076    0.05390544   -0.00898859    0.00377831    0.00365872
C    1.69838653    1.21538574   -0.00348115   -0.00327286    0.00494638   -0.00315714
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H    0.14152443    2.65302839   -0.21622419    0.00364831   -0.00662670   -0.00761015
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H    2.40878511   -2.13699803   -0.01560701    0.00515659    0.00277018    0.00173688
C    2.33515729   -0.02315884   -0.03140070    0.01930294   -0.01230626   -0.00126446
H    3.41795274    0.04220926   -0.10586726    0.00001323    0.00655358   -0.00244222
   15
   -420.54017868
H   -2.63061224    0.44592102   -0.13572904    0.00465616    0.01447717   -0.00246445
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O   -1.90680804   -1.25738659   -0.06545597   -0.00164892   -0.01140947   -0.00298603
C   -0.79000542    0.78154486    0.04865330    0.01888509    0.00818575    0.00090228
C   -0.77735098   -0.70174461    0.04397343    0.01846630    0.01600802    0.00553792
C    0.31307998    1.60412601    0.00508896   -0.00501444    0.00716370    0.00969638
C    0.35734861   -1.58321011    0.05626449   -0.00932272    0.00548225    0.00407800
C    1.69560509    1.21718835   -0.00533920   -0.00564839    0.00906614   -0.00364952
C    1.70244190   -1.30423912   -0.00858959   -0.00751487   -0.00487523   -0.00365337
H    0.13883128    2.64753916   -0.22009762    0.00357505   -0.00598304   -0.00822211
H    0.01191457   -2.62966647    0.01020363   -0.00746105   -0.00842229   -0.00303202
H    2.40809735    2.04132834    0.01815425    0.00488134   -0.00392441    0.00372131
H    2.40699692   -2.13791289   -0.01980465    0.00519853    0.00247006    0.00159353
C    2.33504038   -0.02511160   -0.02935455    0.01928784   -0.01718528   -0.00037774
H    3.41822829    0.04739597   -0.10662795    0.00063821    0.00729111   -0.00246565
   15
   -420.54050006
H   -2.62624408    0.45023836   -0.13638795    0.00467253    0.01256412   -0.00279047
O   -2.07958789    1.24743428    0.01185639   -0.03515098   -0.01411382    0.00211359
O   -1.90681951   -1.26117811   -0.06589279   -0.00426252   -0.01294150   -0.00291882
C   -0.79415190    0.78289279    0.04671237    0.01519226    0.01290086   -0.00021593
C   -0.77402628   -0.70522990    0.04203128    0.02520399    0.01262504    0.00506549
C    0.31025478    1.59833289    0.00827274   -0.00694681    0.00099953    0.01145795
C    0.35872503   -1.58205099    0.05856199   -0.00983273    0.00608832    0.00439878
C    1.69290863    1.21885458   -0.00714217   -0.00767503    0.01260956   -0.00405085
C    1.70231935   -1.30324392   -0.01002487   -0.00888973   -0.00404456   -0.00423776
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H    2.40689412    2.04364401    0.00874255    0.00582194   -0.00329980    0.00341812
H    2.40427627   -2.13927267   -0.02428882    0.00502312    0.00218787    0.00142562
C    2.33463247   -0.02680527   -0.02730270    0.01877095   -0.02144665    0.00051017
H    3.41838815    0.05127276   -0.10694495    0.00131369    0.00784758   -0.00247377
   15
   -420.54073537
H   -2.62270142    0.45231878   -0.13653981    0.00356695    0.00898697   -0.00341962
O   -2.07529552    1.25533408    0.01268355   -0.02972531   -0.00834298    0.00319953
O   -1.90678319   -1.26482315   -0.06629653   -0.00625488   -0.01413772   -0.00280773
C   -0.79852740    0.78404602    0.04477462    0.01095568    0.01730587   -0.00126425
C   -0.77108171   -0.70890590    0.04001257    0.03114133    0.00911851    0.00456894
C    0.30753432    1.59252464    0.01128344   -0.00863426   -0.00516573    0.01309513
C    0.36025025   -1.58098265    0.06079310   -0.01044966    0.00565375    0.00463532
C    1.69032766    1.22033093   -0.00888403   -0.00925062    0.01555365   -0.00435207
C    1.70233071   -1.30218733   -0.01139613   -0.00986435   -0.00339000   -0.00477912
H    0.13156495    2.63953662   -0.22328198    0.00295743   -0.00302751   -0.00955177
H    0.02681495   -2.62527248    0.02230387   -0.00540249   -0.00507250   -0.00255016
H    2.40464486    2.04655392   -0.00128366    0.00656993   -0.00263108    0.00305778
H    2.40065567   -2.14102666   -0.02902942    0.00459636    0.00193090    0.00123681
C    2.33394128   -0.02817555   -0.02525855    0.01785041   -0.02499233    0.00138307
H    3.41831247    0.05373941   -0.10681705    0.00193167    0.00820424   -0.00246011
   15
   -420.54087180
H   -2.61979060    0.45279532   -0.13607368    0.00175129    0.00444258   -0.00420621
O   -2.07066694    1.26332765    0.01347430   -0.02323560   -0.00163317    0.00443285
O   -1.90667650   -1.26830811   -0.06666846   -0.00759915   -0.01500594   -0.00265397
C   -0.80306788    0.78493812    0.04285588    0.00617045    0.02128538   -0.00223165
C   -0.76860687   -0.71271974    0.03792480    0.03616195    0.00558730    0.00404989
C    0.30494407    1.58679403    0.01409639   -0.01004717   -0.01094610    0.01452518
C    0.36193348   -1.57999874    0.06295420   -0.01107101    0.00435553    0.00480481
C    1.68788593    1.22157282   -0.01056021   -0.01031226    0.01790965   -0.00454997
C    1.70249071   -1.30107926   -0.01269518   -0.01043854   -0.00292029   -0.00527956
H    0.12710180    2.63649910   -0.22235537    0.00249348   -0.00125833   -0.01013655
H    0.03582630   -2.62152878    0.02906588   -0.00392787   -0.00210757   -0.00224444
H    2.40121649    2.04993782   -0.01185957    0.00705691   -0.00197830    0.00264300
H    2.39621191   -2.14312876   -0.03399233    0.00391876    0.00169915    0.00102592
C    2.33298055   -0.02916890   -0.02323530    0.01663877   -0.02776341    0.00223261
H    3.41789107    0.05473263   -0.10624689    0.00240658    0.00832177   -0.00241708
   15
   -420.54083966
H   -2.61719299    0.45247599   -0.13485034   -0.00020973   -0.00038085   -0.00499723
O   -2.06577525    1.27133958    0.01421479   -0.01623369    0.00524395    0.00564287
O   -1.90648421   -1.27162317   -0.06701033   -0.00829131   -0.01553902   -0.00246553
C   -0.80770099    0.78550901    0.04097077    0.00083541    0.02475221   -0.00310878
C   -0.76667757   -0.71661815    0.03577583    0.04017571    0.00213004    0.00351090
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C    0.36378391   -1.57907997    0.06504272   -0.01154948    0.00247571    0.00492715
C    1.68559946    1.22254463   -0.01216772   -0.01083352    0.01969061   -0.00464337
C    1.70280805   -1.29992682   -0.01391445   -0.01062796   -0.00262421   -0.00573230
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H    0.04554249   -2.61741202    0.03623180   -0.00230008    0.00129531   -0.00192701
H    2.39652224    2.05367906   -0.02291059    0.00722487   -0.00139310    0.00218021
H    2.39106514   -2.14553740   -0.03913966    0.00305618    0.00148687    0.00079657
C    2.33176849   -0.02974346   -0.02124576    0.01523132   -0.02971625    0.00304872
H    3.41703968    0.05423121   -0.10524208    0.00265454    0.00819805   -0.00233990
   15
   -420.54065579
H   -2.61456227    0.45222029   -0.13272937   -0.00185468   -0.00487012   -0.00565018
O   -2.06069943    1.27929247    0.01489142   -0.00921150    0.01164562    0.00668985
O   -1.90619844   -1.27476227   -0.06732424   -0.00834910   -0.01573071   -0.00225326
C   -0.81234610    0.78570636    0.03913255   -0.00501636    0.02763893   -0.00388630
C   -0.76535441   -0.72054896    0.03357379    0.04312201   -0.00117713    0.00295155
C    0.30023503    1.57590246    0.01904699   -0.01194512   -0.02001296    0.01650652
C    0.36580862   -1.57819841    0.06705677   -0.01174578    0.00041388    0.00502264
C    1.68347613    1.22321938   -0.01370516   -0.01081770    0.02090962   -0.00463509
C    1.70328565   -1.29873453   -0.01504709   -0.01046941   -0.00247847   -0.00614136
H    0.11692294    2.63082460   -0.21495631    0.00145370    0.00157958   -0.01081222
H    0.05567271   -2.61352876    0.04374471   -0.00066911    0.00471133   -0.00161659
H    2.39053199    2.05767310   -0.03435355    0.00705828   -0.00091032    0.00167813
H    2.38537001   -2.14821423   -0.04443003    0.00204023    0.00127522    0.00054600
C    2.33032630   -0.02986973   -0.01930227    0.01369614   -0.03083640    0.00382548
H    3.41571402    0.05225752   -0.10381657    0.00264177    0.00782675   -0.00222603
   15
   -420.54038938
H   -2.61160675    0.45283027   -0.12959440   -0.00286589   -0.00860068   -0.00607569
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   15
   -420.54011751
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C   -0.76468796   -0.72831123    0.02904473    0.04569444   -0.00710280    0.00176588
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   15
   -420.53991852
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   15
   -420.53980661
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   15
   -420.53977791
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   15
   -420.53974410
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   15
   -420.53968796
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   15
   -420.53955959
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   15
   -420.53938209
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   15
   -420.53915122
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C   -0.78707107   -0.75259970    0.01065853    0.01519461   -0.01899963   -0.00364679
C    0.28696622    1.54066408    0.02937920   -0.00485127   -0.00945729    0.00925289
C    0.39232645   -1.56996090    0.08293094    0.01137925    0.01599323    0.00451551
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C    2.30917970   -0.00839069   -0.00467935   -0.00972702   -0.00496263    0.00951986
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   15
   -420.53894710
H   -2.59364091    0.56324794   -0.04765569    0.01814231    0.00160440   -0.00043992
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C   -0.79178395   -0.75448560    0.00849876    0.00819804   -0.01909429   -0.00429170
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C    1.66709859    1.21217441   -0.02690808    0.00328659   -0.00471072    0.00023578
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C    2.30716429   -0.00485583   -0.00388723   -0.01295504   -0.00026887    0.00988349
H    3.39180707   -0.02230059   -0.06983206   -0.00148434   -0.00598302    0.00020608
   15
   -420.53891070
H   -2.60251269    0.57962040   -0.03693378    0.01768519    0.00221899   -0.00012604
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O   -1.90121503   -1.30181173   -0.06988850    0.02577771    0.00511203    0.00068753
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C   -0.79662071   -0.75608328    0.00640383    0.00109932   -0.01879901   -0.00488803
C    0.28574526    1.53644932    0.02920040   -0.00273283   -0.00774771    0.00650265
C    0.39704096   -1.56992459    0.08522054    0.01615408    0.01638892    0.00427737
C    1.66569554    1.21042370   -0.02794893    0.00393637   -0.00954627    0.00090407
C    1.71769865   -1.28196511   -0.02032849    0.00220004    0.00000868   -0.00778878
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H    0.14973448   -2.64336229    0.14145926    0.00229535   -0.00988813    0.00252456
H    2.27043850    2.10577017   -0.16629634   -0.00567167    0.00329718   -0.00520644
H    2.34152938   -2.17269144   -0.09994192   -0.00673567   -0.00615212   -0.00336170
C    2.30534453   -0.00131682   -0.00324447   -0.01600807    0.00435340    0.01018985
H    3.39094573   -0.02777339   -0.06615095   -0.00102256   -0.00723461    0.00040998
   15
   -420.53891092
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O   -2.00309242    1.36154558    0.01672023    0.01372931    0.01603005    0.00098668
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   15
   -420.53897678
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C   -0.80623985   -0.75843866    0.00244348   -0.01237219   -0.01684706   -0.00586778
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   15
   -420.53895325
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O   -1.90366285   -1.30807054   -0.07051644    0.03461948    0.01026106    0.00107310
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   15
   -420.53886291
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   15
   -420.53863266
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O   -1.90719550   -1.31278910   -0.07099320    0.03631214    0.01126473    0.00105145
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   15
   -420.53829934
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C   -0.82264165   -0.76037045   -0.00438330   -0.02906643   -0.00649437   -0.00658051
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   15
   -420.53798501
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O   -1.91235952   -1.31801002   -0.07151681    0.03373523    0.00994421    0.00078945
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C   -0.82576120   -0.76049063   -0.00584397   -0.03012296   -0.00260864   -0.00646579
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C    1.65419852    1.20544309   -0.03607097    0.00008999   -0.02681281    0.00345107
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C    2.30100958    0.01849875   -0.00319424   -0.02088108    0.02120755    0.01064453
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   15
   -420.53770780
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   15
   -420.53747876
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C   -0.83064217   -0.76067811   -0.00847576   -0.02846071    0.00611140   -0.00592416
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C    1.65065973    1.20739837   -0.03881511   -0.00425124   -0.02413660    0.00318960
C    1.72753150   -1.26822396   -0.01332329    0.00669540   -0.00108735   -0.00735701
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   15
   -420.53724928
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O   -1.92286205   -1.32662767   -0.07236168    0.02282038    0.00420702    0.00002663
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   15
   -420.53692646
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C    0.28161652    1.52313482    0.02615809   -0.00787369   -0.00490726   -0.00815680
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C    1.64738481    1.21080301   -0.04175033   -0.00992403   -0.01935242    0.00257079
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C    2.30539607    0.02350993   -0.00670311   -0.01062044    0.01241552    0.01021947
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   15
   -420.53642834
H   -2.75789707    0.81658950    0.08310231   -0.00631108    0.00902324    0.00161818
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O   -1.93122771   -1.33264821   -0.07293136    0.01278171   -0.00104370   -0.00061348
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C   -0.83487395   -0.76182304   -0.01177034   -0.01880666    0.01914780   -0.00454645
C    0.28165365    1.52270987    0.02630254   -0.00885520   -0.00282418   -0.00853224
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C    1.64595036    1.21296323   -0.04327876   -0.01310566   -0.01661122    0.00215711
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H    2.43604153   -2.09065988   -0.07571020    0.00232978    0.00121056   -0.00452858
C    2.30699906    0.02418519   -0.00797073   -0.00791692    0.00877251    0.01011756
H    3.39074446    0.03344600   -0.03723599   -0.00264327   -0.00420017    0.00195516
   15
   -420.53567883
H   -2.76068622    0.83834497    0.09132511   -0.00188202    0.01378798    0.00119686
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   15
   -420.53483020
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   15
   -420.53397249
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   15
   -420.53327268
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   15
   -420.53280684
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   15
   -420.53254209
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   15
   -420.53243863
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   15
   -420.53248392
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   15
   -420.53266062
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   15
   -420.53300868
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   15
   -420.53350498
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   15
   -420.53415318
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   15
   -420.53490288
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O   -1.98226595   -1.36224624   -0.07484326   -0.02193242   -0.01492424   -0.00294922
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C   -0.84529425   -0.80376337   -0.02145757    0.02015052    0.00462381    0.00029921
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   15
   -420.53565571
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   15
   -420.53628867
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   15
   -420.53675798
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O   -1.98902186   -1.36509258   -0.07455867   -0.01688646   -0.01116434   -0.00270568
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C    1.67008286    1.25919460   -0.06441113   -0.00657385    0.00426258   -0.01261286
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   15
   -420.53697381
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O   -1.99086080   -1.36576741   -0.07440092   -0.01432432   -0.00965060   -0.00258170
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C   -0.85583649   -0.82431756   -0.02418224    0.01430875   -0.01586771    0.00030793
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C    0.37237939   -1.58981357    0.08178376   -0.01424706   -0.00339398    0.00607115
C    1.67422087    1.26176186   -0.06477491   -0.00265218    0.00303807   -0.01343716
C    1.73019746   -1.23825769    0.03273463    0.01387213   -0.00206176   -0.00364454
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C    2.33204659    0.04987440   -0.05058728    0.00810442    0.00053296    0.00286184
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   15
   -420.53695537
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C    1.67839929    1.26428359   -0.06493564    0.00099059    0.00149547   -0.01416681
C    1.72925453   -1.23670056    0.03592144    0.01473018   -0.00203589   -0.00310059
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C    2.33250187    0.05269462   -0.05398647    0.00601815    0.00429365    0.00180394
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   15
   -420.53674773
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O   -1.99408485   -1.36680654   -0.07399920   -0.00828527   -0.00652750   -0.00229133
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C   -0.86251498   -0.83346602   -0.02557389    0.00738143   -0.02464303    0.00008254
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C    1.68256313    1.26678292   -0.06488228    0.00427528   -0.00023643   -0.01479337
C    1.72808902   -1.23511266    0.03915510    0.01548146   -0.00205178   -0.00250259
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H    2.42129185   -2.07431766    0.14586001    0.00219301   -0.00232085    0.00272529
C    2.33286679    0.05544994   -0.05741286    0.00344164    0.00806209    0.00068746
H    3.41512389    0.13265690   -0.07007379   -0.00227886    0.00739429    0.00037070
   15
   -420.53636730
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O   -1.99553831   -1.36720616   -0.07375851   -0.00499339   -0.00504768   -0.00213942
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C    1.68666283    1.26928584   -0.06460539    0.00714029   -0.00199265   -0.01529472
C    1.72668960   -1.23349354    0.04242653    0.01613263   -0.00218704   -0.00184887
H    0.00081128    2.55511092    0.16123802   -0.00264633   -0.00487104    0.00116699
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H    2.41036923   -2.08042060    0.15774731    0.00121796   -0.00383180    0.00320128
C    2.33318000    0.05808352   -0.06084958    0.00059439    0.01172952   -0.00047975
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   15
   -420.53583807
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O   -1.99693516   -1.36754838   -0.07349356   -0.00168037   -0.00370964   -0.00198721
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C    0.30389039    1.52082991    0.05526965   -0.00131332    0.01047477    0.00860826
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C    1.69065509    1.27181867   -0.06409742    0.00955699   -0.00357760   -0.01564798
C    1.72504647   -1.23184106    0.04572577    0.01666897   -0.00250434   -0.00111274
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H    2.39923100   -2.08583644    0.16905958    0.00006503   -0.00511161    0.00362829
C    2.33348424    0.06054005   -0.06427899   -0.00228408    0.01517082   -0.00168555
H    3.42144443    0.10821247   -0.07624322    0.00062013    0.00464975    0.00036313
   15
   -420.53521313
H   -2.63427239    0.75053300    0.16588815    0.00601639   -0.00375386    0.00507634
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O   -1.99831281   -1.36784833   -0.07320606    0.00148901   -0.00254832   -0.00183934
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C    1.69450341    1.27440516   -0.06335305    0.01150736   -0.00480002   -0.01583348
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H    2.38808313   -2.09033695    0.17972034   -0.00120641   -0.00605228    0.00397375
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   15
   -420.53457951
H   -2.62845340    0.73232632    0.16220659    0.00328182   -0.00809920    0.00572895
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O   -1.99970712   -1.36811908   -0.07289770    0.00437425   -0.00164842   -0.00169559
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C    1.69817831    1.27706355   -0.06236951    0.01298734   -0.00547293   -0.01582579
C    1.72099803   -1.22841400    0.05236274    0.01740198   -0.00372669    0.00052418
H    0.00349993    2.56015167    0.12064304   -0.00299759   -0.00334473   -0.00114347
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C    2.33423507    0.06471946   -0.07104258   -0.00708122    0.02091464   -0.00417680
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   15
   -420.53397385
H   -2.62323417    0.71556660    0.15749696    0.00115579   -0.01171898    0.00614310
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O   -2.00115066   -1.36837083   -0.07257009    0.00681018   -0.00105172   -0.00155780
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C   -0.87992803   -0.84898508   -0.02903270   -0.01610053   -0.03754471   -0.00067836
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C    1.71858176   -1.22662097    0.05567564    0.01751147   -0.00462456    0.00143569
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H    2.36669821   -2.09597239    0.19884946   -0.00406052   -0.00690961    0.00443201
C    2.33475362    0.06635579   -0.07433911   -0.00854188    0.02297203   -0.00544167
H    3.42944927    0.06599731   -0.08600608    0.00443146   -0.00005228    0.00047191
   15
   -420.53350754
H   -2.61823620    0.70090124    0.15168539   -0.00006948   -0.01427718    0.00627590
O   -1.91139496    1.40203121    0.02668112    0.05156699    0.02979115   -0.00572481
O   -2.00267090   -1.36861034   -0.07222481    0.00863698   -0.00078613   -0.00142470
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C   -0.88297037   -0.85049927   -0.02970259   -0.02035324   -0.03823686   -0.00079025
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C    0.37066096   -1.59313776    0.06741870    0.00093538    0.00412478    0.00286401
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   15
   -420.53323195
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   15
   -420.53320140
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   15
   -420.53338669
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O   -2.00785541   -1.36926436   -0.07109768    0.00940695   -0.00227520   -0.00105769
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   15
   -420.53374172
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O   -2.00980114   -1.36944209   -0.07069617    0.00795986   -0.00355373   -0.00094748
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C   -0.89158844   -0.85083554   -0.03225266   -0.02957833   -0.03415724   -0.00093925
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C    1.71581142    1.29431303   -0.05168390    0.01259812    0.00575123   -0.01118665
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   15
   -420.53420857
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O   -2.01183646   -1.36957916   -0.07028391    0.00572633   -0.00519351   -0.00084095
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C    1.71802386    1.29713771   -0.04921496    0.01111879    0.00947412   -0.00972062
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   15
   -420.53474393
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O   -2.01393611   -1.36965706   -0.06986210    0.00281358   -0.00713179   -0.00074166
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C   -0.89332710   -0.84782113   -0.03344366   -0.02864184   -0.02846553   -0.00085890
C    0.31966317    1.51601023    0.06243797   -0.01154372   -0.01293792    0.01550392
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C    1.69476525   -1.21126640    0.07743807    0.00790023   -0.00950051    0.00788657
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C    2.34155645    0.06773966   -0.09406026    0.00378069    0.01722588   -0.01373024
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   15
   -420.53529147
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C    1.69062203   -1.20853860    0.08017387    0.00457023   -0.00896261    0.00856605
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C    2.34265081    0.06665124   -0.09618269    0.00709453    0.01402895   -0.01469922
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   15
   -420.53581127
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O   -2.01819086   -1.36954444   -0.06899431   -0.00442806   -0.01171666   -0.00055384
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C    2.34363834    0.06535097   -0.09808299    0.01004346    0.01059237   -0.01557637
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   15
   -420.53631374
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O   -1.93271633    1.36907564    0.03745320   -0.00034559    0.01237753    0.00148513
O   -2.02026410   -1.36930213   -0.06855047   -0.00842076   -0.01418823   -0.00045631
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C    1.72549863    1.30646193   -0.03812404    0.00198713    0.02225849   -0.00262075
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   15
   -420.53676930
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O   -2.02224181   -1.36889888   -0.06810146   -0.01243659   -0.01666797   -0.00035089
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C    0.36588720   -1.59708727    0.04599470    0.01794901   -0.00437316   -0.00321301
C    1.72719617    1.30805749   -0.03518169   -0.00080940    0.02402753   -0.00062878
C    1.67800812   -1.19960761    0.08757019   -0.00710489   -0.00511241    0.01012534
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H    2.33864253   -2.05280069    0.24764734   -0.00464211   -0.00350301    0.00375233
C    2.34512457    0.06232388   -0.10116592    0.01400247    0.00350810   -0.01697806
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   15
   -420.53710909
H   -2.61911376    0.66091878    0.03280192    0.00885584    0.00494597    0.00112743
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O   -2.02407856   -1.36830662   -0.06764847   -0.01632085   -0.01907964   -0.00023272
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C   -0.89070902   -0.83377210   -0.03620975   -0.01551397   -0.00860617   -0.00059481
C    0.33289787    1.51813212    0.05777503   -0.01404362   -0.01123302    0.01291812
C    0.36428754   -1.59675024    0.04390987    0.01859433   -0.00100316   -0.00429823
C    1.72890596    1.30929064   -0.03222991   -0.00361683    0.02507457    0.00142506
C    1.67393772   -1.19644597    0.08973908   -0.01096376   -0.00331672    0.01053559
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H    2.32450997    2.21976408   -0.01759837   -0.00313518    0.00304946    0.00330754
H    2.34441192   -2.04442208    0.24768711   -0.00280390   -0.00332390    0.00361174
C    2.34556369    0.06070392   -0.10232740    0.01480960    0.00008620   -0.01747587
H    3.42255542   -0.04550724   -0.13671032   -0.00368189   -0.00787979    0.00104034
   15
   -420.53729615
H   -2.63088330    0.65721681    0.01947070    0.00368000    0.00270743    0.00077307
O   -1.94284945    1.35427956    0.04107005   -0.00789725    0.01473143    0.00259376
O   -2.02573042   -1.36749809   -0.06719287   -0.01994902   -0.02133312   -0.00009787
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C   -0.88929504   -0.83031954   -0.03673318   -0.01215386   -0.00442317   -0.00056996
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C    0.36240737   -1.59639748    0.04189003    0.01871505    0.00189982   -0.00537948
C    1.73067030    1.31014551   -0.02929973   -0.00630262    0.02542642    0.00352805
C    1.67003264   -1.19323434    0.09174873   -0.01447500   -0.00141303    0.01093021
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H    2.33122886    2.21952775   -0.03056543   -0.00203173    0.00378642    0.00248097
H    2.35068580   -2.03544792    0.24707775   -0.00096860   -0.00295847    0.00342971
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H    3.42449411   -0.04610239   -0.14216488   -0.00230592   -0.00749500    0.00090844
   15
   -420.53731389
H   -2.64330869    0.65303320    0.00600275   -0.00195918    0.00006476    0.00025713
O   -1.94606973    1.34903646    0.04222250   -0.00796087    0.01683228    0.00307286
O   -2.02715631   -1.36644778   -0.06673617   -0.02321817   -0.02335809    0.00005462
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C   -0.88769728   -0.82679995   -0.03724797   -0.00881125   -0.00036562   -0.00055926
C    0.33965859    1.52025502    0.05447011   -0.01103044   -0.00969231    0.01097170
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C    1.73252959    1.31061670   -0.02642293   -0.00871243    0.02516219    0.00565789
C    1.66634579   -1.19000140    0.09359313   -0.01745673    0.00053247    0.01131767
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H    2.35713640   -2.02594438    0.24585164    0.00075051   -0.00234377    0.00319520
C    2.34577186    0.05750817   -0.10385302    0.01430826   -0.00613301   -0.01801283
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   15
   -420.53716960
H   -2.65538568    0.64883601   -0.00750917   -0.00731373   -0.00238613   -0.00040030
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O   -2.02831924   -1.36513273   -0.06628011   -0.02605162   -0.02509771    0.00022906
C   -0.73808034    0.68773188   -0.00439996    0.04033322    0.01142030   -0.00618202
C   -0.88596614   -0.82327459   -0.03775430   -0.00557301    0.00349429   -0.00056050
C    0.34330216    1.52154174    0.05256129   -0.00839447   -0.00939408    0.00990221
C    0.35780761   -1.59580618    0.03810978    0.01711214    0.00498202   -0.00736828
C    1.73452010    1.31070804   -0.02363167   -0.01070153    0.02439726    0.00778310
C    1.66292205   -1.18677648    0.09526639   -0.01975416    0.00246145    0.01171319
H    0.06974154    2.56376485    0.00132507    0.00540515   -0.00673592   -0.00560435
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H    2.34555396    2.21687377   -0.05767780    0.00024225    0.00520609    0.00066440
H    2.36345488   -2.01602335    0.24405099    0.00227455   -0.00142285    0.00290293
C    2.34554810    0.05602627   -0.10420900    0.01330682   -0.00882621   -0.01805147
H    3.42928861   -0.04333620   -0.15352439    0.00133957   -0.00641110    0.00045728
   15
   -420.53695635
H   -2.66615969    0.64505815   -0.02094768   -0.01175667   -0.00413161   -0.00113361
O   -1.95224138    1.33795861    0.04441656   -0.00795197    0.01958084    0.00416234
O   -2.02918711   -1.36353326   -0.06582667   -0.02838533   -0.02651266    0.00042009
C   -0.73447284    0.68564247   -0.00362601    0.04327984    0.00875534   -0.00585784
C   -0.88415054   -0.81980174   -0.03825214   -0.00249118    0.00709529   -0.00057417
C    0.34707179    1.52297090    0.05050282   -0.00507166   -0.00942245    0.00878166
C    0.35511230   -1.59561380    0.03637936    0.01535363    0.00477882   -0.00820707
C    1.73667173    1.31043098   -0.02095802   -0.01212849    0.02323943    0.00986614
C    1.65979603   -1.18358872    0.09676254   -0.02126596    0.00434625    0.01211565
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H    0.22532306   -2.68559170    0.14583735    0.00536532   -0.01047329    0.00123398
H    2.35275368    2.21420420   -0.07149633    0.00121843    0.00564547   -0.00029719
H    2.36936767   -2.00585077    0.24172860    0.00352759   -0.00019904    0.00255352
C    2.34512345    0.05467741   -0.10429222    0.01206140   -0.01118902   -0.01794636
H    3.43149489   -0.04017038   -0.15934918    0.00315216   -0.00568816    0.00016988
   15
   -420.53675867
H   -2.67483706    0.64200920   -0.03418178   -0.01486242   -0.00488209   -0.00186222
O   -1.95519199    1.33209337    0.04544593   -0.00880331    0.01948536    0.00464590
O   -2.02973349   -1.36163339   -0.06537801   -0.03018246   -0.02756161    0.00062883
C   -0.73151816    0.68342122   -0.00276358    0.04494968    0.00563664   -0.00546805
C   -0.88229700   -0.81643577   -0.03874128    0.00036352    0.01037614   -0.00059733
C    0.35091710    1.52454280    0.04831163   -0.00108005   -0.00966753    0.00760938
C    0.35218561   -1.59549221    0.03477287    0.01297179    0.00336215   -0.00891347
C    1.73900590    1.30980299   -0.01843347   -0.01287268    0.02175634    0.01186940
C    1.65699050   -1.18046659    0.09807552   -0.02193288    0.00617131    0.01251517
H    0.07046509    2.56913563    0.00492191    0.00436824   -0.00409623   -0.00494892
H    0.22115112   -2.68329686    0.14845870    0.00522452   -0.00955518    0.00145651
H    2.35973764    2.21052251   -0.08526164    0.00196692    0.00577842   -0.00124199
H    2.37465007   -1.99564638    0.23894728    0.00446178    0.00129515    0.00215720
C    2.34451649    0.05349728   -0.10410427    0.01076170   -0.01317699   -0.01770909
H    3.43313791   -0.03598215   -0.16520423    0.00467036   -0.00484499   -0.00014110
   15
   -420.53660767
H   -2.68086199    0.63982265   -0.04708237   -0.01637685   -0.00449729   -0.00247894
O   -1.95804191    1.32600820    0.04642274   -0.01056575    0.01818736    0.00497712
O   -2.02993802   -1.35942121   -0.06493649   -0.03141184   -0.02823024    0.00085222
C   -0.72924161    0.68111526   -0.00181855    0.04538010    0.00210813   -0.00502071
C   -0.88044861   -0.81322623   -0.03922139    0.00293812    0.01327976   -0.00063070
C    0.35477830    1.52626086    0.04600550    0.00331829   -0.00992058    0.00637556
C    0.34906348   -1.59542011    0.03330099    0.01002691    0.00083397   -0.00947681
C    1.74153377    1.30884632   -0.01608821   -0.01283393    0.02004202    0.01373816
C    1.65451561   -1.17743768    0.09919927   -0.02178778    0.00793110    0.01291394
H    0.06959651    2.57306841    0.00808697    0.00344926   -0.00195846   -0.00454535
H    0.21603834   -2.67929713    0.15081994    0.00510254   -0.00757259    0.00154819
H    2.36637148    2.20580574   -0.09880326    0.00245045    0.00553764   -0.00216083
H    2.37913425   -1.98567838    0.23577818    0.00504873    0.00299686    0.00172658
C    2.34374672    0.05251589   -0.10364870    0.00954645   -0.01476154   -0.01735729
H    3.43394669   -0.03092300   -0.17103383    0.00572927   -0.00391222   -0.00045512
   15
   -420.53652784
H   -2.68396286    0.63842903   -0.05953922   -0.01621638   -0.00295751   -0.00291821
O   -1.96077108    1.31971784    0.04734329   -0.01331695    0.01567730    0.00508524
O   -2.02978677   -1.35688917   -0.06450465   -0.03205141   -0.02851278    0.00108509
C   -0.72764979    0.67877781   -0.00079766    0.04465661   -0.00174582   -0.00452537
C   -0.87864425   -0.81021695   -0.03969194    0.00518454    0.01575281   -0.00067384
C    0.35858906    1.52812866    0.04360305    0.00795692   -0.00996589    0.00507552
C    0.34579029   -1.59535952    0.03197223    0.00663478   -0.00259852   -0.00989198
C    1.74425471    1.30758678   -0.01395045   -0.01196361    0.01814840    0.01543573
C    1.65236921   -1.17452865    0.10012781   -0.02088595    0.00966354    0.01328388
H    0.06810941    2.57735156    0.01206941    0.00237797    0.00035857   -0.00407982
H    0.21000652   -2.67394692    0.15290446    0.00501033   -0.00470530    0.00151507
H    2.37256947    2.20009777   -0.11195668    0.00261261    0.00489709   -0.00301707
H    2.38271411   -1.97625152    0.23229844    0.00531688    0.00480343    0.00128528
C    2.34283238    0.05175709   -0.10293082    0.00852529   -0.01587340   -0.01690685
H    3.43373221   -0.02516138   -0.17678158    0.00621857   -0.00287426   -0.00075937
   15
   -420.53643991
H   -2.68416765    0.63755265   -0.07147480   -0.01444496   -0.00035337   -0.00309559
O   -1.96334835    1.31325065    0.04820640   -0.01698670    0.01205290    0.00492557
O   -2.02927249   -1.35403408   -0.06408514   -0.03208580   -0.02839047    0.00133286
C   -0.72673188    0.67646701    0.00029160    0.04288346   -0.00581317   -0.00399132
C   -0.87691779   -0.80744526   -0.04015229    0.00704344    0.01773930   -0.00072876
C    0.36227949    1.53014659    0.04112394    0.01261234   -0.00957677    0.00370829
C    0.34241731   -1.59525903    0.03079289    0.00287041   -0.00656073   -0.01018651
C    1.74715553    1.30605305   -0.01204584   -0.01024376    0.01606568    0.01692456
C    1.65053786   -1.17176576    0.10085556   -0.01935545    0.01140458    0.01361070
H    0.06619493    2.58157217    0.01678533    0.00124807    0.00254975   -0.00354824
H    0.20307502   -2.66775687    0.15471730    0.00484725   -0.00130905    0.00139080
H    2.37830174    2.19351339   -0.12456885    0.00247071    0.00388890   -0.00378047
H    2.38534074   -1.96768923    0.22858708    0.00531684    0.00660482    0.00085703
C    2.34178885    0.05123766   -0.10195741    0.00774058   -0.01646339   -0.01637861
H    3.43240717   -0.01888327   -0.18239294    0.00608622   -0.00176983   -0.00103991
   15
   -420.53635671
H   -2.68179199    0.63672753   -0.08285766   -0.01130077    0.00311254   -0.00298840
O   -1.96573230    1.30664758    0.04901389   -0.02135118    0.00751984    0.00447837
O   -2.02839482   -1.35085727   -0.06368076   -0.03149766   -0.02789271    0.00158976
C   -0.72646125    0.67424423    0.00144118    0.04020073   -0.00998164   -0.00342662
C   -0.87529736   -0.80494114   -0.04060162    0.00848624    0.01919124   -0.00079331
C    0.36577946    1.53230856    0.03858884    0.01707786   -0.00858969    0.00228275
C    0.33900112   -1.59505915    0.02976745   -0.00107046   -0.01064322   -0.01037552
C    1.75021019    1.30427669   -0.01039679   -0.00769053    0.01376897    0.01817006
C    1.64899856   -1.16917544    0.10137765   -0.01734868    0.01321668    0.01385924
H    0.06405520    2.58533925    0.02213915    0.00015321    0.00436146   -0.00295571
H    0.19526993   -2.66133505    0.15628060    0.00466516    0.00227903    0.00121200
H    2.38359250    2.18623403   -0.13650224    0.00207053    0.00255421   -0.00442644
H    2.38701210   -1.96031400    0.22472131    0.00514461    0.00826712    0.00045274
C    2.34062803    0.05096645   -0.10073643    0.00718526   -0.01647846   -0.01578356
H    3.42999515   -0.01228745   -0.18781755    0.00534495   -0.00061662   -0.00128433
   15
   -420.53620904
H   -2.67739515    0.63533478   -0.09370612   -0.00724747    0.00707999   -0.00264067
O   -1.96787382    1.29995969    0.04977083   -0.02597626    0.00246044    0.00377293
O   -2.02716043   -1.34736443   -0.06329443   -0.03028150   -0.02700265    0.00185593
C   -0.72679750    0.67217231    0.00264253    0.03674729   -0.01410519   -0.00283860
C   -0.87380464   -0.80272647   -0.04103892    0.00944712    0.02005599   -0.00087368
C    0.36902169    1.53459956    0.03601927    0.02114998   -0.00690866    0.00081633
C    0.33560113   -1.59469888    0.02889891   -0.00503743   -0.01428022   -0.01052431
C    1.75338025    1.30229244   -0.00902215   -0.00439540    0.01122101    0.01915998
C    1.64772122   -1.16678506    0.10169029   -0.01505801    0.01511026    0.01403207
H    0.06188622    2.58832953    0.02802441   -0.00082819    0.00559547   -0.00231623
H    0.18662622   -2.65531840    0.15762630    0.00436376    0.00551975    0.00103163
H    2.38851381    2.17849793   -0.14764006    0.00145659    0.00099978   -0.00496592
H    2.38775928   -1.95442317    0.22077301    0.00484849    0.00966368    0.00011337
C    2.33935837    0.05094365   -0.09927687    0.00679332   -0.01588449   -0.01513366
H    3.42662851   -0.00558057   -0.19301158    0.00407167    0.00053164   -0.00148411
   15
   -420.53600752
H   -2.67169751    0.63266820   -0.10408179   -0.00293305    0.01100307   -0.00213448
O   -1.96972101    1.29324390    0.05048511   -0.03022619   -0.00259815    0.00292724
O   -2.02558312   -1.34356565   -0.06292916   -0.02843048   -0.02573622    0.00213221
C   -0.72768862    0.67031345    0.00388678    0.03267063   -0.01805367   -0.00223390
C   -0.87245412   -0.80081428   -0.04146300    0.00988960    0.02029826   -0.00096953
C    0.37194483    1.53699414    0.03343738    0.02466375   -0.00450163   -0.00066343
C    0.33227711   -1.59412388    0.02818952   -0.00884771   -0.01695823   -0.01067922
C    1.75661603    1.30013891   -0.00793688   -0.00048300    0.00835457    0.01989748
C    1.64667143   -1.16462332    0.10179091   -0.01266814    0.01714685    0.01409137
H    0.05986369    2.59032284    0.03432625   -0.00163093    0.00612114   -0.00164919
H    0.17719915   -2.65028365    0.15878555    0.00389083    0.00793450    0.00091080
H    2.39317561    2.17058249   -0.15788535    0.00072151   -0.00063909   -0.00537765
H    2.38763306   -1.95026642    0.21680359    0.00456312    0.01067108   -0.00016429
C    2.33798594    0.05116024   -0.09758856    0.00644550   -0.01464271   -0.01443661
H    3.42253453    0.00103134   -0.19793899    0.00240643    0.00164263   -0.00164402
   15
   -420.53581193
H   -2.66546413    0.62803078   -0.11407294    0.00084352    0.01422765   -0.00165310
O   -1.97122635    1.28655700    0.05116617   -0.03334068   -0.00700914    0.00211438
O   -2.02368391   -1.33947525   -0.06258810   -0.02593868   -0.02411248    0.00242217
C   -0.72907314    0.66872718    0.00516480    0.02811728   -0.02169067   -0.00161930
C   -0.87125244   -0.79920821   -0.04187239    0.00976441    0.01988974   -0.00108543
C    0.37449589    1.53945597    0.03086549    0.02749831   -0.00141573   -0.00212603
C    0.32908648   -1.59329419    0.02764164   -0.01233245   -0.01823924   -0.01087797
C    1.75985853    1.29785953   -0.00715214    0.00389342    0.00509890    0.02039243
C    1.64581327   -1.16272103    0.10167863   -0.01034535    0.01933595    0.01402911
H    0.05813129    2.59122502    0.04092494   -0.00221374    0.00589326   -0.00097931
H    0.16707428   -2.64666048    0.15977903    0.00320894    0.00915604    0.00091394
H    2.39770854    2.16278118   -0.16716287   -0.00002867   -0.00222921   -0.00569816
H    2.38668413   -1.94802376    0.21286249    0.00435771    0.01119636   -0.00035785
C    2.33651618    0.05159740   -0.09568204    0.00600103   -0.01272781   -0.01368441
H    3.41801053    0.00734826   -0.20257092    0.00052441    0.00270044   -0.00177003
   15
   -420.53569718
H   -2.65936369    0.62085168   -0.12376312    0.00332222    0.01609789   -0.00141955
O   -1.97235520    1.27994843    0.05182299   -0.03458140   -0.01012622    0.00156305
O   -2.02149104   -1.33511162   -0.06227452   -0.02281831   -0.02215761    0.00272507
C   -0.73088237    0.66746835    0.00646728    0.02321259   -0.02490016   -0.00099722
C   -0.87019767   -0.79790206   -0.04226535    0.00904783    0.01882060   -0.00122447
C    0.37663211    1.54193852    0.02832569    0.02959492    0.00224301   -0.00353775
C    0.32608172   -1.59219066    0.02725834   -0.01534871   -0.01791797   -0.01115896
C    1.76304183    1.29550362   -0.00667546    0.00854977    0.00139198    0.02067586
C    1.64511177   -1.16111126    0.10135438   -0.00822814    0.02165654    0.01384632
H    0.05679389    2.59107697    0.04770026   -0.00256033    0.00493342   -0.00033203
H    0.15637524   -2.64466506    0.16060614    0.00226231    0.00896451    0.00105110
H    2.40224410    2.15537903   -0.17541507   -0.00065203   -0.00363485   -0.00594801
H    2.38494885   -1.94778900    0.20898456    0.00427950    0.01118683   -0.00046415
C    2.33495600    0.05222622   -0.09356872    0.00529941   -0.01018284   -0.01282903
H    3.41339226    0.01318036   -0.20688454   -0.00136975    0.00363788   -0.00183697
   15
   -420.53567768
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O   -2.01903988   -1.33049696   -0.06199186   -0.01909147   -0.01988988    0.00304137
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   15
   -420.53575368
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O   -2.01637267   -1.32565693   -0.06174372   -0.01480878   -0.01735022    0.00337262
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   15
   -420.53585820
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O   -2.01353793   -1.32062029   -0.06153385   -0.01004161   -0.01457931    0.00371879
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C    1.77153313    1.28857022   -0.00712423    0.02214210   -0.01217125    0.02058737
C    1.64364899   -1.15839085    0.09914615   -0.00362953    0.02867257    0.01264121
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C    2.32987654    0.05483117   -0.08611600    0.00016796    0.00079549   -0.01001695
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   15
   -420.53591016
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O   -2.01058963   -1.31541840   -0.06136617   -0.00489017   -0.01163390    0.00407554
C   -0.74084288    0.66654612    0.01173362    0.00226670   -0.03164579    0.00148930
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C    0.31670378   -1.58545875    0.02746443   -0.02173191   -0.00449403   -0.01243347
C    1.77378276    1.28653143   -0.00789863    0.02597005   -0.01707433    0.02032972
C    1.64329800   -1.15830457    0.09801845   -0.00265472    0.03064829    0.01207617
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C    2.32813657    0.05575508   -0.08330862   -0.00266898    0.00511413   -0.00890044
H    3.39986346    0.02852730   -0.22049863   -0.00491659    0.00620120   -0.00266873
   15
   -420.53588250
H   -2.63563511    0.54611954   -0.16609372   -0.00594525    0.00261893   -0.00694466
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O   -2.00758610   -1.31008463   -0.06124471    0.00051279   -0.00858689    0.00443589
C   -0.74361796    0.66747143    0.01301729   -0.00289778   -0.03158293    0.00209439
C   -0.86642541   -0.79497531   -0.04389533   -0.00332882    0.00475440   -0.00234297
C    0.38037286    1.55261915    0.01680216    0.02983374    0.02072525   -0.00897444
C    0.31514016   -1.58345089    0.02797502   -0.02204153   -0.00031978   -0.01251287
C    1.77564038    1.28475051   -0.00898028    0.02924707   -0.02175284    0.01996999
C    1.64298741   -1.15868124    0.09670819   -0.00188790    0.03222846    0.01147009
H    0.05687580    2.58371064    0.08048660   -0.00168321   -0.00487677    0.00205785
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C    2.32643748    0.05660170   -0.08036673   -0.00591240    0.00945469   -0.00772494
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   15
   -420.53580617
H   -2.62980348    0.52689839   -0.17191852   -0.00840217   -0.00133638   -0.00849937
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O   -2.00458846   -1.30465347   -0.06117358    0.00600433   -0.00551144    0.00479240
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C    1.77705656    1.28329786   -0.01036374    0.03189480   -0.02590254    0.01950831
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C    2.32482794    0.05730558   -0.07730811   -0.00929578    0.01363323   -0.00650623
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   15
   -420.53576981
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O   -2.00165883   -1.29915976   -0.06115679    0.01138742   -0.00247481    0.00513556
C   -0.74896136    0.67074034    0.01548087   -0.01275693   -0.02935374    0.00323980
C   -0.86488379   -0.79465980   -0.04432595   -0.01102972   -0.00337345   -0.00298074
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C    1.77799130    1.28223577   -0.01204201    0.03388770   -0.02917984    0.01892615
C    1.64244290   -1.16091039    0.09357719   -0.00074188    0.03370785    0.01017584
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H    2.35003810   -1.99184737    0.18373234    0.00424646    0.00128286    0.00019673
C    2.32335881    0.05780381   -0.07415111   -0.01255212    0.01741540   -0.00528528
H    3.39798931    0.02887155   -0.22573600   -0.00203440    0.00636176   -0.00388067
   15
   -420.53583676
H   -2.61339494    0.48969734   -0.17876680   -0.01000407   -0.00649323   -0.01059946
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O   -1.99885809   -1.29363783   -0.06119823    0.01645970    0.00042359    0.00545511
C   -0.75138072    0.67305033    0.01664348   -0.01735195   -0.02725632    0.00377089
C   -0.86389241   -0.79445662   -0.04447612   -0.01486738   -0.00747102   -0.00332818
C    0.37717048    1.55578776    0.01138847    0.02543168    0.02166658   -0.01090939
C    0.31243792   -1.57760059    0.03063036   -0.02098769    0.00794388   -0.01151572
C    1.77841445    1.28161348   -0.01400625    0.03522611   -0.03129496    0.01820125
C    1.64219160   -1.16278501    0.09177598   -0.00030747    0.03341944    0.00951419
H    0.06105491    2.58617154    0.09634826   -0.00135011   -0.00600574    0.00305768
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C    2.32207893    0.05803944   -0.07091415   -0.01539498    0.02061327   -0.00410021
H    3.39838800    0.02668393   -0.22618910   -0.00062772    0.00609558   -0.00434317
   15
   -420.53610775
H   -2.60253231    0.47264129   -0.17941434   -0.00893601   -0.00741129   -0.01098573
O   -1.97019277    1.22469253    0.05609317    0.00854237   -0.00154527    0.00859642
O   -1.99624356   -1.28812050   -0.06130151    0.02099097    0.00311340    0.00573581
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C    0.31218240   -1.57584676    0.03187329   -0.02017052    0.00874403   -0.01075902
C    1.77830578    1.28146267   -0.01624550    0.03592031   -0.03201536    0.01732147
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C    2.32103085    0.05796439   -0.06761513   -0.01751075    0.02304682   -0.00298203
H    3.39890242    0.02340148   -0.22586169    0.00064860    0.00568991   -0.00475870
   15
   -420.53655367
H   -2.59007744    0.45690322   -0.17809002   -0.00672688   -0.00721271   -0.01092803
O   -1.96967611    1.21873602    0.05619267    0.01122701   -0.00376874    0.00835491
O   -1.99386646   -1.28263820   -0.06146982    0.02478129    0.00549865    0.00597108
C   -0.75536862    0.67886414    0.01879025   -0.02552070   -0.02139917    0.00472711
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C    0.37307654    1.55627706    0.00858748    0.02170600    0.01601591   -0.01179561
C    0.31223170   -1.57422393    0.03327866   -0.01920143    0.00854384   -0.00981321
C    1.77765472    1.28179406   -0.01874645    0.03600891   -0.03119906    0.01627250
C    1.64169849   -1.16803208    0.08775183    0.00021903    0.03064237    0.00821523
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C    2.32024637    0.05754197   -0.06427095   -0.01871075    0.02460241   -0.00194859
H    3.39930487    0.01909691   -0.22467886    0.00162196    0.00515116   -0.00511222
   15
   -420.53714159
H   -2.57642466    0.44244861   -0.17480420   -0.00359515   -0.00598734   -0.01045671
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O   -1.99176962   -1.27721792   -0.06170579    0.02764583    0.00749990    0.00614984
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C   -0.85936424   -0.79293976   -0.04460294   -0.02389857   -0.01807138   -0.00441212
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C    0.31257114   -1.57272925    0.03483223   -0.01807904    0.00750376   -0.00872054
C    1.77645987    1.28259529   -0.02149322    0.03553737   -0.02881781    0.01505228
C    1.64144889   -1.17136250    0.08554852    0.00021797    0.02819003    0.00757668
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H    2.31393235   -2.02970941    0.16913744   -0.00056604   -0.00200999    0.00043556
C    2.31974344    0.05674882   -0.06089719   -0.01885354    0.02519724   -0.00102246
H    3.39942218    0.01386816   -0.22257730    0.00217876    0.00447480   -0.00537324
   15
   -420.53779317
H   -2.56213387    0.42906026   -0.16964083    0.00017353   -0.00395644   -0.00965439
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O   -1.98998539   -1.27188233   -0.06201146    0.02943798    0.00906878    0.00626543
C   -0.75782394    0.68596352    0.02065197   -0.03146608   -0.01382397    0.00551859
C   -0.85718554   -0.79195399   -0.04451911   -0.02542952   -0.02060673   -0.00476218
C    0.36767523    1.55581388    0.00649806    0.01689259    0.00719409   -0.01226984
C    0.31318374   -1.57134727    0.03651751   -0.01679790    0.00587313   -0.00752678
C    1.77472836    1.28383045   -0.02446730    0.03454563   -0.02495919    0.01365009
C    1.64119631   -1.17511843    0.08323065   -0.00003417    0.02515399    0.00693714
H    0.07031523    2.60200237    0.10945756   -0.00185641    0.00136353    0.00446933
H    0.06391498   -2.62870370    0.14043067   -0.00759431    0.00018307    0.00142238
H    2.45273416    2.12654010   -0.18303671    0.00602555   -0.00108299   -0.00558027
H    2.30450505   -2.03849191    0.16530764   -0.00227838   -0.00196436    0.00043074
C    2.31952423    0.05557583   -0.05750787   -0.01792496    0.02487791   -0.00020959
H    3.39915579    0.00783458   -0.21951072    0.00226787    0.00374587   -0.00553325
   15
   -420.53843909
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   15
   -420.53904301
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   15
   -420.53957174
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   15
   -420.54009814
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   15
   -420.54064429
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   15
   -420.54118720
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   15
   -420.54161374
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   15
   -420.54189198
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   15
   -420.54195961
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   15
   -420.54171873
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   15
   -420.54131764
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   15
   -420.54075215
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   15
   -420.54022588
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   15
   -420.53973967
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   15
   -420.53934239
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   15
   -420.53908489
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   15
   -420.53887604
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   15
   -420.53866032
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   15
   -420.53841503
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   15
   -420.53812154
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   15
   -420.53779028
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   15
   -420.53744209
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   15
   -420.53712037
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   15
   -420.53684833
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O   -1.97656161   -1.16536154   -0.08172363   -0.02173066    0.01248000   -0.00595229
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C    1.67645156    1.26157540   -0.09309316   -0.01457679    0.01106732   -0.02252579
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H    2.38721383   -2.11336704    0.04314700    0.00013328    0.00257178   -0.00088559
C    2.30981628   -0.00197063    0.00337607    0.01095381   -0.01497539    0.00714828
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   15
   -420.53661993
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O   -1.97373331   -1.16156058   -0.08231986   -0.01876418    0.01512944   -0.00615122
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C   -0.77342556   -0.71706413   -0.01589763    0.01585586    0.03634941   -0.00077721
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   15
   -420.53643530
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O   -1.97069268   -1.15793135   -0.08284637   -0.01522824    0.01790604   -0.00629664
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C    0.32892427    1.61900451    0.01031783    0.02736119    0.02123199    0.01297705
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C    1.67224901    1.25036108   -0.09278226   -0.01007792    0.00026137   -0.02185642
C    1.70550653   -1.28077673    0.01577821    0.01214567   -0.00606513   -0.00728994
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C    2.30494793   -0.00294659    0.00541715    0.00760969   -0.01287367    0.00585392
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   15
   -420.53630583
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O   -1.96747976   -1.15450531   -0.08330149   -0.01119861    0.02076914   -0.00639340
C   -0.75219088    0.72554649    0.01479556   -0.00197372   -0.02813035   -0.00369386
C   -0.77287832   -0.71795623   -0.01215557    0.00813797    0.03297186   -0.00007391
C    0.32770148    1.62351110    0.00942486    0.02796684    0.02723877    0.01323219
C    0.34769822   -1.60016004    0.07573074   -0.01549412    0.00059415    0.01275932
C    1.67039362    1.24470586   -0.09212818   -0.00775195   -0.00584291   -0.02123825
C    1.71018261   -1.28264936    0.01398327    0.01449695   -0.00332599   -0.00752770
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H    2.41730746   -2.11248713    0.02712833    0.00329075    0.00099203   -0.00136270
C    2.30232730   -0.00313404    0.00629989    0.00501087   -0.01132883    0.00507734
H    3.38258744    0.01902305    0.10629292   -0.00214272   -0.00076555    0.00488320
   15
   -420.53613561
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O   -1.96414020   -1.15131493   -0.08368419   -0.00677661    0.02369642   -0.00642103
C   -0.75496487    0.72632618    0.01429828   -0.00482416   -0.02972743   -0.00420170
C   -0.77281943   -0.71916472   -0.01028025    0.00368030    0.02995536    0.00024960
C    0.32605694    1.62760702    0.00833200    0.02765406    0.03228283    0.01334546
C    0.35006367   -1.60300560    0.07533833   -0.01442254    0.00230502    0.01260746
C    1.66865549    1.23913923   -0.09115322   -0.00546843   -0.01214229   -0.02042814
C    1.71463994   -1.28447154    0.01230212    0.01651798   -0.00072318   -0.00774162
H    0.03057601    2.66771343   -0.02894512   -0.00506845   -0.00457632   -0.00192919
H    0.07618827   -2.66719726    0.07441249   -0.00126666   -0.00772267   -0.00136560
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H    2.42641873   -2.11270827    0.02224232    0.00432714    0.00028324   -0.00150790
C    2.29963140   -0.00315054    0.00710595    0.00196397   -0.00948853    0.00423255
H    3.37974544    0.03200396    0.11740875   -0.00155034    0.00046334    0.00542405
   15
   -420.53601333
H   -2.50875822    0.26500895    0.17563168    0.00398120    0.00007056    0.01011218
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O   -1.96072398   -1.14839335   -0.08399412   -0.00211089    0.02661208   -0.00638929
C   -0.75766657    0.72755416    0.01386450   -0.00714943   -0.03035198   -0.00467556
C   -0.77281592   -0.72082517   -0.00840870   -0.00098714    0.02615658    0.00056004
C    0.32399522    1.63121641    0.00703751    0.02656459    0.03603897    0.01333270
C    0.35264690   -1.60588518    0.07475544   -0.01311698    0.00333753    0.01234926
C    1.66700014    1.23375610   -0.08986964   -0.00327633   -0.01837407   -0.01942138
C    1.71884781   -1.28628244    0.01073801    0.01829853    0.00158483   -0.00793429
H    0.03074422    2.67002787   -0.03323501   -0.00494927   -0.00565595   -0.00185477
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H    2.29882970    2.12061394   -0.04275131   -0.00899570    0.00495089    0.00426831
H    2.43475356   -2.11298204    0.01762765    0.00518854   -0.00032280   -0.00164365
C    2.29690609   -0.00302389    0.00784810   -0.00133480   -0.00738750    0.00333829
H    3.37717900    0.04490130    0.12754797   -0.00070521    0.00173669    0.00597195
   15
   -420.53589522
H   -2.51704210    0.26512617    0.17289100    0.00111585   -0.00249966    0.01030417
O   -2.01654970    1.14592583    0.05152057   -0.00555647   -0.02565869   -0.00691179
O   -1.95728391   -1.14577364   -0.08423166    0.00263808    0.02948122   -0.00628744
C   -0.76026081    0.72923986    0.01350136   -0.00896774   -0.03001837   -0.00511022
C   -0.77279742   -0.72288032   -0.00654560   -0.00570357    0.02170295    0.00086635
C    0.32153260    1.63428275    0.00554157    0.02484646    0.03826970    0.01320672
C    0.35542833   -1.60881419    0.07398596   -0.01171006    0.00350159    0.01199324
C    1.66539448    1.22865036   -0.08829263   -0.00121176   -0.02424735   -0.01823256
C    1.72277922   -1.28811679    0.00929383    0.01990256    0.00347744   -0.00811057
H    0.03180379    2.67334882   -0.03719099   -0.00486188   -0.00592820   -0.00177992
H    0.05658504   -2.67286781    0.07891679   -0.00496737   -0.01073380   -0.00079990
H    2.30790724    2.11116227   -0.05006803   -0.00693047    0.00548644    0.00370130
H    2.44215810   -2.11320055    0.01330870    0.00579902   -0.00073121   -0.00176679
C    2.29420097   -0.00278575    0.00853980   -0.00464583   -0.00509637    0.00243137
H    3.37473805    0.05748558    0.13661190    0.00024587    0.00302829    0.00650917
   15
   -420.53578741
H   -2.52552756    0.26569141    0.16829792   -0.00170203   -0.00494019    0.01032318
O   -2.01770636    1.14848409    0.05221158   -0.00289719   -0.02283537   -0.00678637
O   -1.95387365   -1.14348822   -0.08439792    0.00727160    0.03221826   -0.00612998
C   -0.76272002    0.73137834    0.01321542   -0.01032959   -0.02879121   -0.00549431
C   -0.77269288   -0.72526300   -0.00469563   -0.01026334    0.01674235    0.00118199
C    0.31869495    1.63677243    0.00384607    0.02260622    0.03888213    0.01298586
C    0.35838681   -1.61179497    0.07303525   -0.01031014    0.00268351    0.01155105
C    1.66380734    1.22391048   -0.08644016    0.00068860   -0.02949105   -0.01687916
C    1.72640986   -1.29000307    0.00797226    0.02137508    0.00484423   -0.00827136
H    0.03373953    2.67772424   -0.04082638   -0.00483610   -0.00531507   -0.00171604
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H    2.31822961    2.10072709   -0.05805001   -0.00467270    0.00573150    0.00306157
H    2.44852320   -2.11329135    0.00930759    0.00609388   -0.00087369   -0.00187403
C    2.29156587   -0.00247076    0.00919469   -0.00772754   -0.00265758    0.00153769
H    3.37225407    0.06952575    0.14450412    0.00108899    0.00429424    0.00700130
   15
   -420.53571314
H   -2.53371033    0.26714018    0.16185005   -0.00425271   -0.00698472    0.01011030
O   -2.01882998    1.15130168    0.05297943   -0.00043341   -0.02034091   -0.00649230
O   -1.95054557   -1.14156807   -0.08449470    0.01158256    0.03474947   -0.00591228
C   -0.76502352    0.73395114    0.01301249   -0.01128906   -0.02674236   -0.00581858
C   -0.77243358   -0.72789841   -0.00286353   -0.01445992    0.01144165    0.00150960
C    0.31551608    1.63867614    0.00195436    0.01991107    0.03791875    0.01267224
C    0.36150136   -1.61481518    0.07190999   -0.00902024    0.00090244    0.01103223
C    1.66221003    1.21961539   -0.08433266    0.00240192   -0.03384478   -0.01538463
C    1.72971745   -1.29196188    0.00677572    0.02273811    0.00565535   -0.00841623
H    0.03654681    2.68304565   -0.04415252   -0.00485435   -0.00389629   -0.00166884
H    0.04048149   -2.67109364    0.08399406   -0.00741532   -0.00902907   -0.00018517
H    2.32939303    2.08926606   -0.06658222   -0.00236651    0.00555925    0.00235439
H    2.45379566   -2.11322904    0.00564352    0.00607245   -0.00072596   -0.00196069
C    2.28904711   -0.00211563    0.00982617   -0.01034381   -0.00016007    0.00072459
H    3.36957586    0.08079444    0.15113579    0.00170141    0.00552335    0.00743103
   15
   -420.53563542
H   -2.54113608    0.26983822    0.15358562   -0.00628641   -0.00846071    0.00964646
O   -2.01994839    1.15435066    0.05382074    0.00167616   -0.01839937   -0.00601221
O   -1.94734842   -1.14004185   -0.08452444    0.01537720    0.03699949   -0.00565197
C   -0.76715677    0.73692740    0.01289744   -0.01187685   -0.02395803   -0.00607749
C   -0.77195629   -0.73070667   -0.00105428   -0.01808296    0.00599959    0.00186504
C    0.31203671    1.64000820   -0.00012886    0.01680685    0.03555631    0.01227958
C    0.36475245   -1.61784799    0.07061798   -0.00786205   -0.00175556    0.01045589
C    1.66057666    1.21583071   -0.08199269    0.00390971   -0.03711032   -0.01378266
C    1.73268142   -1.29400549    0.00570642    0.02396845    0.00589762   -0.00854962
H    0.04023065    2.68905861   -0.04717783   -0.00488591   -0.00179338   -0.00163256
H    0.03432968   -2.66766254    0.08661037   -0.00802258   -0.00650215    0.00011049
H    2.34098357    2.07681100   -0.07553758   -0.00013572    0.00490366    0.00159584
H    2.45797994   -2.11304018    0.00233212    0.00572198   -0.00029368   -0.00202507
C    2.28668398   -0.00175802    0.01044657   -0.01230923    0.00230382    0.00000699
H    3.36659650    0.09107064    0.15643080    0.00194187    0.00665218    0.00776540
   15
   -420.53561159
H   -2.54743903    0.27404941    0.14358827   -0.00765907   -0.00925631    0.00893052
O   -2.02108538    1.15760887    0.05473009    0.00328354   -0.01706395   -0.00535801
O   -1.94432506   -1.13893500   -0.08449008    0.01845650    0.03887550   -0.00536433
C   -0.76911083    0.74026512    0.01287421   -0.01213589   -0.02053066   -0.00626848
C   -0.77120652   -0.73360571    0.00072671   -0.02092418    0.00059609    0.00226089
C    0.30830373    1.64080397   -0.00239762    0.01331497    0.03208499    0.01179716
C    0.36812261   -1.62085342    0.06916795   -0.00685634   -0.00508529    0.00983343
C    1.65888447    1.21260565   -0.07944441    0.00518856   -0.03915902   -0.01211531
C    1.73528320   -1.29613764    0.00476637    0.02502421    0.00561676   -0.00866914
H    0.04479294    2.69538935   -0.04990954   -0.00479548    0.00067004   -0.00160217
H    0.02961640   -2.66307338    0.08920716   -0.00822801   -0.00311963    0.00038220
H    2.35260051    2.06348062   -0.08477987    0.00193451    0.00372735    0.00081037
H    2.46113804   -2.11280196   -0.00061507    0.00509279    0.00037439   -0.00206523
C    2.28450600   -0.00143508    0.01106671   -0.01349977    0.00464968   -0.00057785
H    3.36327390    0.10015131    0.16032929    0.00174892    0.00764658    0.00798921
   15
   -420.53562237
H   -2.55237299    0.27991526    0.13198631   -0.00827262   -0.00926868    0.00799995
O   -2.02225906    1.16106122    0.05570008    0.00429387   -0.01642081   -0.00455093
O   -1.94151025   -1.13826880   -0.08439489    0.02065829    0.04034616   -0.00506048
C   -0.77088179    0.74391264    0.01294567   -0.01207487   -0.01657324   -0.00639077
C   -0.77014157   -0.73651398    0.00247346   -0.02280936   -0.00460298    0.00270134
C    0.30436988    1.64111554   -0.00484463    0.00941948    0.02786505    0.01122315
C    0.37159652   -1.62378148    0.06756927   -0.00593694   -0.00879123    0.00917615
C    1.65711413    1.20997112   -0.07671301    0.00622133   -0.03991884   -0.01041995
C    1.73750695   -1.29835417    0.00395737    0.02581531    0.00489080   -0.00877123
H    0.05021339    2.70159973   -0.05235357   -0.00454737    0.00318044   -0.00155716
H    0.02637901   -2.65793070    0.09173558   -0.00807145    0.00079626    0.00062347
H    2.36387317    2.04948598   -0.09416806    0.00373992    0.00205422    0.00002000
H    2.46338206   -2.11263365   -0.00319082    0.00426075    0.00120442   -0.00208033
C    2.28253111   -0.00118217    0.01169541   -0.01385915    0.00677665   -0.00101581
H    3.35964316    0.10785813    0.16279153    0.00110874    0.00846677    0.00808324
   15
   -420.53566476
H   -2.55582859    0.28743753    0.11894717   -0.00808261   -0.00844830    0.00688763
O   -2.02348084    1.16470041    0.05672160    0.00463274   -0.01647192   -0.00363464
O   -1.93892887   -1.13805981   -0.08424229    0.02187852    0.04131961   -0.00476931
C   -0.77247055    0.74781021    0.01311369   -0.01170644   -0.01218175   -0.00644914
C   -0.76873304   -0.73935308    0.00417930   -0.02363290   -0.00940695    0.00319497
C    0.30029382    1.64100636   -0.00746123    0.00518051    0.02321679    0.01055987
C    0.37516020   -1.62657664    0.06583189   -0.00500960   -0.01246196    0.00848241
C    1.65525005    1.20793862   -0.07382405    0.00697596   -0.03939494   -0.00873497
C    1.73934084   -1.30064425    0.00328096    0.02624127    0.00383215   -0.00884988
H    0.05644507    2.70724067   -0.05451768   -0.00407629    0.00549263   -0.00148696
H    0.02459119   -2.65293298    0.09415243   -0.00766244    0.00481540    0.00082576
H    2.37447654    2.03512791   -0.10356032    0.00523795   -0.00005622   -0.00074553
H    2.46486053   -2.11268299   -0.00539240    0.00332578    0.00209190   -0.00207134
C    2.28076478   -0.00103137    0.01233928   -0.01341593    0.00861562   -0.00129472
H    3.35581864    0.11404355    0.16380044    0.00006991    0.00909857    0.00806132
   15
   -420.53569719
H   -2.55784181    0.29646891    0.10467002   -0.00706030   -0.00679479    0.00566873
O   -2.02475452    1.16852718    0.05778427    0.00426024   -0.01725118   -0.00266017
O   -1.93659471   -1.13831904   -0.08403557    0.02206309    0.04175126   -0.00450955
C   -0.77388273    0.75189160    0.01337914   -0.01100412   -0.00747902   -0.00645052
C   -0.76696860   -0.74205050    0.00583677   -0.02331605   -0.01371523    0.00373590
C    0.29613988    1.64054619   -0.01023732    0.00058052    0.01850928    0.00978623
C    0.37879938   -1.62918398    0.06396632   -0.00390044   -0.01562822    0.00775209
C    1.65328089    1.20650029   -0.07080296    0.00740616   -0.03766087   -0.00709616
C    1.74077854   -1.30299204    0.00273832    0.02618953    0.00256602   -0.00889952
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   15
   -420.53573192
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   15
   -420.53580469
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   15
   -420.53588080
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O   -1.93104036   -1.14192354   -0.08311728    0.01687832    0.03979490   -0.00402948
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   15
   -420.53596892
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C   -0.75669792   -0.75026652    0.01181000   -0.01161918   -0.02435593    0.00623925
C    0.28018559    1.63655527   -0.02268169   -0.01941834    0.00338316    0.00575388
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   15
   -420.53609489
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O   -1.92832703   -1.14659427   -0.08227327    0.00996571    0.03611209   -0.00397618
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C    0.27674054    1.63530597   -0.02605157   -0.02414817    0.00114626    0.00454632
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C    1.74238777   -1.31492133    0.00203561    0.01620207   -0.00320110   -0.00848584
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   15
   -420.53619457
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C    0.27366008    1.63403857   -0.02949011   -0.02843799   -0.00044315    0.00327930
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   15
   -420.53632504
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O   -1.92606217   -1.15289856   -0.08124840    0.00203335    0.03110436   -0.00403243
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C    0.27100881    1.63277735   -0.03297821   -0.03209634   -0.00156100    0.00197733
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C    2.27185506   -0.00551592    0.01818094   -0.00170543    0.00811847   -0.00028095
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   15
   -420.53646822
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O   -1.92498708   -1.15659460   -0.08066754   -0.00185232    0.02828932   -0.00406039
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C   -0.74379536   -0.75281526    0.01627785    0.00881242   -0.02409084    0.00853557
C    0.26884179    1.63153934   -0.03649617   -0.03490899   -0.00235496    0.00065443
C    0.40716889   -1.64139593    0.04592968    0.02015117   -0.00048349    0.00014885
C    1.63428834    1.21071795   -0.04460795   -0.00513626   -0.00432055    0.00348787
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   15
   -420.53663938
H   -2.56272902    0.37557661   -0.04649742    0.00257202    0.00475491   -0.00316140
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C   -0.74070507   -0.75251805    0.01709223    0.01381122   -0.02259390    0.00895589
C    0.26720137    1.63033681   -0.04002402   -0.03672752   -0.00304493   -0.00067035
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C    1.63186503    1.21223364   -0.04137866   -0.00857902   -0.00088248    0.00462411
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   15
   -420.53676357
H   -2.56604490    0.37899064   -0.06270684    0.00038178    0.00156061   -0.00447461
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C   -0.73782316   -0.75187981    0.01777131    0.01846913   -0.02064528    0.00929099
C    0.26611486    1.62918040   -0.04354173   -0.03741071   -0.00381341   -0.00199407
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C    1.62957155    1.21376334   -0.03821923   -0.01212458    0.00200077    0.00572452
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   15
   -420.53687257
H   -2.56942901    0.38212584   -0.07810922   -0.00184678   -0.00176736   -0.00587577
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O   -1.92147617   -1.16947306   -0.07864892   -0.01163343    0.01935190   -0.00397524
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C   -0.73521994   -0.75092992    0.01831001    0.02267771   -0.01831132    0.00953388
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C    1.62746133    1.21526350   -0.03514628   -0.01563020    0.00430885    0.00677320
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C    2.26879675   -0.01101632    0.02129478   -0.00507594    0.00109608    0.00147336
H    3.35781547    0.06389113    0.07612109    0.00279824    0.00258089    0.00378048
   15
   -420.53700065
H   -2.57248528    0.38557478   -0.09245376   -0.00376097   -0.00477782   -0.00726238
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O   -1.92008755   -1.17425016   -0.07788509   -0.01399382    0.01642302   -0.00387157
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C   -0.73295899   -0.74970358    0.01870468    0.02637120   -0.01564207    0.00968008
C    0.26562617    1.62705586   -0.05046693   -0.03509270   -0.00595382   -0.00459927
C    0.41591857   -1.64541635    0.03634316    0.02875824    0.00516642   -0.00277059
C    1.62558716    1.21669918   -0.03217568   -0.01892139    0.00608560    0.00775248
C    1.73638230   -1.32934487    0.00628540   -0.00710731   -0.00993037   -0.00654974
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H    2.45484726   -2.15415071   -0.00430807    0.00246918   -0.00302677   -0.00092339
C    2.26818156   -0.01250109    0.02203723   -0.00621672   -0.00064536    0.00214547
H    3.36089251    0.05241432    0.06241701    0.00453147    0.00120134    0.00306657
   15
   -420.53711048
H   -2.57487312    0.38987506   -0.10549211   -0.00506134   -0.00718456   -0.00853331
O   -2.04018078    1.23842896    0.07098496   -0.00084625    0.00797484    0.00913471
O   -1.91854066   -1.17921365   -0.07707733   -0.01582548    0.01361359   -0.00374514
C   -0.78640022    0.79036940    0.02498726    0.00859083    0.03151769   -0.00345118
C   -0.73109609   -0.74824106    0.01895311    0.02950191   -0.01269994    0.00972573
C    0.26618899    1.62612000   -0.05383504   -0.03210279   -0.00723355   -0.00587330
C    0.41707402   -1.64660607    0.03402799    0.02885174    0.00335694   -0.00318241
C    1.62399866    1.21804347   -0.02932219   -0.02186178    0.00736450    0.00863441
C    1.73562426   -1.33094543    0.00732430   -0.00816990   -0.01143996   -0.00625676
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H    0.12618904   -2.70568480    0.09319059   -0.00022118   -0.00820720    0.00357438
H    2.37678865    1.99649805   -0.17639091    0.00849598   -0.00688866   -0.00655399
H    2.45142095   -2.15707604   -0.00250620    0.00179818   -0.00297837   -0.00079306
C    2.26766009   -0.01397622    0.02274715   -0.00713375   -0.00230068    0.00289161
H    3.36316043    0.04072319    0.04816241    0.00578879   -0.00024821    0.00226526
   15
   -420.53718452
H   -2.57636117    0.39545737   -0.11699726   -0.00558606   -0.00876539   -0.00956131
O   -2.04111056    1.24456727    0.07161464   -0.00079718    0.01188365    0.01011425
O   -1.91681477   -1.18433174   -0.07622706   -0.01711141    0.01096648   -0.00356611
C   -0.78785074    0.79051518    0.02638923    0.00718953    0.02983593   -0.00291347
C   -0.72967852   -0.74658680    0.01905461    0.03202086   -0.00954234    0.00967073
C    0.26723586    1.62529340   -0.05711438   -0.02800179   -0.00841907   -0.00712321
C    0.41779425   -1.64784505    0.03176081    0.02810358    0.00034891   -0.00348340
C    1.62274011    1.21927692   -0.02659909   -0.02432795    0.00821368    0.00939276
C    1.73498871   -1.33237295    0.00845779   -0.00838629   -0.01301141   -0.00596682
H    0.12982799    2.69838766   -0.07826902    0.00760131   -0.00257081    0.00227717
H    0.14009642   -2.70616934    0.08895897    0.00218203   -0.00613652    0.00339014
H    2.36490688    2.00942195   -0.17449618    0.00746431   -0.00458544   -0.00664376
H    2.44767463   -2.15946908   -0.00056160    0.00088155   -0.00265058   -0.00066045
C    2.26724606   -0.01541665    0.02341328   -0.00770308   -0.00387681    0.00368956
H    3.36439492    0.02907711    0.03350090    0.00644357   -0.00171431    0.00140247
   15
   -420.53725534
H   -2.57685639    0.40260470   -0.12678563   -0.00524361   -0.00941157   -0.01027536
O   -2.04203074    1.25057170    0.07212984   -0.00137796    0.01476714    0.01081920
O   -1.91489528   -1.18957443   -0.07533636   -0.01783229    0.00852889   -0.00336966
C   -0.78940904    0.79021071    0.02783519    0.00501693    0.02744559   -0.00231193
C   -0.72874435   -0.74478845    0.01901002    0.03390745   -0.00624153    0.00951549
C    0.26870495    1.62459366   -0.06028606   -0.02295855   -0.00926639   -0.00834535
C    0.41809050   -1.64908819    0.02954620    0.02659492   -0.00358239   -0.00368871
C    1.62184872    1.22038663   -0.02401784   -0.02622982    0.00869223    0.01001299
C    1.73447900   -1.33360380    0.00968150   -0.00781354   -0.01453432   -0.00567668
H    0.12576650    2.70059516   -0.08156772    0.00678507   -0.00013705    0.00234289
H    0.15360979   -2.70555973    0.08411786    0.00471181   -0.00330912    0.00313705
H    2.35168705    2.02317217   -0.17140687    0.00603936   -0.00233913   -0.00662775
H    2.44377190   -2.16138798    0.00150189   -0.00020283   -0.00211598   -0.00052757
C    2.26694798   -0.01679859    0.02402361   -0.00785819   -0.00536184    0.00450699
H    3.36447941    0.01773873    0.01858734    0.00642374   -0.00314044    0.00050612
   15
   -420.53722899
H   -2.57642021    0.41143224   -0.13472999   -0.00402608   -0.00907336   -0.01060744
O   -2.04293469    1.25640963    0.07252263   -0.00261078    0.01654487    0.01118589
O   -1.91277405   -1.19491406   -0.07440744   -0.01797021    0.00631996   -0.00315382
C   -0.79104239    0.78949197    0.02931602    0.00219284    0.02447108   -0.00164876
C   -0.72832204   -0.74289579    0.01882166    0.03513678   -0.00287731    0.00926364
C    0.27052028    1.62403329   -0.06333158   -0.01718705   -0.00952557   -0.00953679
C    0.41798536   -1.65027652    0.02738729    0.02448889   -0.00804339   -0.00383841
C    1.62135315    1.22136530   -0.02158781   -0.02749788    0.00885539    0.01048640
C    1.73408662   -1.33461509    0.01099104   -0.00657101   -0.01589232   -0.00538200
H    0.12048593    2.70282742   -0.08528732    0.00579479    0.00231190    0.00235702
H    0.16627694   -2.70435784    0.07871180    0.00719228   -0.00014260    0.00286985
H    2.33738580    2.03734532   -0.16712600    0.00422767   -0.00023917   -0.00649541
H    2.43990630   -2.16292780    0.00366037   -0.00135107   -0.00147264   -0.00039618
C    2.26676822   -0.01809957    0.02456581   -0.00759207   -0.00677110    0.00530717
H    3.36341695    0.00696470    0.00358270    0.00574588   -0.00449113   -0.00039083
   15
   -420.53710580
H   -2.57527105    0.42187899   -0.14077064   -0.00199150   -0.00775055   -0.01053814
O   -2.04380848    1.26206090    0.07278888   -0.00446888    0.01719469    0.01117639
O   -1.91044953   -1.20032561   -0.07344277   -0.01751547    0.00437337   -0.00292044
C   -0.79270831    0.78840379    0.03082172   -0.00111027    0.02103858   -0.00092608
C   -0.72843016   -0.74095960    0.01849336    0.03569991    0.00047118    0.00892310
C    0.27259500    1.62361609   -0.06623299   -0.01098374   -0.00904784   -0.01067058
C    0.41751044   -1.65134319    0.02528637    0.02194857   -0.01253912   -0.00394705
C    1.62127255    1.22221035   -0.01931611   -0.02809919    0.00876552    0.01080015
C    1.73379298   -1.33538646    0.01238193   -0.00482698   -0.01695597   -0.00507677
H    0.11416525    2.70464669   -0.08943094    0.00464923    0.00451259    0.00233636
H    0.17765105   -2.70312922    0.07278964    0.00947434    0.00294701    0.00259446
H    2.32232841    2.05156422   -0.16167728    0.00207081    0.00165156   -0.00624950
H    2.43628321   -2.16420245    0.00589022   -0.00244774   -0.00083249   -0.00026835
C    2.26670279   -0.01929824    0.02502783   -0.00695123   -0.00812285    0.00605500
H    3.36132850   -0.00300226   -0.01135193    0.00448121   -0.00572825   -0.00126091
   15
   -420.53687878
H   -2.57377371    0.43370774   -0.14492010    0.00073974   -0.00551472   -0.01006324
O   -2.04463104    1.26751811    0.07292872   -0.00691465    0.01676420    0.01078566
O   -1.90792686   -1.20578703   -0.07244499   -0.01645962    0.00271705   -0.00266841
C   -0.79435712    0.78699790    0.03234135   -0.00468234    0.01729130   -0.00014935
C   -0.72907717   -0.73903041    0.01803025    0.03556171    0.00370909    0.00849260
C    0.27483560    1.62333461   -0.06897313   -0.00459410   -0.00766617   -0.01174770
C    0.41670383   -1.65222087    0.02324514    0.01921853   -0.01652121   -0.00405957
C    1.62161598    1.22292317   -0.01720755   -0.02801200    0.00842884    0.01097891
C    1.73357196   -1.33590200    0.01384956   -0.00278880   -0.01759409   -0.00475646
H    0.10700860    2.70566128   -0.09399456    0.00346072    0.00619176    0.00226519
H    0.18732310   -2.70242350    0.06640026    0.01143840    0.00545022    0.00233663
H    2.30690123    2.06548989   -0.15510515   -0.00031509    0.00326519   -0.00588858
H    2.43309823   -2.16532528    0.00816846   -0.00337497   -0.00033160   -0.00014619
C    2.26674214   -0.02037417    0.02539840   -0.00604101   -0.00941773    0.00672386
H    3.35844013   -0.01194050   -0.02606033    0.00275397   -0.00680048   -0.00208157
   15
   -420.53656739
H   -2.57241638    0.44651862   -0.14726290    0.00394291   -0.00253732   -0.00924228
O   -2.04537477    1.27278594    0.07294652   -0.00981059    0.01542248    0.01005345
O   -1.90521807   -1.21127956   -0.07141695   -0.01477474    0.00135031   -0.00239268
C   -0.79593511    0.78533079    0.03386320   -0.00827633    0.01337726    0.00067503
C   -0.73026098   -0.73715705    0.01743883    0.03471426    0.00674373    0.00798191
C    0.27714585    1.62316802   -0.07153575    0.00164697   -0.00540543   -0.01274742
C    0.41560674   -1.65284999    0.02126528    0.01645180   -0.01947512   -0.00417298
C    1.62238220    1.22350873   -0.01526476   -0.02727832    0.00789842    0.01100042
C    1.73339291   -1.33615217    0.01538909   -0.00063095   -0.01771368   -0.00441437
H    0.09922982    2.70557108   -0.09896590    0.00223498    0.00720495    0.00216908
H    0.19494398   -2.70268407    0.05958942    0.01289851    0.00689020    0.00212080
H    2.29153510    2.07883069   -0.14747388   -0.00291153    0.00462927   -0.00543897
H    2.43051668   -2.16638575    0.01047312   -0.00402741   -0.00005235   -0.00003055
C    2.26687266   -0.02130777    0.02566743   -0.00499276   -0.01066294    0.00729268
H    3.35506011   -0.01965682   -0.04039521    0.00073737   -0.00769896   -0.00283133
   15
   -420.53616887
H   -2.57177142    0.45978029   -0.14794565    0.00730640    0.00086342   -0.00818127
O   -2.04600703    1.27787939    0.07285054   -0.01294692    0.01346274    0.00907478
O   -1.90234223   -1.21678775   -0.07036176   -0.01246930    0.00030880   -0.00210151
C   -0.79738823    0.78346144    0.03537478   -0.01165048    0.00944460    0.00154086
C   -0.73196879   -0.73538534    0.01672682    0.03314372    0.00950790    0.00739821
C    0.27943167    1.62308201   -0.07390574    0.00748059   -0.00224680   -0.01366212
C    0.41426072   -1.65318630    0.01934853    0.01383186   -0.02107077   -0.00430033
C    1.62356008    1.22397512   -0.01348812   -0.02592117    0.00715892    0.01090809
C    1.73322347   -1.33613523    0.01699532    0.00146311   -0.01725939   -0.00404558
H    0.09104597    2.70419570   -0.10432700    0.00109829    0.00743098    0.00203255
H    0.20025035   -2.70416516    0.05239627    0.01382884    0.00696859    0.00193938
H    2.27669416    2.09134225   -0.13886505   -0.00554859    0.00571809   -0.00490392
H    2.42865452   -2.16743285    0.01278341   -0.00432544   -0.00006625    0.00007688
C    2.26707871   -0.02208025    0.02582635   -0.00399574   -0.01184430    0.00775759
H    3.35154784   -0.02599072   -0.05422141   -0.00133307   -0.00838490   -0.00351481
   15
   -420.53575625
H   -2.57243778    0.47288685   -0.14715653    0.01039215    0.00423725   -0.00705006
O   -2.04649249    1.28282028    0.07265171   -0.01600583    0.01136117    0.00799256
O   -1.89932554   -1.22229966   -0.06928277   -0.00954773   -0.00043064   -0.00178534
C   -0.79866576    0.78144915    0.03686304   -0.01457179    0.00563709    0.00243930
C   -0.73417684   -0.73375690    0.01590301    0.03084873    0.01190501    0.00675051
C    0.28160522    1.62302906   -0.07606925    0.01265606    0.00165582   -0.01447860
C    0.41270530   -1.65320582    0.01749680    0.01144744   -0.02119614   -0.00442327
C    1.62512920    1.22433349   -0.01187625   -0.02401167    0.00621656    0.01071285
C    1.73303215   -1.33585801    0.01866268    0.00336658   -0.01625057   -0.00364338
H    0.08266375    2.70149480   -0.11005324    0.00003764    0.00687457    0.00186468
H    0.20307571   -2.70688012    0.04485387    0.01418468    0.00562884    0.00177426
H    2.26285158    2.10282784   -0.12937442   -0.00811867    0.00656859   -0.00430597
H    2.42756617   -2.16846299    0.01508001   -0.00427652   -0.00041740    0.00017462
C    2.26734544   -0.02267375    0.02586812   -0.00323444   -0.01294831    0.00812511
H    3.34827244   -0.03081862   -0.06741557   -0.00321815   -0.00885334   -0.00414295
   15
   -420.53538643
H   -2.57496527    0.48523997   -0.14509630    0.01275552    0.00698083   -0.00604693
O   -2.04679683    1.28763197    0.07236215   -0.01858248    0.00966345    0.00699065
O   -1.89620111   -1.22780687   -0.06818353   -0.00603001   -0.00087506   -0.00145134
C   -0.79972378    0.77935135    0.03831438   -0.01684851    0.00207415    0.00336271
C   -0.73685039   -0.73230796    0.01497726    0.02782986    0.01389102    0.00602861
C    0.28358850    1.62295044   -0.07801397    0.01697043    0.00609598   -0.01518280
C    0.41097640   -1.65290644    0.01571194    0.00935784   -0.02002982   -0.00451602
C    1.62706081    1.22459810   -0.01042625   -0.02164077    0.00507374    0.01042944
C    1.73279023   -1.33533572    0.02038508    0.00499901   -0.01473758   -0.00320227
H    0.07427343    2.69756719   -0.11611523   -0.00089272    0.00561565    0.00169040
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H    2.25046791    2.11313400   -0.11910937   -0.01050922    0.00722176   -0.00366314
H    2.42724248   -2.16941424    0.01734534   -0.00385946   -0.00104362    0.00026219
C    2.26766155   -0.02307160    0.02578716   -0.00288934   -0.01393922    0.00840758
H    3.34557054   -0.03405573   -0.07986420   -0.00470954   -0.00909847   -0.00473549
   15
   -420.53511196
H   -2.57977196    0.49635309   -0.14194345    0.01392695    0.00855861   -0.00533862
O   -2.04689117    1.29233317    0.07199305   -0.02027464    0.00894176    0.00624607
O   -1.89300880   -1.23330439   -0.06706785   -0.00195987   -0.00103384   -0.00109161
C   -0.80052802    0.77722177    0.03971486   -0.01834689   -0.00113063    0.00430000
C   -0.73994386   -0.73106849    0.01396042    0.02411695    0.01540990    0.00525877
C    0.28531638    1.62277928   -0.07972927    0.02029356    0.01081811   -0.01575722
C    0.40910566   -1.65230540    0.01399528    0.00754937   -0.01791885   -0.00454933
C    1.62931917    1.22478627   -0.00913388   -0.01891112    0.00372540    0.01007773
C    1.73247310   -1.33459104    0.02215585    0.00632713   -0.01286386   -0.00271816
H    0.06604154    2.69263685   -0.12248132   -0.00167692    0.00381430    0.00150687
H    0.20111415   -2.71484345    0.02884202    0.01339331   -0.00028476    0.00140729
H    2.23997136    2.12214218   -0.10818552   -0.01259984    0.00773054   -0.00299263
H    2.42760942   -2.17017455    0.01956362   -0.00315238   -0.00188418    0.00033839
C    2.26802200   -0.02325886    0.02557918   -0.00308120   -0.01479328    0.00862463
H    3.34370830   -0.03565816   -0.09146053   -0.00563060   -0.00912084   -0.00531515
   15
   -420.53498577
H   -2.58706422    0.50594797   -0.13782327    0.01360422    0.00859185   -0.00505314
O   -2.04675663    1.29693171    0.07155276   -0.02077506    0.00955514    0.00586079
O   -1.88979468   -1.23879043   -0.06593979    0.00258723   -0.00092616   -0.00071851
C   -0.80105590    0.77510873    0.04105034   -0.01899403   -0.00389069    0.00522906
C   -0.74340122   -0.73006141    0.01286413    0.01977804    0.01643883    0.00444289
C    0.28673871    1.62244449   -0.08120647    0.02255503    0.01553780   -0.01619755
C    0.40712047   -1.65143399    0.01234732    0.00599239   -0.01533663   -0.00450684
C    1.63186315    1.22491832   -0.00799379   -0.01594157    0.00219871    0.00966755
C    1.73206065   -1.33365215    0.02396766    0.00737383   -0.01077755   -0.00218608
H    0.05810888    2.68702619   -0.12911804   -0.00230862    0.00164082    0.00130447
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H    2.23173725    2.12976012   -0.09672300   -0.01430339    0.00814475   -0.00231240
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   15
   -420.53501974
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O   -2.04638760    1.30142059    0.07104566   -0.01998308    0.01155098    0.00583879
O   -1.88661025   -1.24426620   -0.06480360    0.00750839   -0.00057476   -0.00033524
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C    0.28782130    1.62187521   -0.08243892    0.02375294    0.01988675   -0.01648694
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C    1.63464799    1.22501733   -0.00699982   -0.01284457    0.00052220    0.00921055
C    1.73153698   -1.33255030    0.02581246    0.00818474   -0.00867491   -0.00160206
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H    2.42987539   -2.17050712    0.02380652   -0.00124786   -0.00371625    0.00045232
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H    3.34304347   -0.03398237   -0.11167713   -0.00549255   -0.00852204   -0.00650085
   15
   -420.53516492
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O   -1.88351122   -1.24973562   -0.06366362    0.01267797   -0.00002196    0.00004832
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C   -0.75113759   -0.72879888    0.01048302    0.00963850    0.01697748    0.00271347
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H    2.43143413   -2.16975419    0.02581064   -0.00026394   -0.00443317    0.00048853
C    2.26944180   -0.02244154    0.02416314   -0.00686246   -0.01626465    0.00902543
H    3.34421728   -0.03081114   -0.12008363   -0.00452222   -0.00793600   -0.00711964
   15
   -420.53541589
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O   -2.04499425    1.30996804    0.06982947   -0.01531897    0.01823080    0.00641061
O   -1.88055608   -1.25520493   -0.06252418    0.01794089    0.00070006    0.00041178
C   -0.80094679    0.76924674    0.04452899   -0.01607876   -0.00897540    0.00775908
C   -0.75526367   -0.72855162    0.00922432    0.00415534    0.01651623    0.00182161
C    0.28891001    1.61978281   -0.08415469    0.02318213    0.02609734   -0.01655623
C    0.40069859   -1.64757709    0.00780290    0.00237094   -0.00907471   -0.00390786
C    1.64075342    1.22521843   -0.00542206   -0.00672750   -0.00299799    0.00818175
C    1.73010959   -1.32998203    0.02956487    0.00932323   -0.00506457   -0.00027285
H    0.03714829    2.67000704   -0.15027961   -0.00365560   -0.00427774    0.00058938
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H    2.43304206   -2.16820721    0.02772702    0.00059564   -0.00488167    0.00051008
C    2.27009109   -0.02168470    0.02342040   -0.00874150   -0.01634240    0.00905043
H    3.34619951   -0.02621385   -0.12720849   -0.00315015   -0.00717054   -0.00773452
   15
   -420.53581965
H   -2.63601717    0.53286991   -0.11173927   -0.00015268   -0.00294280   -0.00657846
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O   -1.87780438   -1.26068217   -0.06138938    0.02312162    0.00148817    0.00075028
C   -0.80039502    0.76753715    0.04547016   -0.01377897   -0.00952617    0.00843868
C   -0.75945249   -0.72855363    0.00793808   -0.00136975    0.01563010    0.00092890
C    0.28892427    1.61816657   -0.08463701    0.02168303    0.02735027   -0.01630130
C    0.39846370   -1.64598180    0.00641123    0.00129590   -0.00844109   -0.00359723
C    1.64398172    1.22537357   -0.00482271   -0.00389585   -0.00468623    0.00761407
C    1.72918850   -1.32856985    0.03145240    0.00976368   -0.00383323    0.00046837
H    0.03137428    2.66544847   -0.15760738   -0.00399999   -0.00520380    0.00027148
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H    2.43454588   -2.16578672    0.02955177    0.00124969   -0.00497873    0.00051726
C    2.27087247   -0.02068102    0.02254092   -0.01055883   -0.01620361    0.00898751
H    3.34874663   -0.02032788   -0.13294152   -0.00160203   -0.00624919   -0.00830658
   15
   -420.53624811
H   -2.65009521    0.53934844   -0.10246657   -0.00442923   -0.00608495   -0.00683787
O   -2.04291081    1.31768956    0.06832350   -0.00930827    0.02463137    0.00672388
O   -1.87531471   -1.26617636   -0.06026306    0.02803715    0.00232352    0.00104899
C   -0.79963549    0.76597088    0.04628387   -0.01102668   -0.00950264    0.00900630
C   -0.76362085   -0.72879148    0.00663777   -0.00671316    0.01435004    0.00005038
C    0.28861159    1.61613850   -0.08487309    0.01946658    0.02719018   -0.01584901
C    0.39620918   -1.64425773    0.00507391    0.00023478   -0.00873865   -0.00326080
C    1.64726925    1.22559937   -0.00433846   -0.00132890   -0.00620371    0.00701885
C    1.72811982   -1.32709914    0.03333278    0.01015074   -0.00308627    0.00125681
H    0.02632181    2.66181564   -0.16498294   -0.00442265   -0.00533551   -0.00011657
H    0.14483411   -2.71862179   -0.02345801    0.00499541   -0.01320219   -0.00075548
H    2.23212178    2.14474027   -0.03566121   -0.01522042    0.00934722    0.00113725
H    2.43582789   -2.16247647    0.03128358    0.00167659   -0.00466930    0.00051096
C    2.27181315   -0.01943263    0.02152569   -0.01210714   -0.01584428    0.00880206
H    3.35158278   -0.01331877   -0.13718042   -0.00006847   -0.00519774   -0.00880901
   15
   -420.53678637
H   -2.66338522    0.54690961   -0.09196809   -0.00807139   -0.00830385   -0.00673867
O   -2.04169348    1.32114876    0.06745677   -0.00686977    0.02646944    0.00649666
O   -1.87314265   -1.27169689   -0.05914859    0.03249443    0.00310180    0.00129874
C   -0.79870966    0.76454763    0.04696157   -0.00793669   -0.00893273    0.00944654
C   -0.76768825   -0.72924594    0.00533667   -0.01164417    0.01277270   -0.00079836
C    0.28800526    1.61370106   -0.08486980    0.01668038    0.02560782   -0.01518019
C    0.39395113   -1.64240043    0.00378590   -0.00086949   -0.00994479   -0.00293024
C    1.65057722    1.22591864   -0.00396029    0.00094716   -0.00746012    0.00639874
C    1.72689772   -1.32558115    0.03519412    0.01047429   -0.00285204    0.00208277
H    0.02206606    2.65913168   -0.17233653   -0.00485417   -0.00465173   -0.00057524
H    0.13070023   -2.71190442   -0.03212819    0.00357576   -0.01181412   -0.00115187
H    2.24074112    2.14280842   -0.02356704   -0.01388962    0.00929637    0.00181930
H    2.43681179   -2.15833113    0.03292358    0.00184680   -0.00398620    0.00049169
C    2.27293615   -0.01794497    0.02037755   -0.01312106   -0.01525563    0.00847052
H    3.35443631   -0.00537598   -0.13983634    0.00119867   -0.00402706   -0.00917369
   15
   -420.53736018
H   -2.67523893    0.55595140   -0.08025978   -0.01068093   -0.00936360   -0.00632225
O   -2.04039748    1.32430899    0.06651661   -0.00524409    0.02699215    0.00598205
O   -1.87133861   -1.27725250   -0.05804882    0.03632304    0.00373582    0.00149801
C   -0.79766410    0.76325882    0.04749659   -0.00462345   -0.00785340    0.00975815
C   -0.77158029   -0.72989324    0.00404761   -0.01597955    0.01097078   -0.00161062
C    0.28714737    1.61087800   -0.08463721    0.01338306    0.02276681   -0.01432173
C    0.39170627   -1.64039178    0.00254222   -0.00204470   -0.01194740   -0.00262224
C    1.65387128    1.22635032   -0.00367886    0.00289438   -0.00838962    0.00576581
C    1.72551736   -1.32401944    0.03702393    0.01070477   -0.00310996    0.00293662
H    0.01868499    2.65727550   -0.17958507   -0.00529618   -0.00331234   -0.00110741
H    0.11592058   -2.70307540   -0.04059179    0.00224818   -0.00937091   -0.00149351
H    2.25185529    2.13920570   -0.01180026   -0.01215849    0.00904766    0.00249243
H    2.43746651   -2.15347332    0.03447523    0.00178643   -0.00295640    0.00046042
C    2.27425677   -0.01622692    0.01910155   -0.01351084   -0.01444169    0.00795926
H    3.35707919    0.00329072   -0.14084258    0.00209981   -0.00277766   -0.00941102
   15
   -420.53801584
H   -2.68518801    0.56665957   -0.06741753   -0.01204488   -0.00907163   -0.00559765
O   -2.03904107    1.32716433    0.06550884   -0.00464810    0.02610569    0.00520909
O   -1.86994588   -1.28285027   -0.05696597    0.03936364    0.00412926    0.00162929
C   -0.79654878    0.76208820    0.04788423   -0.00119365   -0.00632535    0.00994045
C   -0.77523169   -0.73070626    0.00278282   -0.01951037    0.00905294   -0.00236583
C    0.28608765    1.60771194   -0.08418828    0.00964300    0.01893196   -0.01330559
C    0.38949222   -1.63820188    0.00133822   -0.00320219   -0.01448230   -0.00234391
C    1.65712200    1.22690840   -0.00348461    0.00449992   -0.00894275    0.00513201
C    1.72397535   -1.32241021    0.03880932    0.01078448   -0.00377850    0.00381081
H    0.01625652    2.65600901   -0.18663306   -0.00567705   -0.00152625   -0.00172091
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H    2.26515354    2.13397686   -0.00048197   -0.01009794    0.00857965    0.00314689
H    2.43780263   -2.14808679    0.03594415    0.00153447   -0.00167014    0.00041848
C    2.27578077   -0.01429079    0.01770542   -0.01316288   -0.01340325    0.00726433
H    3.35935050    0.01245736   -0.14015708    0.00253609   -0.00149511   -0.00948532
   15
   -420.53860253
H   -2.69298890    0.57898090   -0.05357118   -0.01201827   -0.00740936   -0.00463336
O   -2.03763087    1.32972485    0.06444214   -0.00520840    0.02379489    0.00424595
O   -1.86899883   -1.28849462   -0.05590156    0.04149033    0.00422161    0.00170815
C   -0.79541549    0.76101276    0.04812171    0.00227925   -0.00441683    0.00999843
C   -0.77858924   -0.73165611    0.00155373   -0.02208536    0.00710628   -0.00305621
C    0.28488260    1.60426045   -0.08353832    0.00551444    0.01443777   -0.01216548
C    0.38732660   -1.63579289    0.00016968   -0.00435452   -0.01720653   -0.00209896
C    1.66030505    1.22760120   -0.00336798    0.00579438   -0.00908685    0.00451504
C    1.72227058   -1.32074341    0.04053708    0.01063345   -0.00478229    0.00469015
H    0.01485017    2.65501482   -0.19337250   -0.00595722    0.00044414   -0.00235983
H    0.08533108   -2.68097435   -0.05665873    0.00013582   -0.00235700   -0.00202921
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H    2.43786399   -2.14240177    0.03733788    0.00117394   -0.00023588    0.00036676
C    2.27750287   -0.01215232    0.01619970   -0.01206979   -0.01213085    0.00638544
H    3.36117266    0.02189300   -0.13776628    0.00245473   -0.00020075   -0.00939412
   15
   -420.53907077
H   -2.69864646    0.59261753   -0.03889270   -0.01059812   -0.00445560   -0.00352991
O   -2.03616053    1.33201665    0.06332737   -0.00694276    0.02016817    0.00318432
O   -1.86852151   -1.29418652   -0.05485648    0.04263299    0.00393613    0.00172943
C   -0.79431659    0.76000374    0.04820815    0.00570600   -0.00221828    0.00994486
C   -0.78161420   -0.73271349    0.00037075   -0.02357440    0.00523079   -0.00367668
C    0.28359456    1.60059103   -0.08270451    0.00106368    0.00965037   -0.01094717
C    0.38522665   -1.63312393   -0.00096710   -0.00538361   -0.01974997   -0.00187444
C    1.66340085    1.22843087   -0.00331966    0.00678691   -0.00880788    0.00392900
C    1.72040543   -1.31900407    0.04219395    0.01016062   -0.00597524    0.00556239
H    0.01451678    2.65394253   -0.19969028   -0.00610102    0.00230980   -0.00297025
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H    2.43771418   -2.13667446    0.03866573    0.00080363    0.00121026    0.00030579
C    2.27940659   -0.00983069    0.01459767   -0.01027487   -0.01063271    0.00533281
H    3.36255995    0.03136500   -0.13368622    0.00188577    0.00109033   -0.00914614
   15
   -420.53935416
H   -2.70241418    0.60704189   -0.02357888   -0.00794913   -0.00046537   -0.00240752
O   -2.03461048    1.33408069    0.06217648   -0.00970755    0.01548487    0.00213330
O   -1.86852686   -1.29992268   -0.05383096    0.04275781    0.00323195    0.00169772
C   -0.79330381    0.75902804    0.04814436    0.00900394    0.00016892    0.00978818
C   -0.78428411   -0.73385011   -0.00075674   -0.02392689    0.00349196   -0.00421785
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C    0.38320779   -1.63015708   -0.00207553   -0.00616819   -0.02166444   -0.00165252
C    1.66639433    1.22939328   -0.00333080    0.00752711   -0.00815273    0.00338965
C    1.71838717   -1.31717428    0.04376674    0.00927468   -0.00723385    0.00641862
H    0.01527854    2.65245939   -0.20547378   -0.00600495    0.00384154   -0.00357560
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H    2.31425346    2.10962621    0.02963455   -0.00279954    0.00552623    0.00487932
H    2.43741903   -2.13116324    0.03993863    0.00050651    0.00253845    0.00023682
C    2.28146503   -0.00734852    0.01291516   -0.00793868   -0.00891529    0.00414747
H    3.36361375    0.04064387   -0.12796108    0.00091016    0.00229369   -0.00875753
   15
   -420.53936401
H   -2.70476389    0.62153995   -0.00782951   -0.00444330    0.00415182   -0.00138465
O   -2.03294968    1.33596968    0.06100128   -0.01314776    0.01021144    0.00121398
O   -1.86901633   -1.30569509   -0.05282465    0.04188523    0.00210788    0.00161119
C   -0.79242690    0.75804968    0.04793268    0.01207761    0.00264138    0.00954778
C   -0.78659364   -0.73503979   -0.00182055   -0.02313281    0.00197185   -0.00467531
C    0.28104191    1.59288562   -0.08055921   -0.00845064    0.00051442   -0.00847509
C    0.38128175   -1.62686397   -0.00315900   -0.00659136   -0.02253186   -0.00140068
C    1.66927428    1.23047851   -0.00339325    0.00803206   -0.00713892    0.00290699
C    1.71622930   -1.31523519    0.04524252    0.00789892   -0.00842834    0.00724156
H    0.01711810    2.65029223   -0.21061451   -0.00566999    0.00485663   -0.00411890
H    0.03969179   -2.64632233   -0.07795581   -0.00301381    0.00765257   -0.00255376
H    2.33223119    2.09923194    0.03804767   -0.00028079    0.00396250    0.00533732
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C    2.28364304   -0.00473182    0.01117013   -0.00521437   -0.00698875    0.00283861
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   15
   -420.53914705
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O   -1.86998007   -1.31149103   -0.05183657    0.04008155    0.00056681    0.00147642
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   15
   -420.53877788
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O   -1.87139772   -1.31729307   -0.05086520    0.03746629   -0.00135459    0.00130578
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   15
   -420.53829142
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O   -1.87323977   -1.32307943   -0.04990861    0.03418825   -0.00360405    0.00109967
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C    1.67716923    1.23429794   -0.00382132    0.00859819   -0.00264459    0.00192201
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   15
   -420.53779597
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C   -0.79112110    0.75338255    0.04569288    0.01997682    0.01108751    0.00809744
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C    1.67954299    1.23568369   -0.00402773    0.00857799   -0.00092706    0.00176003
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   15
   -420.53733324
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O   -1.87804326   -1.33450074   -0.04803010    0.02629906   -0.00872763    0.00060582
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   15
   -420.53687261
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C   -0.79217404    0.75016705    0.04381480    0.01978499    0.01301592    0.00733264
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C    1.68390297    1.23847201   -0.00451940    0.00833303    0.00234541    0.00166948
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H    0.04468146    2.62112618   -0.22384017    0.00021310   -0.00200017   -0.00510995
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   15
   -420.53644293
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O   -1.88403757   -1.34552505   -0.04617884    0.01774685   -0.01412579    0.00004112
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C   -0.79551272   -0.74347230   -0.00707320    0.00507836   -0.00065001   -0.00537979
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C    1.68589291    1.23982529   -0.00480329    0.00810347    0.00376948    0.00172956
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C    2.29899579    0.01461658   -0.00105950    0.00544221    0.00975063   -0.00700846
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   15
   -420.53601756
H   -2.72534886    0.67082312    0.11895170   -0.00948247    0.00248702    0.00272181
O   -2.01284164    1.34991101    0.05147765   -0.00106117    0.00883463   -0.00163374
O   -1.88736109   -1.35081223   -0.04525553    0.01360228   -0.01671279   -0.00025388
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   15
   -420.53575303
H   -2.72620442    0.66947567    0.13367435   -0.01272300   -0.00096813    0.00362684
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C    0.28313328    1.56179536   -0.06624637   -0.03235687   -0.00752165   -0.00166948
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C    1.69597852   -1.29089233    0.05238404   -0.01487678   -0.01129203    0.01177053
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C    2.30277478    0.01938185   -0.00391909    0.00289692    0.01430543   -0.00987195
H    3.39196322    0.08359352   -0.00170922    0.00166721    0.00792462   -0.00183294
   15
   -420.53568362
H   -2.72478876    0.66828887    0.14774431   -0.01462552   -0.00346697    0.00450430
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O   -1.89442747   -1.36079088   -0.04339690    0.00613450   -0.02133729   -0.00084827
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C    1.69114866    1.24347675   -0.00581987    0.00685193    0.00651432    0.00220569
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C    2.30458789    0.02145698   -0.00513586    0.00123049    0.01627715   -0.01131775
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   15
   -420.53590007
H   -2.72076333    0.66770923    0.16100526   -0.01493102   -0.00478722    0.00524339
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O   -1.89808578   -1.36542998   -0.04245485    0.00297755   -0.02326949   -0.00113864
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C   -0.80066689   -0.74812436   -0.00830357    0.02366370    0.00239534   -0.00396610
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C    1.69268362    1.24451164   -0.00622168    0.00617526    0.00681617    0.00243536
C    1.69301844   -1.28362641    0.05214609   -0.01580273   -0.01164704    0.01191046
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C    2.30638240    0.02328636   -0.00618153   -0.00042358    0.01796439   -0.01274302
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   15
   -420.53638687
H   -2.71407422    0.66797318    0.17332588   -0.01356005   -0.00484740    0.00573111
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O   -1.90177830   -1.36980540   -0.04149989    0.00028916   -0.02490878   -0.00142184
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C   -0.80268819   -0.74934537   -0.00844543    0.02698759    0.00336633   -0.00345226
C    0.29191597    1.55370191   -0.06071549   -0.02344140   -0.00706848   -0.00008141
C    0.36280365   -1.57264653   -0.01622011   -0.00311351    0.01081624    0.00147423
C    1.69412542    1.24544390   -0.00666035    0.00533825    0.00676812    0.00268804
C    1.69189479   -1.27973082    0.05175737   -0.01518010   -0.01190814    0.01186857
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H   -0.01392880   -2.59914864   -0.10748742   -0.01366764   -0.00060539   -0.00450424
H    2.45533274    2.01937111    0.05586761    0.01289763   -0.01393954    0.00462320
H    2.39955640   -2.11297550    0.05775299    0.00410377   -0.00024919   -0.00050797
C    2.30818306    0.02484456   -0.00703461   -0.00188293    0.01929813   -0.01411032
H    3.40332822    0.07070701    0.04894612    0.00600963    0.00612540    0.00120372
   15
   -420.53707584
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   15
   -420.53785361
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   15
   -420.53857099
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   15
   -420.53915366
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   15
   -420.53957536
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   15
   -420.53985170
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   15
   -420.54000726
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   15
   -420.54009629
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   15
   -420.54003130
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   15
   -420.53977438
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   15
   -420.53926749
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O   -1.94028319   -1.39777830   -0.02931622    0.00544352   -0.02308159   -0.00384516
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   15
   -420.53855855
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C   -0.85986555   -0.77180810   -0.00882324   -0.00215965    0.00753285    0.00441636
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H    2.31069723   -2.11671792    0.08463413   -0.00472137   -0.00546460    0.00037346
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   15
   -420.53772597
H   -2.63489747    0.64371796    0.25155873   -0.00179550   -0.00985065    0.00899975
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C   -0.80260431    0.70548104    0.00745253   -0.02557383   -0.01167383    0.00211894
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   15
   -420.53693207
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O   -1.95097120   -1.39936467   -0.02520372    0.01369093   -0.01826062   -0.00417496
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C    0.34143256    1.52656379   -0.03661777    0.02825296    0.01209437    0.00017538
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H    2.30557103   -2.11135385    0.08921446   -0.00460927   -0.00652705    0.00076511
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   15
   -420.53620758
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O   -1.95480349   -1.39945434   -0.02373953    0.01604012   -0.01664938   -0.00421689
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C   -0.87844086   -0.78021589   -0.00974067   -0.02222903    0.00240499    0.00611138
C    0.34275536    1.52435150   -0.03502374    0.02762261    0.01260982   -0.00005597
C    0.35712047   -1.52320713   -0.03313055    0.00011939    0.02178612   -0.00463392
C    1.71505957    1.25548050   -0.02049311   -0.00171030   -0.00237050    0.00527435
C    1.68798115   -1.20596785    0.02741339    0.00391456    0.01589387    0.00226909
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H    2.30425693   -2.10694870    0.09131550   -0.00465797   -0.00641975    0.00095956
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   15
   -420.53565355
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O   -1.95881735   -1.39935501   -0.02222754    0.01794657   -0.01516421   -0.00422262
C   -0.79307798    0.70232589   -0.00038507   -0.01225108   -0.00590416   -0.00004175
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C    0.34366119    1.52194997   -0.03342887    0.02644748    0.01197068   -0.00027910
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C    1.71679838    1.25645883   -0.02204036   -0.00075329   -0.00082197    0.00489790
C    1.68764840   -1.20141499    0.02499896    0.00403929    0.01760325    0.00116705
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C    2.34376966    0.02015098    0.01426824   -0.01235582   -0.02257718   -0.01219911
H    3.41432343   -0.04099250    0.20653881   -0.00096907   -0.00621205    0.00791077
   15
   -420.53528934
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O   -1.96303425   -1.39908348   -0.02066768    0.01927264   -0.01388354   -0.00419327
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C    0.34416779    1.51936883   -0.03182977    0.02473553    0.01019599   -0.00051204
C    0.35805847   -1.52050417   -0.03460437    0.00372040    0.01922645   -0.00515266
C    1.71854866    1.25744942   -0.02366153    0.00014785    0.00086026    0.00440688
C    1.68725471   -1.19712750    0.02256687    0.00402590    0.01866446    0.00006789
H    0.07476762    2.56747606   -0.00041144    0.00099692   -0.00435485    0.00191418
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   15
   -420.53508942
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C   -0.89404374   -0.78893993   -0.01148534   -0.03770544   -0.00367400    0.00741553
C    0.34430100    1.51663479   -0.03022290    0.02249265    0.00740925   -0.00076492
C    0.35845628   -1.51960028   -0.03522626    0.00530187    0.01689311   -0.00530589
C    1.72029683    1.25842706   -0.02534920    0.00092856    0.00251414    0.00381095
C    1.68680036   -1.19312147    0.02013375    0.00381570    0.01910466   -0.00103199
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H    2.30544403   -2.08731772    0.09645480   -0.00510319   -0.00353520    0.00146184
C    2.34997371    0.02062680    0.02121194   -0.01337099   -0.02902008   -0.00915467
H    3.42579620   -0.04168067    0.20377129    0.00179976   -0.00604290    0.00769309
   15
   -420.53497180
H   -2.63424559    0.65783613    0.21908346    0.00366499   -0.00011980    0.00525599
O   -1.96191910    1.35131966    0.03782958    0.00215768    0.00819647   -0.00460030
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C   -0.78192347    0.69994505   -0.00821733    0.00452370    0.00240789   -0.00217474
C   -0.89819819   -0.79177736   -0.01228304   -0.04094176   -0.00548818    0.00772898
C    0.34409456    1.51378964   -0.02860443    0.01976307    0.00386236   -0.00104403
C    0.35877415   -1.51895132   -0.03576802    0.00670020    0.01419033   -0.00537886
C    1.72203117    1.25936697   -0.02709435    0.00152652    0.00395658    0.00311487
C    1.68628862   -1.18940362    0.01771623    0.00334762    0.01897891   -0.00212686
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H    2.30763759   -2.07921074    0.09767913   -0.00520874   -0.00197481    0.00160521
C    2.35337673    0.02149947    0.02490337   -0.01257629   -0.03122862   -0.00732853
H    3.43116330   -0.04038443    0.20029629    0.00257271   -0.00579414    0.00736346
   15
   -420.53492704
H   -2.63390554    0.66373971    0.20917295    0.00692724    0.00421669    0.00396093
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O   -1.97701232   -1.39736372   -0.01570609    0.01877727   -0.01195061   -0.00390537
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C   -0.90173504   -0.79453210   -0.01319751   -0.04301299   -0.00707277    0.00796520
C    0.34358991    1.51088668   -0.02697016    0.01649570   -0.00013897   -0.00132548
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C    1.72374271    1.26024750   -0.02888651    0.00189554    0.00504719    0.00233773
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H    2.22904989    2.21718532   -0.08245764   -0.01753396    0.00541176   -0.00389639
H    2.31076692   -2.07074895    0.09861445   -0.00518367   -0.00035329    0.00174985
C    2.35696871    0.02284340    0.02870540   -0.01082977   -0.03265460   -0.00531419
H    3.43607502   -0.03804655    0.19549811    0.00282604   -0.00544921    0.00688665
   15
   -420.53497067
H   -2.63480166    0.66889320    0.19854548    0.00947997    0.00791789    0.00292256
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O   -1.98210782   -1.39651306   -0.01396186    0.01695422   -0.01207557   -0.00374187
C   -0.77468594    0.69824698   -0.01329284    0.01614365    0.00839737   -0.00342105
C   -0.90462303   -0.79718023   -0.01423232   -0.04385767   -0.00838204    0.00811665
C    0.34283635    1.50798594   -0.02531580    0.01277705   -0.00424251   -0.00160835
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C    1.72542588    1.26105231   -0.03071392    0.00201394    0.00565598    0.00148912
C    1.68512682   -1.18281858    0.01299418    0.00133776    0.01752324   -0.00432132
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H    2.23218253    2.21678213   -0.08554764   -0.01701692    0.00495045   -0.00391962
H    2.31482641   -2.06222251    0.09923487   -0.00495480    0.00119457    0.00189574
C    2.36072334    0.02468005    0.03258759   -0.00821633   -0.03322694   -0.00314845
H    3.44048543   -0.03472842    0.18946240    0.00258287   -0.00502791    0.00627507
   15
   -420.53516993
H   -2.63738380    0.67264021    0.18738610    0.01062580    0.01030190    0.00228115
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O   -1.98739489   -1.39552505   -0.01217521    0.01432421   -0.01258844   -0.00354102
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C   -0.90684937   -0.79970198   -0.01538973   -0.04348927   -0.00939022    0.00817355
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C    1.72707887    1.26177231   -0.03256378    0.00188712    0.00570121    0.00058035
C    1.68450725   -1.17992976    0.01072285   -0.00027573    0.01649148   -0.00543183
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C    2.36460121    0.02701801    0.03651720   -0.00481856   -0.03290333   -0.00086857
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   15
   -420.53554777
H   -2.64185144    0.67455796    0.17581015    0.00988984    0.01092622    0.00206654
O   -1.95745939    1.34381642    0.03905349   -0.01025588   -0.00525936   -0.00084840
O   -1.99284378   -1.39439392   -0.01034845    0.01095524   -0.01345649   -0.00329553
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C   -0.90841961   -0.80208212   -0.01667059   -0.04193405   -0.01009411    0.00812488
C    0.34081321    1.50243506   -0.02193062    0.00429008   -0.01158602   -0.00202753
C    0.35886540   -1.51813959   -0.03712430    0.01050165    0.00761351   -0.00523816
C    1.72870362    1.26240677   -0.03442235    0.00152332    0.00518887   -0.00037732
C    1.68389233   -1.17729026    0.00853365   -0.00229020    0.01543821   -0.00655063
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C    2.36855130    0.02985233    0.04045985   -0.00087936   -0.03166902    0.00148693
H    3.44805202   -0.02546082    0.17413623    0.00093089   -0.00403717    0.00477948
   15
   -420.53606471
H   -2.64807136    0.67453485    0.16385692    0.00722491    0.00976515    0.00219965
O   -1.95610440    1.34202884    0.03940036   -0.00887638   -0.00454752   -0.00086249
O   -1.99841637   -1.39310989   -0.00848434    0.00695658   -0.01461223   -0.00299985
C   -0.76585301    0.69464693   -0.02050031    0.03114243    0.01618976   -0.00486376
C   -0.90935714   -0.80430998   -0.01807417   -0.03928652   -0.01051461    0.00796284
C    0.33967156    1.49989530   -0.02019350   -0.00019197   -0.01429373   -0.00211271
C    0.35852130   -1.51825769   -0.03726349    0.01102512    0.00859364   -0.00520865
C    1.73030554    1.26296341   -0.03627515    0.00097977    0.00414560   -0.00138128
C    1.68331247   -1.17488429    0.00644349   -0.00464526    0.01447794   -0.00767036
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H    2.25898605    2.21030891   -0.09060218   -0.01196519    0.00503349   -0.00378176
H    2.33192472   -2.03880998    0.09893250   -0.00258883    0.00415544    0.00242480
C    2.37251434    0.03316441    0.04438004    0.00335281   -0.02955416    0.00383795
H    3.45150112   -0.01969049    0.16511364   -0.00018416   -0.00349306    0.00399262
   15
   -420.53660474
H   -2.65556990    0.67277474    0.15150494    0.00304705    0.00719438    0.00250219
O   -1.95465031    1.34029150    0.03975717   -0.00577531   -0.00235427   -0.00106058
O   -2.00406741   -1.39165992   -0.00658625    0.00246071   -0.01597753   -0.00264845
C   -0.76375629    0.69300621   -0.02276461    0.03472624    0.01802067   -0.00521293
C   -0.90970185   -0.80637916   -0.01959799   -0.03567120   -0.01068007    0.00767984
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   15
   -420.53706472
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   15
   -420.53736346
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   15
   -420.53741557
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   15
   -420.53728005
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   15
   -420.53700131
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C    1.73993030    1.26587818   -0.04638320   -0.00136527   -0.00643431   -0.00801741
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   15
   -420.53666260
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C    1.74159504    1.26654658   -0.04774335   -0.00083327   -0.00784284   -0.00912873
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   15
   -420.53627605
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   15
   -420.53583185
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O   -2.04560168   -1.37218785    0.00920287   -0.03371629   -0.02471207    0.00213682
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   15
   -420.53529546
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   15
   -420.53463065
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O   -2.05308898   -1.36468826    0.01306349   -0.03849255   -0.02439154    0.00362991
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   15
   -420.53385904
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O   -2.05619031   -1.36052202    0.01493627   -0.03984653   -0.02379063    0.00436692
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C    0.33912009    1.48592235    0.00176399   -0.00857397   -0.00563419    0.00344078
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C    1.74974339    1.27193313   -0.05216385    0.00680737   -0.01065623   -0.01382475
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C    2.40398490    0.08872696    0.07817611    0.01814219    0.03096688    0.02316762
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   15
   -420.53307220
H   -2.64433043    0.64866786   -0.02257812    0.00846684    0.01006918   -0.00197313
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O   -2.05884028   -1.35608625    0.01675955   -0.04049571   -0.02288125    0.00507985
C   -0.77753696    0.65441650   -0.04292581   -0.00595891   -0.00954375   -0.00754964
C   -0.89438755   -0.82026456   -0.04394585    0.02056883   -0.00337237   -0.00359399
C    0.34050599    1.48563585    0.00345476   -0.00500620   -0.00603905    0.00395221
C    0.34253676   -1.54336386   -0.03236046   -0.01210424    0.00512328   -0.00102100
C    1.75117517    1.27347844   -0.05247235    0.00877045   -0.01060901   -0.01451753
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   15
   -420.53236639
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   15
   -420.53182535
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   15
   -420.53151173
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C    1.69771175   -1.15986616   -0.00361031    0.00484893    0.00657629   -0.01027190
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   15
   -420.53141131
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C   -0.89385398   -0.82223585   -0.05180759    0.01847032    0.00023794   -0.00834602
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   15
   -420.53151748
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O   -2.06534747   -1.33032427    0.02486254   -0.03324423   -0.01466868    0.00809383
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C    1.75587205    1.28357649   -0.05056434    0.01438685   -0.00998319   -0.01656543
C    1.70127453   -1.16018193   -0.00154306    0.00922964    0.00870424   -0.00823726
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H    2.36558138   -2.02054461    0.00537280   -0.00151108    0.00218573   -0.00045970
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   15
   -420.53177544
H   -2.63320202    0.60106867   -0.09835899   -0.00169450   -0.00475917   -0.00711001
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O   -2.06541597   -1.32458572    0.02623253   -0.02997310   -0.01237787    0.00852173
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   15
   -420.53218818
H   -2.63353692    0.59238443   -0.10767779   -0.00432380   -0.00758488   -0.00815852
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C    1.75631014    1.28868402   -0.04808221    0.01406564   -0.00908800   -0.01666836
C    1.70428665   -1.16102993    0.00102059    0.01213417    0.01196599   -0.00584930
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C    2.40225699    0.10044213    0.07574871    0.02067814    0.03732347    0.02265658
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   15
   -420.53270376
H   -2.63310857    0.58505158   -0.11553140   -0.00593738   -0.00938755   -0.00895672
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O   -2.06457614   -1.31271600    0.02867866   -0.02221372   -0.00726186    0.00915090
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C    1.70552777   -1.16171247    0.00244427    0.01319731    0.01369147   -0.00455158
H    0.03590015    2.53206821    0.07579281   -0.00129062    0.00226640    0.00141200
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C    2.40067004    0.09919397    0.07383806    0.01980589    0.03388940    0.02188987
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   15
   -420.53332602
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C    1.75590121    1.29433382   -0.04459448    0.01302051   -0.00673267   -0.01626913
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   15
   -420.53400609
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O   -2.06273194   -1.30051886    0.03071091   -0.01352453   -0.00161905    0.00944281
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C    1.75539722    1.29732116   -0.04247988    0.01246178   -0.00478105   -0.01585574
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C    2.39662269    0.09522635    0.06903765    0.01624609    0.02489656    0.02000075
H    3.47658837    0.10377014   -0.00844482   -0.00295747    0.00561901   -0.00466945
   15
   -420.53477669
H   -2.62540446    0.57334158   -0.12918271   -0.00381174   -0.00768053   -0.00919789
O   -1.94034767    1.28662054    0.04249041    0.02025537    0.01351997    0.01178450
O   -2.06155481   -1.29437653    0.03156708   -0.00912976    0.00126744    0.00946738
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C   -0.90084241   -0.82586869   -0.06020464   -0.01414803   -0.00099681   -0.01394852
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C    1.75470470    1.30038015   -0.04012571    0.01197499   -0.00226652   -0.01529623
C    1.70800108   -1.16509098    0.00704658    0.01569870    0.01735990   -0.00049870
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C    2.39421583    0.09264251    0.06617647    0.01378106    0.01962941    0.01886346
H    3.47650886    0.10123255   -0.00720468   -0.00159198    0.00554342   -0.00444539
   15
   -420.53553160
H   -2.62111809    0.57252415   -0.13038198   -0.00101976   -0.00483731   -0.00853438
O   -1.94158688    1.28314274    0.04163236    0.01626162    0.00998071    0.01118758
O   -2.06027400   -1.28824851    0.03231591   -0.00487700    0.00410986    0.00942231
C   -0.78307457    0.63414126   -0.04641634   -0.03515642   -0.02949336   -0.00929948
C   -0.90164175   -0.82640984   -0.06063851   -0.01978805   -0.00230434   -0.01439197
C    0.35088264    1.48793651    0.01641076    0.01509073    0.00536914    0.01079414
C    0.34621709   -1.58158768   -0.02537413   -0.01129460   -0.00244117    0.00595681
C    1.75383099    1.30347272   -0.03754047    0.01160471    0.00081434   -0.01458455
C    1.70836671   -1.16672210    0.00862307    0.01642480    0.01764038    0.00081545
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H    2.35680883   -2.04948926   -0.04342095   -0.00169206   -0.00613620   -0.00366082
C    2.39160084    0.08976224    0.06303026    0.01111235    0.01406933    0.01757888
H    3.47671182    0.09769818   -0.00516487    0.00005798    0.00538314   -0.00417400
   15
   -420.53621263
H   -2.61665719    0.57256586   -0.13004871    0.00239341   -0.00120674   -0.00759528
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O   -2.05893761   -1.28216702    0.03295793   -0.00091170    0.00684653    0.00932365
C   -0.78004338    0.63537294   -0.04579580   -0.03192509   -0.02719010   -0.00907726
C   -0.90214220   -0.82691593   -0.06085488   -0.02517642   -0.00379238   -0.01474603
C    0.35046262    1.48808345    0.01659951    0.01472977    0.00477189    0.01088755
C    0.34804398   -1.58418154   -0.02518736   -0.00990331   -0.00280673    0.00631183
C    1.75278167    1.30655236   -0.03473489    0.01136364    0.00440365   -0.01372524
C    1.70848413   -1.16861922    0.01018732    0.01706767    0.01732322    0.00206928
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H    2.35662395   -2.05034217   -0.04839394   -0.00213210   -0.00591974   -0.00400734
C    2.38881781    0.08666937    0.05961845    0.00847077    0.00839873    0.01613682
H    3.47690332    0.09319600   -0.00237461    0.00177760    0.00513127   -0.00383611
   15
   -420.53679550
H   -2.61262932    0.57281899   -0.12834980    0.00594407    0.00282226   -0.00651588
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O   -2.05759049   -1.27616302    0.03349420    0.00262332    0.00939340    0.00919117
C   -0.77653058    0.63701502   -0.04503809   -0.02778596   -0.02431151   -0.00879105
C   -0.90226251   -0.82736456   -0.06084840   -0.03012496   -0.00537825   -0.01502267
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C    0.35002057   -1.58673202   -0.02509588   -0.00847645   -0.00393403    0.00655851
C    1.75156037    1.30956490   -0.03172196    0.01124500    0.00840336   -0.01272552
C    1.70834368   -1.17077752    0.01172038    0.01756918    0.01638806    0.00324076
H    0.03523648    2.52161938    0.02943675    0.00195254   -0.00634816   -0.00135049
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H    2.34249989    2.23233569   -0.03926581    0.00149239    0.00618070    0.00064729
H    2.35682489   -2.05013581   -0.05264649   -0.00270803   -0.00525561   -0.00429512
C    2.38590637    0.08344945    0.05596285    0.00608107    0.00279175    0.01453485
H    3.47677693    0.08777134    0.00110528    0.00334747    0.00478427   -0.00342443
   15
   -420.53718819
H   -2.60966490    0.57256744   -0.12547703    0.00901827    0.00663584   -0.00548028
O   -1.94617742    1.27223798    0.03833934    0.00054052   -0.00392580    0.00827885
O   -2.05627262   -1.27026535    0.03392624    0.00559538    0.01168802    0.00904230
C   -0.77259873    0.63902403   -0.04414752   -0.02276086   -0.02090297   -0.00845087
C   -0.90192807   -0.82773190   -0.06061486   -0.03446699   -0.00696445   -0.01522904
C    0.34896304    1.48819137    0.01648390    0.01348158    0.00016743    0.01074381
C    0.35212554   -1.58922218   -0.02510342   -0.00707170   -0.00572189    0.00669850
C    1.75016893    1.31245007   -0.02851678    0.01121511    0.01266895   -0.01159356
C    1.70793787   -1.17318286    0.01320454    0.01784442    0.01486500    0.00432189
H    0.03427000    2.52310799    0.02214697    0.00184650   -0.00550752   -0.00167028
H    0.20984483   -2.67792400   -0.07668304    0.00037807   -0.00719259   -0.00233721
H    2.32610909    2.24273858   -0.03977848   -0.00092368    0.00661621    0.00035687
H    2.35751453   -2.04898913   -0.05612707   -0.00336505   -0.00420790   -0.00450658
C    2.38290246    0.08018702    0.05208768    0.00412583   -0.00257433    0.01277454
H    3.47605278    0.08148681    0.00520079    0.00458663    0.00434165   -0.00294328
   15
   -420.53745719
H   -2.60830744    0.57113362   -0.12161454    0.01094721    0.00959480   -0.00465986
O   -1.94780146    1.26862022    0.03703844   -0.00396914   -0.00775313    0.00746227
O   -2.05501758   -1.26449998    0.03425561    0.00786845    0.01366955    0.00896599
C   -0.76832375    0.64134855   -0.04312923   -0.01690298   -0.01703314   -0.00806453
C   -0.90107347   -0.82799405   -0.06015114   -0.03801807   -0.00847283   -0.01537164
C    0.34790246    1.48822177    0.01618167    0.01249888   -0.00365293    0.01053992
C    0.35433732   -1.59162527   -0.02521209   -0.00555094   -0.00797058    0.00671945
C    1.74860786    1.31514362   -0.02513646    0.01122411    0.01700824   -0.01034338
C    1.70726268   -1.17581234    0.01462346    0.01778447    0.01284345    0.00530649
H    0.03297409    2.52557854    0.01515760    0.00153609   -0.00400893   -0.00196942
H    0.22177967   -2.67653166   -0.08114231    0.00195789   -0.00426897   -0.00239190
H    2.30988525    2.25195558   -0.04035535   -0.00341750    0.00667594    0.00006435
H    2.35880982   -2.04708853   -0.05879732   -0.00401827   -0.00291157   -0.00465583
C    2.37983545    0.07696306    0.04801954    0.00275135   -0.00755087    0.01087301
H    3.47451008    0.07442230    0.00982523    0.00535351    0.00380190   -0.00239875
   15
   -420.53761254
H   -2.60889633    0.56799323   -0.11690817    0.01119780    0.01113240   -0.00418178
O   -1.94938175    1.26508910    0.03565259   -0.00708329   -0.01015493    0.00697192
O   -2.05385105   -1.25888933    0.03448347    0.00932534    0.01529985    0.00883393
C   -0.76379409    0.64393013   -0.04198905   -0.01031987   -0.01277580   -0.00764426
C   -0.89964520   -0.82812829   -0.05945508   -0.04062884   -0.00982327   -0.01545281
C    0.34665329    1.48830821    0.01572015    0.01119126   -0.00814822    0.01026538
C    0.35663287   -1.59390766   -0.02542223   -0.00389568   -0.01037945    0.00663649
C    1.74687713    1.31758013   -0.02159988    0.01119491    0.02122352   -0.00898844
C    1.70631917   -1.17863556    0.01596227    0.01726661    0.01044884    0.00619788
H    0.03140355    2.52876467    0.00852257    0.00108845   -0.00208788   -0.00225295
H    0.23336200   -2.67437751   -0.08517192    0.00353606   -0.00088267   -0.00237868
H    2.29427602    2.25997460   -0.04094365   -0.00587076    0.00646931   -0.00022777
H    2.36082699   -2.04466516   -0.06063097   -0.00456475   -0.00150698   -0.00474651
C    2.37672603    0.07385262    0.04378714    0.00203040   -0.01199763    0.00885328
H    3.47201188    0.06667475    0.01488075    0.00556919    0.00316966   -0.00180460
   15
   -420.53767352
H   -2.61147319    0.56287343   -0.11144367    0.00954227    0.01098125   -0.00407031
O   -1.95088327    1.26167163    0.03418735   -0.00850439   -0.01086507    0.00683059
O   -2.05278949   -1.25345187    0.03461112    0.00989218    0.01654300    0.00872358
C   -0.75910907    0.64670452   -0.04073332   -0.00317883   -0.00822952   -0.00720202
C   -0.89760392   -0.82811425   -0.05852546   -0.04217297   -0.01096689   -0.01547352
C    0.34523536    1.48851825    0.01510351    0.00951458   -0.01297785    0.00993061
C    0.35898710   -1.59603337   -0.02573261   -0.00206233   -0.01256196    0.00647250
C    1.74497725    1.31969617   -0.01792752    0.01105653    0.02509156   -0.00753394
C    1.70511528   -1.18161650    0.01720746    0.01617768    0.00783756    0.00700456
H    0.02963797    2.53232481    0.00229289    0.00057819   -0.00003320   -0.00251902
H    0.24430893   -2.67206474   -0.08877383    0.00503852    0.00254200   -0.00232079
H    2.27972088    2.26683091   -0.04149095   -0.00815508    0.00613704   -0.00051664
H    2.36366309   -2.04196949   -0.06161093   -0.00490236   -0.00015893   -0.00479041
C    2.37358513    0.07092281    0.03942099    0.00196940   -0.01580431    0.00674420
H    3.46851919    0.05835772    0.02026075    0.00522675    0.00245672   -0.00118282
   15
   -420.53767058
H   -2.61574319    0.55579974   -0.10524205    0.00617323    0.00925462   -0.00425254
O   -1.95228978    1.25837595    0.03264442   -0.00833351   -0.00996088    0.00695843
O   -2.05183929   -1.24820169    0.03463990    0.00951437    0.01740891    0.00856370
C   -0.75437645    0.64960312   -0.03936870    0.00431286   -0.00351100   -0.00675282
C   -0.89492641   -0.82793473   -0.05736196   -0.04255723   -0.01185337   -0.01543243
C    0.34367404    1.48892451    0.01433680    0.00745483   -0.01781030    0.00953167
C    0.36137229   -1.59796995   -0.02614083   -0.00002450   -0.01409342    0.00625004
C    1.74291041    1.32143356   -0.01414135    0.01073949    0.02838194   -0.00599793
C    1.70366760   -1.18471589    0.01834683    0.01441843    0.00517408    0.00774283
H    0.02776806    2.53589307   -0.00348366    0.00008446    0.00187356   -0.00276002
H    0.25435136   -2.67020439   -0.09195807    0.00638869    0.00557672   -0.00227124
H    2.26662943    2.27258217   -0.04194529   -0.01014746    0.00582121   -0.00080241
H    2.36737726   -2.03924194   -0.06172888   -0.00493162    0.00096625   -0.00480763
C    2.37041370    0.06823108    0.03495294    0.00252167   -0.01890039    0.00458139
H    3.46409308    0.04959948    0.02585359    0.00436818    0.00166678   -0.00055387
   15
   -420.53757695
H   -2.62110903    0.54707723   -0.09827271    0.00166358    0.00639024   -0.00457403
O   -1.95360280    1.25519231    0.03102244   -0.00701609   -0.00792465    0.00722612
O   -2.05099615   -1.24314872    0.03457142    0.00820335    0.01793906    0.00849329
C   -0.74970919    0.65255479   -0.03790197    0.01189946    0.00123099   -0.00631197
C   -0.89160697   -0.82757634   -0.05596522   -0.04172442   -0.01247114   -0.01532511
C    0.34200042    1.48959965    0.01342607    0.00505264   -0.02230763    0.00906953
C    0.36375762   -1.59969474   -0.02664359    0.00222976   -0.01456706    0.00600633
C    1.74068150    1.32274272   -0.01026458    0.01017520    0.03092871   -0.00438926
C    1.70200281   -1.18789358    0.01936923    0.01193620    0.00259828    0.00841068
H    0.02588181    2.53912979   -0.00876387   -0.00033034    0.00338484   -0.00296468
H    0.26324648   -2.66933579   -0.09473535    0.00756958    0.00774997   -0.00221665
H    2.25535943    2.27728327   -0.04225517   -0.01176965    0.00565576   -0.00108989
H    2.37197395   -2.03668357   -0.06098166   -0.00458768    0.00176412   -0.00480314
C    2.36720352    0.06582417    0.03041566    0.00357239   -0.02122331    0.00239680
H    3.45888674    0.04054176    0.03154633    0.00309522    0.00082285    0.00006124
   15
   -420.53745174
H   -2.62676795    0.53721078   -0.09048058   -0.00330289    0.00308876   -0.00485776
O   -1.95483672    1.25209807    0.02931853   -0.00516271   -0.00532958    0.00745897
O   -2.05024527   -1.23829894    0.03440659    0.00599855    0.01811005    0.00842971
C   -0.74522159    0.65548801   -0.03633978    0.01928371    0.00583689   -0.00588892
C   -0.88765817   -0.82702969   -0.05433685   -0.03968026   -0.01282399   -0.01514789
C    0.34025073    1.49061130    0.01237827    0.00239580   -0.02616890    0.00854904
C    0.36610898   -1.60120090   -0.02723715    0.00469080   -0.01370120    0.00576958
C    1.73829910    1.32358534   -0.00632153    0.00932445    0.03258869   -0.00271996
C    1.70015839   -1.19111083    0.02026454    0.00875168    0.00024084    0.00902557
H    0.02405319    2.54176559   -0.01351106   -0.00061964    0.00431379   -0.00312109
H    0.27078151   -2.66984530   -0.09711437    0.00854624    0.00872739   -0.00219311
H    2.24620175    2.28096250   -0.04236879   -0.01294379    0.00574359   -0.00138232
H    2.37739036   -2.03443691   -0.05936996   -0.00381787    0.00216637   -0.00478535
C    2.36393894    0.06373719    0.02584211    0.00495137   -0.02275023    0.00022485
H    3.45312683    0.03133664    0.03722850    0.00156406   -0.00006714    0.00064558
   15
   -420.53729519
H   -2.63183728    0.52678828   -0.08181623   -0.00796986   -0.00012458   -0.00497922
O   -1.95601202    1.24906431    0.02753016   -0.00336696   -0.00276837    0.00753765
O   -2.04956170   -1.23365440    0.03414615    0.00299406    0.01802576    0.00835581
C   -0.74102498    0.65833335   -0.03468851    0.02617992    0.01013530   -0.00549349
C   -0.88311081   -0.82628948   -0.05247956   -0.03649111   -0.01291653   -0.01488593
C    0.33846495    1.49201755    0.01120129   -0.00037752   -0.02916568    0.00796370
C    0.36838923   -1.60250167   -0.02791798    0.00729793   -0.01140540    0.00555712
C    1.73577608    1.32393637   -0.00233740    0.00817871    0.03330124   -0.00100422
C    1.69818243   -1.19433204    0.02102347    0.00494362   -0.00183573    0.00957843
H    0.02233395    2.54363484   -0.01769719   -0.00075774    0.00454559   -0.00321979
H    0.27678158   -2.67190638   -0.09909746    0.00926575    0.00836577   -0.00225524
H    2.23936742    2.28360347   -0.04223338   -0.01364314    0.00612352   -0.00168385
H    2.38348850   -2.03257488   -0.05689692   -0.00263360    0.00219533   -0.00474522
C    2.36059935    0.06199320    0.02126513    0.00644608   -0.02347039   -0.00190856
H    3.44708670    0.02214390    0.04279501   -0.00004930   -0.00098887    0.00118982
   15
   -420.53717502
H   -2.63548450    0.51638035   -0.07225897   -0.01177941   -0.00275720   -0.00486567
O   -1.95714865    1.24606247    0.02565647   -0.00209724   -0.00071889    0.00739879
O   -2.04891152   -1.22921412    0.03379093   -0.00066626    0.01771074    0.00825941
C   -0.73722324    0.66102603   -0.03295415    0.03228365    0.01394840   -0.00513168
C   -0.87801297   -0.82535424   -0.05039732   -0.03225821   -0.01278252   -0.01452957
C    0.33668483    1.49386353    0.00990398   -0.00310560   -0.03112705    0.00731821
C    0.37055907   -1.60363155   -0.02868285    0.00996744   -0.00783288    0.00536762
C    1.73312974    1.32378504    0.00166187    0.00676172    0.03307129    0.00073949
C    1.69613237   -1.19752577    0.02163770    0.00064105   -0.00364621    0.01006033
H    0.02074880    2.54469645   -0.02130462   -0.00073532    0.00403743   -0.00325348
H    0.28111721   -2.67545531   -0.10067359    0.00973664    0.00675519   -0.00238143
H    2.23498233    2.28513796   -0.04179457   -0.01386827    0.00678208   -0.00199751
H    2.39005791   -2.03110241   -0.05356980   -0.00116993    0.00187354   -0.00467804
C    2.35716243    0.06060310    0.01671692    0.00782447   -0.02340163   -0.00398183
H    3.44105333    0.01312909    0.04814814   -0.00151952   -0.00193691    0.00168492
   15
   -420.53713832
H   -2.63702905    0.50645569   -0.06182944   -0.01434787   -0.00449291   -0.00450085
O   -1.95826074    1.24306949    0.02369907   -0.00163917    0.00055898    0.00701887
O   -2.04825330   -1.22497466    0.03334206   -0.00484356    0.01726823    0.00811433
C   -0.73390833    0.66350862   -0.03114216    0.03732377    0.01710100   -0.00480175
C   -0.87242848   -0.82422595   -0.04809552   -0.02715052   -0.01243778   -0.01407160
C    0.33495138    1.49617876    0.00849609   -0.00561268   -0.03194784    0.00661960
C    0.37257823   -1.60464412   -0.02952890    0.01260989   -0.00333781    0.00518098
C    1.73038143    1.32313474    0.00564996    0.00512239    0.03197117    0.00249051
C    1.69407290   -1.20066466    0.02209993   -0.00390977   -0.00520380    0.01046387
H    0.01929385    2.54504145   -0.02432731   -0.00056375    0.00282193   -0.00321998
H    0.28370330   -2.68020610   -0.10182016    0.00997741    0.00416546   -0.00255582
H    2.23308752    2.28544846   -0.04099591   -0.01365297    0.00764710   -0.00232078
H    2.39683577   -2.02996351   -0.04940081    0.00047859    0.00132062   -0.00457306
C    2.35360761    0.05956588    0.01222884    0.00887524   -0.02255816   -0.00598068
H    3.43528892    0.00446307    0.05319842   -0.00267551   -0.00289479    0.00214145
   15
   -420.53724853
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C   -0.73115618    0.66573364   -0.02925753    0.04107954    0.01944041   -0.00449987
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   15
   -420.53752549
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O   -2.04672042   -1.21707697    0.03217075   -0.01394679    0.01611109    0.00762268
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   15
   -420.53794006
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O   -2.04574280   -1.21340591    0.03145392   -0.01849411    0.01552741    0.00725324
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C    1.72178036    1.31840918    0.01728446   -0.00023644    0.02478691    0.00752162
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C    2.34211889    0.05838917   -0.00057905    0.00863393   -0.01578293   -0.01144152
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   15
   -420.53849226
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O   -2.04455561   -1.20991108    0.03065491   -0.02279142    0.01499273    0.00679362
C   -0.72673213    0.67058316   -0.02321242    0.04340120    0.02051552   -0.00364698
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C    0.37839429   -1.60891815   -0.03365765    0.02065273    0.01389395    0.00383194
C    1.71888442    1.31602943    0.02096825   -0.00184892    0.02160976    0.00903210
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   15
   -420.53915358
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O   -2.04311028   -1.20658637    0.02977891   -0.02667556    0.01454094    0.00624451
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C    1.71601614    1.31332310    0.02451563   -0.00321812    0.01829064    0.01041418
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C    2.33380751    0.05885282   -0.00829962    0.00568074   -0.00836535   -0.01450248
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   15
   -420.53988407
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O   -2.04136285   -1.20342670    0.02883217   -0.03000571    0.01420187    0.00560469
C   -0.72703642    0.67228066   -0.01890007    0.03760316    0.01603808   -0.00294987
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C    0.32710829    1.51952232   -0.00164140   -0.00833429   -0.01874219    0.00178970
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C    1.68513196   -1.21719467    0.02144425   -0.02253321   -0.01188453    0.01077373
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H    2.42612511   -2.02494002   -0.00865832    0.00675640    0.00019374   -0.00245795
C    2.32951078    0.05930343   -0.01184233    0.00373671   -0.00404613   -0.01579093
H    3.41168695   -0.03060194    0.07288024    0.00008452   -0.00819832    0.00437011
   15
   -420.54063034
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O   -2.03927568   -1.20042821    0.02782193   -0.03266333    0.01397326    0.00487900
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C    1.71044011    1.30713231    0.03111986   -0.00493392    0.01152165    0.01272745
C    1.68465615   -1.21940916    0.02075636   -0.02248227   -0.01267455    0.01050859
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H    2.42731077   -2.02405978    0.00016001    0.00635018    0.00094692   -0.00189476
C    2.32515758    0.05981491   -0.01514653    0.00172664    0.00051996   -0.01688471
H    3.40876263   -0.03212923    0.07376677    0.00123861   -0.00871724    0.00458544
   15
   -420.54138582
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O   -2.03681870   -1.19758834    0.02675641   -0.03456300    0.01386958    0.00407501
C   -0.72959272    0.67302546   -0.01441065    0.02739449    0.00813712   -0.00199050
C   -0.82081379   -0.80935445   -0.02298054    0.02025787   -0.00498689   -0.00620528
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C    0.37938209   -1.61616535   -0.03867434    0.02069827    0.01331373    0.00068330
C    1.70775823    1.30374999    0.03414178   -0.00519563    0.00820631    0.01363526
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H    0.00691675    2.56008828   -0.03011569   -0.00002680   -0.00813092   -0.00159095
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C    2.32077812    0.06031838   -0.01819573   -0.00018588    0.00520916   -0.01775223
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   15
   -420.54211772
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O   -2.03397041   -1.19490591    0.02564474   -0.03565493    0.01388859    0.00319922
C   -0.73153274    0.67318183   -0.01211703    0.02125870    0.00330745   -0.00138963
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C    0.32491361    1.53564357   -0.00724388   -0.00129252   -0.01153606   -0.00075056
C    0.37882680   -1.61853565   -0.03998803    0.01933622    0.00985125   -0.00033823
C    1.70515443    1.30024357    0.03695776   -0.00504755    0.00495552    0.01436903
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H    2.42642106   -2.02299142    0.01871389    0.00435385    0.00297560   -0.00071841
C    2.31640118    0.06074312   -0.02097680   -0.00186489    0.00987549   -0.01838207
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   15
   -420.54275895
H   -2.54895449    0.42183544    0.06607751    0.00750010    0.00794426    0.00215950
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O   -2.03071844   -1.19238112    0.02449684   -0.03590584    0.01401332    0.00225938
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C   -0.80928291   -0.80454631   -0.01540207    0.02700254   -0.00249311   -0.00328515
C    0.32427322    1.54140866   -0.00910589    0.00139744   -0.00997419   -0.00163184
C    0.37797974   -1.62105389   -0.04129663    0.01753288    0.00552695   -0.00138685
C    1.70262649    1.29666213    0.03955669   -0.00452339    0.00177662    0.01493425
C    1.68518361   -1.22487464    0.01775974   -0.01679690   -0.01331062    0.00942670
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C    2.31205205    0.06101877   -0.02348026   -0.00322576    0.01437110   -0.01876379
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   15
   -420.54315853
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O   -2.02705994   -1.19001537    0.02332338   -0.03532200    0.01423401    0.00127607
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C   -0.80410608   -0.80207621   -0.01152715    0.02896953   -0.00127028   -0.00176386
C    0.32361193    1.54732480   -0.01094318    0.00389401   -0.00861675   -0.00254252
C    0.37686801   -1.62365515   -0.04258428    0.01542288    0.00073443   -0.00245223
C    1.70016656    1.29305375    0.04193001   -0.00368856   -0.00133218    0.01533860
C    1.68591603   -1.22629345    0.01646804   -0.01367377   -0.01251686    0.00899121
H    0.00174076    2.58580652   -0.02640098   -0.00258620   -0.00179840   -0.00091752
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C    2.30775126    0.06107751   -0.02570033   -0.00423198    0.01854453   -0.01889090
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   15
   -420.54333811
H   -2.53299874    0.39352512    0.09048636    0.00592355    0.00195288    0.00412345
O   -1.96465305    1.21032817   -0.00357454   -0.00758223   -0.00272726   -0.00315192
O   -2.02300152   -1.18781114    0.02213549   -0.03393464    0.01452503    0.00024764
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C   -0.79936611   -0.79958683   -0.00762558    0.02999314   -0.00011152   -0.00022583
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C    0.37552333   -1.62626762   -0.04383491    0.01310718   -0.00400769   -0.00350027
C    1.69776212    1.28946546    0.04407160   -0.00263496   -0.00438144    0.01559013
C    1.68685491   -1.22752386    0.01504045   -0.01031723   -0.01102190    0.00851076
H    0.00072926    2.59560824   -0.02477822   -0.00342145    0.00073421   -0.00068374
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H    2.34826458    2.16271272    0.01386984    0.00031688    0.00027937   -0.00349814
H    2.41987699   -2.02581832    0.04725638    0.00043437    0.00536493    0.00100158
C    2.30351405    0.06085645   -0.02763508   -0.00489953    0.02223892   -0.01877831
H    3.38867270   -0.01568167    0.06552575    0.00162208   -0.00799572    0.00436374
   15
   -420.54324011
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   15
   -420.54289351
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   15
   -420.54232260
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   15
   -420.54164461
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O   -2.00320343   -1.18068843    0.01747485   -0.02176653    0.01641630   -0.00386805
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   15
   -420.54086036
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O   -1.99753547   -1.17935806    0.01639081   -0.01754196    0.01709206   -0.00477639
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C    0.36650013   -1.63739848   -0.04900355    0.00306955   -0.01421105   -0.00806306
C    1.68599778    1.27338303    0.05124496    0.00222644   -0.01740125    0.01478437
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   15
   -420.54002401
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O   -1.99166877   -1.17822159    0.01536090   -0.01305874    0.01782720   -0.00559739
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C   -0.78007214   -0.78508175    0.01505948    0.01989355    0.00342070    0.00836669
C    0.31615452    1.59091600   -0.02192277    0.00662955    0.00818909   -0.00903097
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C    1.68359263    1.27081514    0.05198984    0.00260608   -0.01896834    0.01424614
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C    2.27982063    0.05130209   -0.03354813   -0.00780424    0.02732569   -0.01468695
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   15
   -420.53919931
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C    0.31461513    1.59702102   -0.02305298    0.00497939    0.01190516   -0.00978236
C    0.36237222   -1.64044373   -0.05031020    0.00023072   -0.01213288   -0.00965360
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C    1.69517765   -1.23420703    0.00198895    0.00868105    0.01743523    0.00310783
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H    2.40474249   -2.05992332    0.10255044    0.00019038   -0.00203557    0.00533818
C    2.27622346    0.04821626   -0.03368191   -0.00917705    0.02470681   -0.01373060
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   15
   -420.53841144
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O   -1.97954410   -1.17656541    0.01349939   -0.00370381    0.01958359   -0.00689527
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C   -0.77645527   -0.78060645    0.02183021    0.01270305    0.00268377    0.01064434
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   15
   -420.53772331
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O   -1.97339203   -1.17606547    0.01268246    0.00096398    0.02051757   -0.00735282
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C    0.31133993    1.60863744   -0.02486005    0.00107531    0.01867990   -0.01100433
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C    2.26947161    0.04098083   -0.03334155   -0.01267463    0.01680699   -0.01175450
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   15
   -420.53720905
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O   -1.96725079   -1.17579823    0.01194882    0.00550345    0.02143861   -0.00768276
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C   -0.77360441   -0.77628836    0.02795922    0.00505180    0.00094049    0.01250883
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H    2.39914433   -2.07473629    0.11420992    0.00056463   -0.00458334    0.00686339
C    2.26636939    0.03695026   -0.03289727   -0.01445648    0.01184875   -0.01074456
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   15
   -420.53683323
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O   -1.96117177   -1.17577413    0.01130221    0.00982801    0.02231316   -0.00789297
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C   -0.77232264   -0.77415772    0.03074688    0.00132482   -0.00024368    0.01326948
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C    1.67097712    1.26240121    0.05270140    0.00172882   -0.01682969    0.01019110
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H    2.39706897   -2.07815870    0.11573323    0.00011871   -0.00441939    0.00716389
C    2.26348540    0.03274101   -0.03229056   -0.01597257    0.00651232   -0.00972470
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   15
   -420.53667870
H   -2.48407679    0.31260999    0.12347757    0.00796490   -0.00336721    0.00861952
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O   -1.95520396   -1.17600304    0.01074505    0.01384949    0.02306514   -0.00799632
C   -0.75106863    0.70588292    0.01828502   -0.03222691   -0.02542904    0.00825754
C   -0.77106116   -0.77202321    0.03333404   -0.00219450   -0.00158813    0.01391790
C    0.30637884    1.62389204   -0.02631025   -0.00454292    0.02265574   -0.01207908
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C    1.66835514    1.26155831    0.05232719    0.00124896   -0.01444112    0.00921645
C    1.69795499   -1.24518587   -0.00901541    0.01934686    0.03167333   -0.00078730
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H    0.03767284   -2.70069765   -0.01620070   -0.01084120   -0.00745895    0.00203227
H    2.44781237    2.02252122    0.14263064    0.01266313   -0.00976066    0.00257955
H    2.39497506   -2.08079257    0.11596850   -0.00055866   -0.00373325    0.00734180
C    2.26084234    0.02843357   -0.03153682   -0.01702359    0.00101600   -0.00870526
H    3.35008894    0.10822244   -0.01362621    0.00177468    0.00962054   -0.00117390
   15
   -420.53672594
H   -2.48443637    0.31607476    0.11477109    0.00920336   -0.00039567    0.00760825
O   -1.96742262    1.17555954   -0.02590495    0.01608079   -0.01147697   -0.00891539
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C   -0.74912610    0.71153726    0.01957294   -0.02907027   -0.02133075    0.00832829
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   15
   -420.53692694
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   15
   -420.53723412
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   15
   -420.53759359
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C    1.65776939    1.25992398    0.04959119   -0.00162938   -0.00233834    0.00510146
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   15
   -420.53794813
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C    1.65515284    1.25972064    0.04867509   -0.00280439    0.00038569    0.00403318
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   15
   -420.53831871
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   15
   -420.53860105
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C   -0.75910970   -0.75527631    0.04523342   -0.01313770   -0.00914881    0.01518789
C    0.29810858    1.64960428   -0.02331984   -0.01287100    0.00052720   -0.01102691
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   15
   -420.53876960
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   15
   -420.53878807
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O   -1.91217079   -1.18999233    0.00967713    0.02485722    0.01795844   -0.00618092
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   15
   -420.53860907
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   15
   -420.53832883
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   15
   -420.53780807
H   -2.55657550    0.31399216   -0.03740248   -0.01412865   -0.00435361   -0.00144360
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O   -1.90291125   -1.19879678    0.01069976    0.01729282    0.01111304   -0.00494622
C   -0.71941399    0.77718759    0.02565677    0.04182576    0.03320419    0.00776950
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C    1.63954893    1.25688739    0.04150377   -0.01730996    0.00381649   -0.00363223
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H    2.40790747   -2.11961145    0.02076072    0.00392206   -0.00037321    0.00489535
C    2.24423301   -0.00800480   -0.01613367    0.00325960   -0.01786907    0.00029852
H    3.32374654    0.04800575   -0.06531914   -0.00462924    0.00361878   -0.00459376
   15
   -420.53724167
H   -2.55777347    0.31311759   -0.05270768   -0.01462675   -0.00461445   -0.00237776
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O   -1.90025948   -1.20202012    0.01115934    0.01411173    0.00853501   -0.00448294
C   -0.71865855    0.78142382    0.02549940    0.04447386    0.03484561    0.00777777
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   15
   -420.53658589
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   15
   -420.53594312
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   15
   -420.53534052
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   15
   -420.53482881
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C    0.30149425    1.68178805   -0.00603181   -0.00089174    0.01759726   -0.00460785
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   15
   -420.53440555
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   15
   -420.53407718
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C    0.30346854    1.68664356   -0.00142541    0.00594072    0.02167038   -0.00332614
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C    1.66579000   -1.34331823   -0.04609800   -0.03418986   -0.03866319    0.00052370
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   15
   -420.53386976
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O   -1.88423469   -1.22563604    0.01546906   -0.00319731   -0.00853062   -0.00055642
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   15
   -420.53375832
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O   -1.88196513   -1.22882585    0.01616444   -0.00369494   -0.01033777    0.00009206
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C   -0.72465769   -0.70950496    0.03905457    0.02333160    0.01666446    0.00345647
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C    2.23501140   -0.01304347   -0.00380102   -0.00700223    0.00847304    0.00270569
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   15
   -420.53377378
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O   -1.87965423   -1.23189863    0.01685878   -0.00355865   -0.01190123    0.00075369
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C   -0.72376108   -0.70686251    0.03767733    0.02336508    0.01907296    0.00216178
C    0.30565055    1.69147126    0.00583511    0.01402994    0.02260431   -0.00125630
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   15
   -420.53388235
H   -2.48835296    0.30631034   -0.16516109    0.00876414    0.00474181   -0.00650426
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O   -1.87730353   -1.23483663    0.01754455   -0.00279860   -0.01321826    0.00141616
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C   -0.72321696   -0.70450805    0.03626740    0.02277843    0.02117281    0.00086311
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C    0.36099061   -1.62775344    0.00186192    0.00649291    0.00068342   -0.00001555
C    1.64104507    1.24921095    0.03570098   -0.01475859   -0.00115794   -0.00390972
C    1.67031373   -1.35159250   -0.05322628   -0.02391166   -0.04434669    0.00106210
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   15
   -420.53410646
H   -2.48382866    0.30074070   -0.17093709    0.00886481    0.00179555   -0.00714431
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O   -1.87492163   -1.23762489    0.01821428   -0.00144799   -0.01430336    0.00207077
C   -0.74923899    0.79764582    0.01662206    0.00379994    0.00540223    0.00336518
C   -0.72301659   -0.70247326    0.03484441    0.02165169    0.02290000   -0.00042563
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C    1.64292438    1.24861842    0.03563294   -0.01292070   -0.00119880   -0.00335162
C    1.67246993   -1.35200298   -0.05504604   -0.02019750   -0.04282997    0.00109027
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C    2.23327491   -0.01543976   -0.00034856   -0.00529343    0.01231060    0.00237123
H    3.31994851   -0.08375904   -0.01136191   -0.00103519   -0.01204436   -0.00092331
   15
   -420.53440444
H   -2.48089316    0.29485397   -0.17542611    0.00848653   -0.00158691   -0.00783863
O   -2.02368404    1.18365961   -0.03686313   -0.00295963   -0.00810719    0.00552789
O   -1.87252375   -1.24025119    0.01886054    0.00041751   -0.01510826    0.00269829
C   -0.75398650    0.79749633    0.01532436   -0.00146619    0.00203321    0.00260265
C   -0.72314301   -0.70078414    0.03342783    0.02005992    0.02417929   -0.00168684
C    0.30599503    1.69323425    0.01326614    0.01597971    0.02243524    0.00084122
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C    1.64499917    1.24804422    0.03561555   -0.01119230   -0.00140555   -0.00276742
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   15
   -420.53472995
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O   -1.87013099   -1.24270646    0.01947623    0.00272361   -0.01563014    0.00328015
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C   -0.72357232   -0.69945999    0.03203670    0.01810629    0.02496839   -0.00290017
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   15
   -420.53503252
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O   -1.86776944   -1.24498470    0.02005479    0.00539433   -0.01588917    0.00379572
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C   -0.72427513   -0.69851273    0.03068934    0.01589226    0.02524622   -0.00405033
C    0.30503721    1.69270721    0.01817468    0.01346591    0.02393587    0.00209643
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C    2.23226769   -0.01944549    0.00278395   -0.00439388    0.01039732    0.00176796
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   15
   -420.53524423
H   -2.48076530    0.28129531   -0.17998694    0.00644591   -0.01063430   -0.00935483
O   -2.03010992    1.19432042   -0.03884241    0.00302055    0.00632246    0.00770052
O   -1.86546932   -1.24708296    0.02059037    0.00831737   -0.01583992    0.00422702
C   -0.76781081    0.79702741    0.01124109   -0.01476575   -0.00503390    0.00036169
C   -0.72521800   -0.69794653    0.02940312    0.01351713    0.02499154   -0.00512080
C    0.30424199    1.69190748    0.02058608    0.01128625    0.02521722    0.00266373
C    0.36370561   -1.62900290    0.01891252    0.00302017   -0.00545556    0.00637414
C    1.65214797    1.24646975    0.03577628   -0.00697892   -0.00233884   -0.00080904
C    1.68358545   -1.34770318   -0.06250171   -0.00546415   -0.02500078    0.00153683
H    0.08807749    2.76504417   -0.04109807   -0.00153584    0.00732416   -0.00248816
H    0.03944759   -2.66046160   -0.04457248    0.00272441    0.00144698   -0.00149844
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C    2.23206535   -0.02111659    0.00377030   -0.00535473    0.00841932    0.00151447
H    3.31064455   -0.07340005    0.01925101   -0.00729255   -0.01007585    0.00144668
   15
   -420.53533217
H   -2.48321376    0.27994646   -0.17823583    0.00588122   -0.01249914   -0.00945391
O   -2.03229242    1.19779785   -0.03966749    0.00437279    0.00954551    0.00800325
O   -1.86326370   -1.24900180    0.02107810    0.01139474   -0.01548863    0.00455978
C   -0.77205620    0.79698290    0.00985423   -0.01825640   -0.00620261   -0.00032689
C   -0.72636518   -0.69775757    0.02819422    0.01109008    0.02421468   -0.00609889
C    0.30327673    1.69072630    0.02295727    0.00866368    0.02670669    0.00318644
C    0.36407367   -1.62900617    0.02211613    0.00238916   -0.00445460    0.00782440
C    1.65476816    1.24600962    0.03586793   -0.00576253   -0.00233509   -0.00009239
C    1.68670861   -1.34548025   -0.06441826   -0.00178980   -0.01878050    0.00166476
H    0.09028647    2.76136399   -0.04016442   -0.00092944    0.00538441   -0.00244972
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H    2.36981499    2.07448930    0.03376541   -0.00029842    0.00447204   -0.00152695
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C    2.23194497   -0.02291424    0.00473378   -0.00714905    0.00580715    0.00122993
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   15
   -420.53526992
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O   -1.86118739   -1.25074518    0.02151421    0.01453587   -0.01485324    0.00478395
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C   -0.72768007   -0.69793413    0.02707741    0.00869158    0.02293946   -0.00697591
C    0.30218084    1.68914130    0.02528031    0.00574603    0.02821141    0.00367767
C    0.36440577   -1.62894202    0.02520145    0.00162008   -0.00350170    0.00926188
C    1.65747545    1.24558434    0.03596096   -0.00452814   -0.00195800    0.00063653
C    1.68985873   -1.34297346   -0.06635989    0.00196635   -0.01248946    0.00171619
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H    2.35516972   -2.19102073   -0.26535258   -0.00234569   -0.00745181   -0.00731579
C    2.23193363   -0.02479897    0.00567872   -0.00971979    0.00260854    0.00091058
H    3.31286228   -0.05688225    0.03341785   -0.00597839   -0.00762385    0.00261145
   15
   -420.53508500
H   -2.49122682    0.28416711   -0.16966526    0.00527987   -0.01392796   -0.00889684
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O   -1.85927595   -1.25232031    0.02189616    0.01763805   -0.01393769    0.00489577
C   -0.77967573    0.79718115    0.00710486   -0.02368036   -0.00666123   -0.00155780
C   -0.72912649   -0.69845694    0.02606594    0.00640639    0.02120007   -0.00774427
C    0.30099827    1.68713009    0.02754778    0.00267161    0.02944796    0.00414908
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C    1.66025107    1.24518805    0.03604438   -0.00318325   -0.00110023    0.00135198
C    1.69297899   -1.34027756   -0.06832732    0.00582196   -0.00643875    0.00164043
H    0.09507557    2.75154307   -0.03699339    0.00050787    0.00043024   -0.00222475
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C    2.23206996   -0.02672253    0.00660992   -0.01287414   -0.00109417    0.00056491
H    3.31566659   -0.04644877    0.03984844   -0.00422507   -0.00606408    0.00318794
   15
   -420.53482169
H   -2.49668179    0.28999231   -0.16294611    0.00527928   -0.01343239   -0.00825312
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O   -1.85756448   -1.25373756    0.02222267    0.02061833   -0.01277942    0.00490273
C   -0.78296792    0.79743086    0.00576094   -0.02554490   -0.00596966   -0.00208456
C   -0.73066996   -0.69929978    0.02517142    0.00429312    0.01904445   -0.00839962
C    0.29977530    1.68467429    0.02975253   -0.00040132    0.03013950    0.00460890
C    0.36501229   -1.62866198    0.03093144   -0.00063624   -0.00293787    0.01191304
C    1.66307458    1.24480781    0.03610740   -0.00164715    0.00026138    0.00202519
C    1.69601112   -1.33748369   -0.07031934    0.00975619   -0.00090234    0.00139744
H    0.09739827    2.74628550   -0.03479519    0.00121216   -0.00197612   -0.00208960
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C    2.23240130   -0.02862907    0.00753259   -0.01632272   -0.00519010    0.00020842
H    3.31922529   -0.03492639    0.04570534   -0.00204788   -0.00430834    0.00374867
   15
   -420.53449545
H   -2.50309044    0.29822413   -0.15474398    0.00549607   -0.01213074   -0.00741615
O   -2.04158829    1.21044669   -0.04386351    0.00486984    0.01185218    0.00668975
O   -1.85608670   -1.25501004    0.02249367    0.02339998   -0.01142345    0.00480988
C   -0.78587465    0.79777014    0.00444846   -0.02677955   -0.00470715   -0.00254486
C   -0.73227862   -0.70043015    0.02440376    0.00240548    0.01653807   -0.00893955
C    0.29855824    1.68176382    0.03188759   -0.00335262    0.02997332    0.00507546
C    0.36532095   -1.62845418    0.03353612   -0.00218446   -0.00367200    0.01304913
C    1.66592268    1.24442302    0.03613989    0.00013984    0.00212708    0.00262596
C    1.69889572   -1.33467529   -0.07233226    0.01369903    0.00389917    0.00095495
H    0.09950426    2.74137656   -0.03222064    0.00180855   -0.00388305   -0.00196645
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H    3.32315119   -0.02263065    0.05088785    0.00023770   -0.00239390    0.00427625
   15
   -420.53417273
H   -2.51049079    0.30862856   -0.14520903    0.00589416   -0.01003396   -0.00642485
O   -2.04406085    1.21326084   -0.04511780    0.00357282    0.00977831    0.00585605
O   -1.85487411   -1.25615307    0.02271018    0.02592200   -0.00993407    0.00462820
C   -0.78837729    0.79817995    0.00317438   -0.02734176   -0.00292180   -0.00293778
C   -0.73392395   -0.70181023    0.02377113    0.00077482    0.01374445   -0.00936335
C    0.29739160    1.67840150    0.03394589   -0.00607731    0.02872704    0.00555178
C    0.36566297   -1.62818996    0.03594370   -0.00399591   -0.00514718    0.01401854
C    1.66876834    1.24400554    0.03613280    0.00220387    0.00443157    0.00312517
C    1.70157330   -1.33192475   -0.07435937    0.01754089    0.00779377    0.00030485
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H    2.35470300   -2.18576041   -0.29685544   -0.00281416   -0.00831724   -0.00839571
C    2.23385527   -0.03214055    0.00937356   -0.02274853   -0.01391015   -0.00042937
H    3.32703708   -0.00990559    0.05530131    0.00233042   -0.00036887    0.00475186
   15
   -420.53380727
H   -2.51895613    0.32083117   -0.13451767    0.00647866   -0.00727677   -0.00537043
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O   -1.85395527   -1.25718352    0.02287425    0.02812617   -0.00835481    0.00437623
C   -0.79046744    0.79863339    0.00194464   -0.02717282   -0.00067426   -0.00326130
C   -0.73558136   -0.70339788    0.02327992   -0.00057090    0.01074822   -0.00967081
C    0.29631653    1.67460634    0.03592022   -0.00852109    0.02626618    0.00604743
C    0.36606567   -1.62784707    0.03813955   -0.00601246   -0.00730088    0.01480459
C    1.67158032    1.24352065    0.03607860    0.00455607    0.00706483    0.00350196
C    1.70398597   -1.32929083   -0.07639084    0.02113742    0.01069308   -0.00054721
H    0.10266831    2.73382448   -0.02602395    0.00246951   -0.00519602   -0.00182838
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H    2.46362703    2.00045677   -0.04262091    0.01250227   -0.00352771   -0.00604330
H    2.35567348   -2.18052261   -0.30099043   -0.00364660   -0.00688286   -0.00815284
C    2.23507427   -0.03361414    0.01030141   -0.02508821   -0.01813676   -0.00064764
H    3.33051017    0.00288560    0.05886073    0.00396022    0.00168297    0.00514545
   15
   -420.53349114
H   -2.52858768    0.33433629   -0.12285955    0.00704782   -0.00400343   -0.00430253
O   -2.04910476    1.21859258   -0.04781443   -0.00069054    0.00321813    0.00390252
O   -1.85335513   -1.25811924    0.02298867    0.02995982   -0.00676604    0.00409005
C   -0.79214762    0.79909655    0.00076413   -0.02626005    0.00195621   -0.00352257
C   -0.73723050   -0.70514789    0.02293479   -0.00161969    0.00763369   -0.00986133
C    0.29536997    1.67041553    0.03780306   -0.01065703    0.02264805    0.00655426
C    0.36655941   -1.62739314    0.04011178   -0.00813419   -0.00998889    0.01540267
C    1.67432315    1.24292874    0.03597162    0.00713427    0.00986081    0.00374575
C    1.70607955   -1.32681732   -0.07841383    0.02431638    0.01255937   -0.00157054
H    0.10360923    2.73141439   -0.02242689    0.00246708   -0.00440678   -0.00181343
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H    2.47287149    1.98829635   -0.05223553    0.01268843   -0.00615215   -0.00646906
H    2.35730267   -2.17405308   -0.30366033   -0.00463413   -0.00493797   -0.00773324
C    2.23667151   -0.03481395    0.01123893   -0.02652918   -0.02198768   -0.00075441
H    3.33327983    0.01537458    0.06149516    0.00493520    0.00370462    0.00545166
   15
   -420.53318792
H   -2.53948658    0.34855990   -0.11042553    0.00750253   -0.00057800   -0.00330880
O   -2.05162795    1.22118394   -0.04923479   -0.00342097   -0.00063686    0.00294627
O   -1.85309446   -1.25897816    0.02305674    0.03139269   -0.00523146    0.00374975
C   -0.79343171    0.79952981   -0.00036318   -0.02458286    0.00486976   -0.00372707
C   -0.73885555   -0.70701333    0.02273862   -0.00235607    0.00450635   -0.00993597
C    0.29458416    1.66588342    0.03958681   -0.01246459    0.01811375    0.00704018
C    0.36717613   -1.62678782    0.04185134   -0.01022504   -0.01296517    0.01582449
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C    1.70780629   -1.32453252   -0.08041292    0.02685234    0.01345467   -0.00271722
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   15
   -420.53290537
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O   -2.05411223    1.22378236   -0.05068866   -0.00624876   -0.00429988    0.00208780
O   -1.85318950   -1.25977765    0.02308230    0.03239070   -0.00380217    0.00338061
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C   -0.74044538   -0.70894701    0.02269254   -0.00277797    0.00146542   -0.00989328
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C    1.67944367    1.24125631    0.03558654    0.01258990    0.01512782    0.00384464
C    1.70912806   -1.32245010   -0.08237086    0.02852966    0.01351101   -0.00392094
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   15
   -420.53268576
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O   -1.85365153   -1.26053388    0.02306954    0.03292367   -0.00252377    0.00298434
C   -0.79492362    0.80012799   -0.00244652   -0.01915233    0.01113702   -0.00400972
C   -0.74199359   -0.71090308    0.02279590   -0.00287535   -0.00138980   -0.00973225
C    0.29359934    1.65607648    0.04282856   -0.01515220    0.00772652    0.00784368
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C    1.68173930    1.24009671    0.03530690    0.01513318    0.01714087    0.00374185
C    1.71001980   -1.32057115   -0.08426954    0.02911403    0.01291285   -0.00510735
H    0.10393278    2.72765648   -0.00966618    0.00157482    0.00164488   -0.00185311
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C    2.24387021   -0.03623689    0.01411482   -0.02454602   -0.02940816   -0.00019024
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   15
   -420.53264136
H   -2.58020225    0.38977189   -0.07014719    0.00571309    0.00629385   -0.00108442
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O   -1.85448658   -1.26126133    0.02302295    0.03297153   -0.00142558    0.00256776
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C   -0.74349871   -0.71283846    0.02304626   -0.00263795   -0.00397398   -0.00945444
C    0.29344094    1.65095773    0.04427444   -0.01603478    0.00269131    0.00812161
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C    1.68380658    1.23867884    0.03497077    0.01728450    0.01841219    0.00357783
C    1.71047290   -1.31888691   -0.08609111    0.02841451    0.01187582   -0.00620835
H    0.10338685    2.72635894   -0.00474897    0.00110138    0.00387318   -0.00181746
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H    2.37378869   -2.14338786   -0.30144425   -0.00702410    0.00352216   -0.00550005
C    2.24703893   -0.03586138    0.01508507   -0.02193173   -0.03005585    0.00033386
H    3.33595321    0.05553449    0.06198668    0.00111340    0.00968586    0.00556900
   15
   -420.53281615
H   -2.59608401    0.40165656   -0.05617358    0.00342464    0.00634720   -0.00053879
O   -2.06102939    1.23198663   -0.05516066   -0.01235102   -0.00955869    0.00017002
O   -1.85569520   -1.26197241    0.02294725    0.03252826   -0.00054282    0.00213431
C   -0.79526718    0.80005373   -0.00428773   -0.01174988    0.01717616   -0.00421736
C   -0.74496431   -0.71471414    0.02343943   -0.00206439   -0.00621463   -0.00905994
C    0.29352453    1.64579760    0.04559764   -0.01658487   -0.00172585    0.00829112
C    0.37143513   -1.62200713    0.04638698   -0.01448322   -0.02042743    0.01628258
C    1.68561324    1.23698375    0.03458054    0.01884415    0.01873073    0.00339306
C    1.71049810   -1.31738193   -0.08781896    0.02630694    0.01058690   -0.00717440
H    0.10264299    2.72436943    0.00049503    0.00063917    0.00570211   -0.00174032
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H    2.48700583    1.95348425   -0.08207681    0.00884205   -0.01700206   -0.00711198
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C    2.25053842   -0.03503264    0.01605007   -0.01864512   -0.02971119    0.00102017
H    3.33538144    0.06177849    0.05957117   -0.00134158    0.01041909    0.00537020
   15
   -420.53326395
H   -2.61257031    0.41241555   -0.04210307    0.00031089    0.00523100    0.00000714
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O   -1.85727235   -1.26267714    0.02284736    0.03158730    0.00013309    0.00168183
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C   -0.74639910   -0.71649636    0.02396945   -0.00114164   -0.00803611   -0.00855185
C    0.29385846    1.64066241    0.04679563   -0.01677966   -0.00519550    0.00834429
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C    1.68713594    1.23500685    0.03413898    0.01964126    0.01793677    0.00321456
C    1.71012729   -1.31603687   -0.08943853    0.02277710    0.00917320   -0.00798628
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H    2.38923855   -2.13030153   -0.29397310   -0.00506223    0.00500363   -0.00488353
C    2.25431938   -0.03375585    0.01699947   -0.01500127   -0.02840011    0.00185266
H    3.33505362    0.06615271    0.05619046   -0.00394992    0.01078614    0.00508943
   15
   -420.53392243
H   -2.62910482    0.42224292   -0.02803572   -0.00334445    0.00333081    0.00062850
O   -2.06498349    1.23795948   -0.05816273   -0.01307481   -0.00711072   -0.00097319
O   -1.85920739   -1.26338311    0.02272839    0.03017469    0.00057362    0.00121707
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C   -0.74781701   -0.71815764    0.02462862    0.00010868   -0.00939956   -0.00793430
C    0.29444568    1.63560441    0.04786759   -0.01658619   -0.00754965    0.00829025
C    0.37482707   -1.61786325    0.04718084   -0.01181484   -0.01666899    0.01615422
C    1.68836270    1.23276020    0.03364878    0.01960465    0.01595350    0.00306087
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H    0.10087890    2.71712754    0.01189730   -0.00010453    0.00730430   -0.00142869
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H    2.48031465    1.95860018   -0.08511929    0.00825345   -0.01677775   -0.00722474
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C    2.25832715   -0.03205074    0.01792072   -0.01137377   -0.02620493    0.00280623
H    3.33543446    0.06859071    0.05189507   -0.00637598    0.01081035    0.00473901
   15
   -420.53475959
H   -2.64503530    0.43147589   -0.01408270   -0.00714446    0.00106079    0.00132704
O   -2.06673901    1.24107561   -0.05965046   -0.01283276   -0.00493202   -0.00163607
O   -1.86148430   -1.26409541    0.02259562    0.02831551    0.00081508    0.00073724
C   -0.79460464    0.79791156   -0.00656717   -0.00009796    0.02371396   -0.00455467
C   -0.74923692   -0.71967737    0.02540764    0.00166471   -0.01027735   -0.00721775
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C    0.37680301   -1.61539584    0.04721087   -0.00919318   -0.01265818    0.01600136
C    1.68929404    1.23027377    0.03311228    0.01875154    0.01279818    0.00292967
C    1.70842989   -1.31373994   -0.09230592    0.01207070    0.00607579   -0.00920389
H    0.09999254    2.71158957    0.01799960   -0.00037502    0.00690286   -0.00120339
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H    2.40818131   -2.12066157   -0.28296135   -0.00064529    0.00393025   -0.00469017
C    2.26250741   -0.02995033    0.01879941   -0.00817167   -0.02324902    0.00386122
H    3.33695531    0.06908678    0.04674688   -0.00826183    0.01055334    0.00436873
   15
   -420.53565834
H   -2.65968414    0.44051601   -0.00036944   -0.01065526   -0.00107627    0.00208451
O   -2.06834895    1.24424770   -0.06111958   -0.01261743   -0.00272897   -0.00235526
O   -1.86408205   -1.26481681    0.02245451    0.02606527    0.00087788    0.00024418
C   -0.79430437    0.79651852   -0.00719164    0.00319209    0.02484057   -0.00468091
C   -0.75068227   -0.72104231    0.02629568    0.00347018   -0.01066079   -0.00641201
C    0.29636140    1.62584338    0.04963802   -0.01484636   -0.00855120    0.00791763
C    0.37891719   -1.61273821    0.04699907   -0.00595657   -0.00767376    0.01575481
C    1.68994268    1.22759511    0.03253149    0.01721978    0.00859630    0.00279552
C    1.70726450   -1.31274112   -0.09353520    0.00548306    0.00428422   -0.00970286
H    0.09917191    2.70482028    0.02431810   -0.00053173    0.00571309   -0.00094873
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C    2.26681217   -0.02749916    0.01961964   -0.00574237   -0.01966247    0.00499644
H    3.33995083    0.06768721    0.04081295   -0.00929156    0.01003107    0.00396473
   15
   -420.53656113
H   -2.67242529    0.44974269    0.01296844   -0.01348486   -0.00268567    0.00284744
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O   -1.86697518   -1.26554801    0.02231063    0.02349459    0.00076355   -0.00025670
C   -0.79405171    0.79475063   -0.00774534    0.00593709    0.02534085   -0.00480515
C   -0.75218031   -0.72224664    0.02728057    0.00546110   -0.01055768   -0.00552728
C    0.29766353    1.62115559    0.05034212   -0.01324029   -0.00729156    0.00763466
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C    1.69033157    1.22478750    0.03190849    0.01518608    0.00356732    0.00262538
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H    0.09844572    2.69703259    0.03080719   -0.00059849    0.00383183   -0.00068029
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C    2.27120498   -0.02475130    0.02036423   -0.00433245   -0.01557983    0.00619980
H    3.34460363    0.06448465    0.03416582   -0.00926910    0.00929988    0.00353377
   15
   -420.53745661
H   -2.68275176    0.45943994    0.02579471   -0.01535070   -0.00347322    0.00355176
O   -2.07113682    1.25066483   -0.06396948   -0.01347213    0.00040021   -0.00376188
O   -1.87013459   -1.26628770    0.02216966    0.02068375    0.00050522   -0.00075996
C   -0.79388803    0.79260035   -0.00822641    0.00806358    0.02519897   -0.00491697
C   -0.75376109   -0.72329189    0.02834895    0.00756330   -0.00999094   -0.00457661
C    0.29916522    1.61657691    0.05093082   -0.01113172   -0.00510053    0.00731440
C    0.38336053   -1.60715850    0.04586697    0.00130110    0.00318976    0.01486535
C    1.69049118    1.22192661    0.03124587    0.01289031   -0.00200139    0.00238246
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H    0.09782613    2.68856244    0.03741871   -0.00058710    0.00145859   -0.00041039
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H    2.44831943    2.00175215   -0.07545420    0.01018395   -0.00668207   -0.00746736
H    2.43615732   -2.11088418   -0.26013709    0.00726836    0.00060529   -0.00434002
C    2.27566468   -0.02176829    0.02101501   -0.00404001   -0.01116014    0.00745868
H    3.35090895    0.05961093    0.02688334   -0.00814284    0.00835148    0.00305472
   15
   -420.53821199
H   -2.69033186    0.46974871    0.03798344   -0.01600639   -0.00331857    0.00413754
O   -2.07230468    1.25387471   -0.06533440   -0.01495565    0.00085605   -0.00433162
O   -1.87352850   -1.26703301    0.02203731    0.01774124    0.00014725   -0.00126243
C   -0.79384550    0.79006986   -0.00863315    0.00956566    0.02440358   -0.00500544
C   -0.75545621   -0.72418661    0.02948646    0.00965811   -0.00898502   -0.00357173
C    0.30083464    1.61207458    0.05140895   -0.00853870   -0.00227587    0.00698107
C    0.38558057   -1.60439947    0.04496015    0.00480522    0.00806113    0.01419073
C    1.69045594    1.21909624    0.03054737    0.01055654   -0.00777718    0.00202667
C    1.70368557   -1.31000053   -0.09631221   -0.01441683   -0.00300632   -0.01133617
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H    2.43598285    2.01693880   -0.06968902    0.01035916   -0.00320418   -0.00734300
H    2.44348418   -2.10810565   -0.25092716    0.00928230   -0.00009677   -0.00400864
C    2.28018666   -0.01861682    0.02155296   -0.00475160   -0.00652008    0.00876877
H    3.35866603    0.05323639    0.01905181   -0.00604324    0.00720650    0.00251448
   15
   -420.53887933
H   -2.69504824    0.48064062    0.04943064   -0.01540815   -0.00215354    0.00452013
O   -2.07330212    1.25707554   -0.06665031   -0.01727088    0.00049595   -0.00474826
O   -1.87712363   -1.26777990    0.02191929    0.01476171   -0.00028066   -0.00176217
C   -0.79394684    0.78717111   -0.00896426    0.01044326    0.02299675   -0.00505896
C   -0.75729725   -0.72494595    0.03067793    0.01165302   -0.00759127   -0.00252538
C    0.30263261    1.60760635    0.05178153   -0.00548985    0.00080219    0.00664632
C    0.38772843   -1.60176118    0.04383895    0.00792214    0.01199093    0.01336961
C    1.69026091    1.21638329    0.02981839    0.00835723   -0.01340762    0.00153447
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   15
   -420.53943088
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   15
   -420.53986971
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   15
   -420.54013661
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   15
   -420.54027547
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   15
   -420.54028840
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   15
   -420.54018113
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   15
   -420.54000573
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   15
   -420.53983081
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   15
   -420.53964846
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   15
   -420.53948708
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   15
   -420.53936428
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O   -1.92207422   -1.27486023    0.02308822    0.00104694   -0.00186481   -0.00619846
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H    3.42272734   -0.04461699   -0.07543672   -0.00334390   -0.00943144   -0.00404032
   15
   -420.53930679
H   -2.66561924    0.53215766    0.12761483   -0.00331157   -0.00335130    0.00815070
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O   -1.92627797   -1.27535374    0.02353897    0.00191129   -0.00142579   -0.00641738
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C    0.39959809   -1.58264559    0.01913195    0.00774471   -0.00877363    0.00095043
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   15
   -420.53932325
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   15
   -420.53944247
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   15
   -420.53962425
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   15
   -420.53989137
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   15
   -420.54013756
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   15
   -420.54036383
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   15
   -420.54055122
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   15
   -420.54069907
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   15
   -420.54081903
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   15
   -420.54086639
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   15
   -420.54087968
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   15
   -420.54081944
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   15
   -420.54065979
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   15
   -420.54036977
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O   -1.99163500   -1.28398326    0.03740656    0.00282967    0.00626266   -0.00352507
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   15
   -420.53998554
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O   -1.99683674   -1.28499792    0.03884075    0.00071036    0.00613486   -0.00294389
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C   -0.85561462   -0.78239118    0.03224890   -0.01143142   -0.01015837    0.00951045
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   15
   -420.53953997
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O   -2.00204628   -1.28608204    0.04030831   -0.00171982    0.00588423   -0.00232181
C   -0.82103977    0.69334433   -0.00401373   -0.01231599    0.01471219    0.00324843
C   -0.85815964   -0.78584274    0.03016606   -0.00969681   -0.01246267    0.00872646
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C    1.69830017    1.23532081    0.04133362   -0.00382064    0.02079959   -0.00261141
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   15
   -420.53903887
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O   -2.00723606   -1.28723283    0.04180216   -0.00441502    0.00553740   -0.00166079
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C    0.38982649   -1.54280065   -0.01432028   -0.00036571   -0.00735620   -0.00838236
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   15
   -420.53854866
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C   -0.82074005    0.68718779   -0.00434923   -0.01562507    0.01643634    0.00314723
C   -0.86284231   -0.79215188    0.02561824   -0.00530041   -0.01604996    0.00687650
C    0.28977790    1.46938619    0.04231995   -0.03238306   -0.03311480   -0.00448347
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C    1.70340208    1.23503858    0.04563690    0.00110216    0.01729428   -0.00010900
C    1.75669694   -1.20936222   -0.02201108    0.01931542    0.01242144    0.00718272
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   15
   -420.53804014
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C   -0.86504620   -0.79495529    0.02318120   -0.00282248   -0.01725041    0.00583311
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C    0.38838274   -1.53564538   -0.01611364    0.00076857    0.00328599   -0.00818417
C    1.70594612    1.23448938    0.04780032    0.00298422    0.01352973    0.00094854
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H    2.39619836   -2.09020890   -0.00937120   -0.00061927   -0.00076207    0.00043883
C    2.41589171    0.04334451   -0.06783450    0.03315263   -0.00835699   -0.01216917
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   15
   -420.53752047
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O   -2.02237095   -1.29104121    0.04636492   -0.01343351    0.00404295    0.00047881
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C   -0.86720745   -0.79749841    0.02065605   -0.00031146   -0.01800686    0.00472465
C    0.29341233    1.46722850    0.04230049   -0.02861694   -0.02719837   -0.00422863
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C    1.70844550    1.23373710    0.04994958    0.00449383    0.00854652    0.00187486
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   15
   -420.53696879
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O   -2.02715758   -1.29241052    0.04788596   -0.01647660    0.00344529    0.00121833
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C   -0.86936386   -0.79976980    0.01805953    0.00209836   -0.01831279    0.00356515
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C    1.75198956   -1.20594002   -0.01102239    0.00398539    0.01000913    0.01154111
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   15
   -420.53639031
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O   -2.03175743   -1.29381888    0.04939318   -0.01939038    0.00281629    0.00195917
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C   -0.87155173   -0.80176487    0.01540916    0.00428408   -0.01816148    0.00236888
C    0.29876584    1.46669784    0.04253539   -0.02244796   -0.01776168   -0.00370840
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C    1.71322320    1.23193830    0.05415086    0.00673586   -0.00404347    0.00345920
C    1.75019881   -1.20512299   -0.00767984   -0.00019128    0.00811642    0.01285726
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C    2.41620841    0.05685035   -0.07913487    0.02934094    0.00795719   -0.01739219
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   15
   -420.53573321
H   -2.67932806    0.64250156   -0.13328091   -0.00284688    0.00252866   -0.00316423
O   -1.96115614    1.31527315   -0.06147346    0.02502725   -0.00202068    0.00153115
O   -2.03613752   -1.29525920    0.05087817   -0.02209293    0.00217433    0.00269440
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C   -0.87380396   -0.80348589    0.01272299    0.00611823   -0.01755596    0.00115089
C    0.30197610    1.46687257    0.04273906   -0.01870985   -0.01259457   -0.00340920
C    0.38529916   -1.52265131   -0.01825707    0.00210524    0.02488238   -0.00660585
C    1.71546730    1.23108129    0.05617884    0.00771329   -0.01095210    0.00418320
C    1.74840980   -1.20442777   -0.00453156   -0.00344067    0.00549384    0.01407401
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H    2.43583854   -2.07235198   -0.00299124    0.01039113   -0.00597566   -0.00044926
C    2.41538025    0.06122363   -0.08241009    0.02526044    0.01355486   -0.01900777
H    3.49274291    0.15445845   -0.02371766   -0.00270512    0.00914872    0.00341568
   15
   -420.53506358
H   -2.67673426    0.65353335   -0.14740030    0.00098430    0.00637751   -0.00319792
O   -1.95879579    1.31453644   -0.06024296    0.02026236   -0.00597778    0.00159130
O   -2.04026726   -1.29672416    0.05233261   -0.02451055    0.00152370    0.00342333
C   -0.81326688    0.66335219   -0.00646549   -0.02456863    0.00367570    0.00274123
C   -0.87614814   -0.80494201    0.01001943    0.00749350   -0.01651214   -0.00007324
C    0.30546889    1.46723802    0.04299427   -0.01465993   -0.00766957   -0.00310935
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C    1.71759472    1.23038974    0.05814359    0.00873923   -0.01775013    0.00489282
C    1.74667151   -1.20381476   -0.00159593   -0.00562669    0.00215884    0.01517081
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H    2.37952802    2.09661577    0.16757744    0.01138146   -0.00414096    0.00265526
H    2.44208470   -2.06550875   -0.00128615    0.01139624   -0.00531480   -0.00060815
C    2.41417107    0.06539219   -0.08539807    0.02044194    0.01900683   -0.02052319
H    3.49588480    0.15585611   -0.02062276    0.00024999    0.00924831    0.00397820
   15
   -420.53436384
H   -2.67431233    0.66342362   -0.16094580    0.00442614    0.00975638   -0.00309672
O   -1.95666521    1.31386694   -0.05903036    0.01541900   -0.00924253    0.00148843
O   -2.04411931   -1.29820638    0.05374823   -0.02657403    0.00085953    0.00413691
C   -0.81081460    0.65890729   -0.00696939   -0.02446032   -0.00058552    0.00267536
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   15
   -420.53375805
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O   -2.04767027   -1.29969837    0.05511694   -0.02824217    0.00021141    0.00483455
C   -0.80799336    0.65447165   -0.00751374   -0.02363612   -0.00517890    0.00261563
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H    2.44843953   -2.04925996    0.00247262    0.01076874   -0.00149348   -0.00080917
C    2.41090184    0.07279019   -0.09042246    0.01062008    0.02891178   -0.02316170
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   15
   -420.53327875
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O   -2.05090126   -1.30119275    0.05643082   -0.02948009   -0.00042799    0.00551143
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C    0.38177963   -1.51532612   -0.01882725    0.00021090    0.03040871   -0.00387000
C    1.72311427    1.23028834    0.06354758    0.01233866   -0.03380983    0.00725848
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   15
   -420.53293031
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O   -2.05379826   -1.30268228    0.05768221   -0.03028273   -0.00104403    0.00615722
C   -0.80130443    0.64590799   -0.00872023   -0.01990843   -0.01476823    0.00249836
C   -0.88672930   -0.80852091   -0.00060139    0.00705726   -0.00869460   -0.00478191
C    0.32099511    1.46928510    0.04444375    0.00307302    0.00385483   -0.00208043
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C    1.72460619    1.23118139    0.06514584    0.01354435   -0.03673893    0.00814581
C    1.74063269   -1.20104785    0.00772069   -0.00364382   -0.01578489    0.01808324
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C    2.40697721    0.07845219   -0.09404955    0.00335006    0.03630352   -0.02510165
H    3.50308581    0.14518827   -0.01631816    0.00878305    0.00762684    0.00568959
   15
   -420.53267942
H   -2.67501095    0.68271378   -0.20953354    0.00336528    0.01030148   -0.00416956
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O   -2.05635216   -1.30416000    0.05886379   -0.03065314   -0.00162254    0.00677173
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C   -0.88966744   -0.80900207   -0.00311921    0.00538829   -0.00612063   -0.00585043
C    0.32493030    1.46972539    0.04489380    0.00737225    0.00429597   -0.00186152
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C    1.72589349    1.23262806    0.06662087    0.01459279   -0.03814743    0.00908153
C    1.73931380   -1.19993783    0.00938830   -0.00124146   -0.02010248    0.01839750
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C    2.40491316    0.08048638   -0.09530076    0.00133796    0.03860967   -0.02577558
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   15
   -420.53246680
H   -2.67754242    0.68234710   -0.22004204   -0.00044485    0.00742144   -0.00518114
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O   -2.05855871   -1.30561937    0.05996860   -0.03061276   -0.00215630    0.00734192
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C   -0.89268638   -0.80939081   -0.00554866    0.00317072   -0.00345814   -0.00685600
C    0.32875436    1.47010157    0.04537200    0.01139410    0.00402963   -0.00165319
C    0.37907697   -1.51452880   -0.01860132   -0.00158729    0.02400354   -0.00189664
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C    1.73801350   -1.19852493    0.01077796    0.00131066   -0.02354947    0.01853772
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H    2.44085496   -2.01818467    0.01173794    0.00260364    0.01054940   -0.00074192
C    2.40282742    0.08193818   -0.09616250    0.00053032    0.03979322   -0.02625394
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   15
   -420.53227826
H   -2.67998973    0.68064783   -0.22961741   -0.00451965    0.00429357   -0.00631276
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O   -2.06041837   -1.30705431    0.06099018   -0.03018609   -0.00265153    0.00786329
C   -0.78914473    0.63490655   -0.01081029   -0.01019849   -0.02792459    0.00225961
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C    0.37821336   -1.51503975   -0.01845586   -0.00180569    0.02138291   -0.00131484
C    1.72779585    1.23724405    0.06914419    0.01568172   -0.03639607    0.01104085
C    1.73669371   -1.19675764    0.01188756    0.00363182   -0.02566170    0.01850034
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H    2.43676059   -2.01382709    0.01441064    0.00074680    0.01246687   -0.00064238
C    2.40073228    0.08278985   -0.09662752    0.00086282    0.03974574   -0.02653914
H    3.49413013    0.12261515   -0.02345669    0.00602106    0.00474768    0.00575156
   15
   -420.53210665
H   -2.68163049    0.67817346   -0.23805766   -0.00813088    0.00139696   -0.00740634
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O   -2.06193592   -1.30845924    0.06192262   -0.02941687   -0.00308899    0.00833299
C   -0.78471231    0.63199951   -0.01157708   -0.00630242   -0.03141647    0.00214162
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C    0.37737673   -1.51587452   -0.01829048   -0.00174897    0.01917745   -0.00076375
C    1.72839481    1.24038723    0.07016292    0.01545635   -0.03351822    0.01201845
C    1.73531965   -1.19460442    0.01271767    0.00541326   -0.02607613    0.01828281
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C    2.39862296    0.08304206   -0.09669150    0.00213924    0.03844605   -0.02664244
H    3.48860952    0.11313783   -0.02792230    0.00343453    0.00368682    0.00553112
   15
   -420.53206998
H   -2.68182186    0.67543846   -0.24516747   -0.01075591   -0.00084364   -0.00830724
O   -1.94386827    1.31200952   -0.05015712    0.01071955    0.00672884    0.00637930
O   -2.06312007   -1.30982916    0.06276057   -0.02834920   -0.00348290    0.00874532
C   -0.78018477    0.62956670   -0.01237621   -0.00225931   -0.03426242    0.00199540
C   -0.90185912   -0.81040081   -0.01216045   -0.00596807    0.00402124   -0.00940477
C    0.33898667    1.47091442    0.04694521    0.02052245    0.00134115   -0.00111944
C    0.37656616   -1.51700020   -0.01811350   -0.00138198    0.01771416   -0.00023497
C    1.72876085    1.24403601    0.07099997    0.01458004   -0.02964799    0.01296491
C    1.73386462   -1.19205926    0.01327157    0.00649045   -0.02457757    0.01788331
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H    2.29632329    2.16711274    0.09533838   -0.00481123   -0.00185535   -0.00147743
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C    2.39648056    0.08271452   -0.09635286    0.00403158    0.03589105   -0.02657287
H    3.48247683    0.10299779   -0.03338207    0.00041714    0.00262115    0.00522506
   15
   -420.53211611
H   -2.68009604    0.67284163   -0.25078634   -0.01205352   -0.00216488   -0.00888968
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O   -2.06398288   -1.31115963    0.06349938   -0.02703390   -0.00380567    0.00908755
C   -0.77562310    0.62765101   -0.01320548    0.00181598   -0.03636618    0.00181985
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C    1.72890730    1.24813228    0.07164106    0.01299818   -0.02513122    0.01384920
C    1.73231233   -1.18914481    0.01355531    0.00687925   -0.02117347    0.01730271
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C    2.39427692    0.08184576   -0.09561266    0.00613397    0.03216847   -0.02633629
H    3.47626957    0.09238526   -0.03978137   -0.00265414    0.00160812    0.00486221
   15
   -420.53231713
H   -2.67622142    0.67061863   -0.25481072   -0.01188393   -0.00243485   -0.00907346
O   -1.94173449    1.31154508   -0.04844730    0.00777151    0.00963952    0.00725441
O   -2.06453923   -1.31244693    0.06413517   -0.02551672   -0.00408326    0.00936495
C   -0.77108882    0.62628419   -0.01406221    0.00584797   -0.03766286    0.00161182
C   -0.90760079   -0.81131148   -0.01587942   -0.01319767    0.00764627   -0.01065571
C    0.34433873    1.47132805    0.04808340    0.02338495   -0.00022457   -0.00087720
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C    1.72885808    1.25260814    0.07207285    0.01069829   -0.02030542    0.01465337
C    1.73065666   -1.18591226    0.01357767    0.00677572   -0.01611035    0.01654349
H    0.02227233    2.52107740    0.04643830   -0.00405863    0.00525296   -0.00224274
H    0.24029784   -2.59094315   -0.06023109    0.00518494    0.00758312   -0.00399980
H    2.27571425    2.18398532    0.08012087   -0.00885688   -0.00233772   -0.00199157
H    2.42021156   -2.01877283    0.02598616    0.00108306    0.00763796    0.00010628
C    2.39198088    0.08049187   -0.09447445    0.00794978    0.02741635   -0.02593734
H    3.47053458    0.08148241   -0.04705560   -0.00534899    0.00065222    0.00446838
   15
   -420.53253895
H   -2.67022898    0.66881881   -0.25720785   -0.01024494   -0.00165399   -0.00883206
O   -1.94080995    1.31115553   -0.04771385    0.00460488    0.00938313    0.00713079
O   -2.06480628   -1.31368796    0.06466479   -0.02384214   -0.00430552    0.00957379
C   -0.76664281    0.62548578   -0.01494329    0.00976087   -0.03811522    0.00137787
C   -0.91019993   -0.81192719   -0.01750179   -0.01689114    0.00884038   -0.01113538
C    0.34649380    1.47153438    0.04867324    0.02374797   -0.00068584   -0.00079863
C    0.37421419   -1.52196580   -0.01759217    0.00121339    0.01812683    0.00126133
C    1.72864791    1.25739095    0.07228319    0.00774754   -0.01545656    0.01536248
C    1.72889877   -1.18243764    0.01335011    0.00647847   -0.00979814    0.01561929
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H    0.24760323   -2.59724168   -0.06235877    0.00561755    0.00498432   -0.00420184
H    2.26762973    2.19304119    0.07302843   -0.01007690   -0.00176435   -0.00216024
H    2.41595214   -2.02451246    0.02893284    0.00261844    0.00394085    0.00039485
C    2.38956555    0.07872451   -0.09294428    0.00901958    0.02180848   -0.02537001
H    3.46575128    0.07046140   -0.05513396   -0.00726486   -0.00024431    0.00405536
   15
   -420.53272940
H   -2.66241089    0.66730301   -0.25802050   -0.00731559    0.00008250   -0.00820885
O   -1.93993679    1.31066049   -0.04706094    0.00051523    0.00807106    0.00663864
O   -2.06480297   -1.31488021    0.06508587   -0.02206647   -0.00447757    0.00971722
C   -0.76234417    0.62526264   -0.01584517    0.01350556   -0.03771949    0.00111745
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C    0.34829068    1.47175085    0.04927521    0.02341047   -0.00096509   -0.00075280
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   15
   -420.53284708
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O   -2.06454941   -1.31602168    0.06539678   -0.02022491   -0.00462454    0.00980072
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   15
   -420.53283557
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O   -2.06406644   -1.31711075    0.06559656   -0.01837502   -0.00474339    0.00983329
C   -0.75441202    0.62650591   -0.01769533    0.02030052   -0.03450091    0.00054744
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C    0.37168952   -1.52942373   -0.01723841    0.00452799    0.02064932    0.00234026
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C    2.38153147    0.07183104   -0.08610254    0.00514736    0.00210732   -0.02244052
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   15
   -420.53272390
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O   -2.06337499   -1.31814601    0.06568485   -0.01655719   -0.00486510    0.00981878
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C   -0.91750710   -0.81580033   -0.02225850   -0.03028440    0.00921211   -0.01207571
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C    0.37073316   -1.53252037   -0.01718502    0.00553540    0.02045138    0.00251279
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C    1.72087554   -1.16813771    0.01024871    0.00877301    0.01801006    0.01082689
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H    2.39181454   -2.04775672    0.03939870    0.00603072   -0.00916549    0.00176720
C    2.37865568    0.06933317   -0.08312084    0.00169423   -0.00463557   -0.02097192
H    3.45991234    0.02830156   -0.09391506   -0.00360895   -0.00343712    0.00193833
   15
   -420.53258399
H   -2.62527238    0.65635498   -0.24829365    0.00807693    0.00998911   -0.00439373
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O   -2.06249565   -1.31912606    0.06566178   -0.01481585   -0.00500720    0.00976837
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C   -0.91830831   -0.81712815   -0.02299672   -0.03292195    0.00834421   -0.01207289
C    0.35213717    1.47280023    0.05179571    0.01640350   -0.00289004   -0.00076760
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C    1.72695328    1.28346089    0.06969949   -0.01082055    0.00555623    0.01706972
C    1.71857866   -1.16498875    0.00901622    0.01081870    0.02343374    0.00953472
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H    2.38323337   -2.05068480    0.04137604    0.00529864   -0.01043344    0.00208149
C    2.37575487    0.06690505   -0.07982237   -0.00225484   -0.01109254   -0.01924577
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   15
   -420.53251274
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O   -2.06144814   -1.32004926    0.06552794   -0.01320320   -0.00519333    0.00968842
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C    0.36855595   -1.53962178   -0.01719269    0.00724879    0.01735676    0.00251756
C    1.72688157    1.28866213    0.06841937   -0.01380670    0.00940233    0.01696526
C    1.71611764   -1.16219258    0.00763953    0.01336478    0.02761119    0.00828148
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C    2.37288815    0.06464403   -0.07623319   -0.00620780   -0.01705162   -0.01728455
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   15
   -420.53259946
H   -2.61245083    0.64206233   -0.23792982    0.00956495    0.00973368   -0.00420623
O   -1.93310658    1.30667844   -0.04441405   -0.01593713   -0.00109994    0.00367790
O   -2.06025070   -1.32091350    0.06528422   -0.01176897   -0.00543870    0.00958500
C   -0.74255075    0.63484823   -0.02145865    0.02995149   -0.02036466   -0.00063273
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C    0.36730922   -1.54357972   -0.01725384    0.00792726    0.01441627    0.00235554
C    1.72701781    1.29372118    0.06688296   -0.01612696    0.01328506    0.01669058
C    1.71345413   -1.15981215    0.00613755    0.01626213    0.03036576    0.00709671
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C    2.37011472    0.06263997   -0.07238291   -0.00969378   -0.02232421   -0.01513461
H    3.46280016    0.00264250   -0.12689277    0.00522664   -0.00540568   -0.00067731
   15
   -420.53284674
H   -2.60859915    0.63223893   -0.23161594    0.00782198    0.00737981   -0.00475539
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O   -2.05891955   -1.32171598    0.06493180   -0.01056486   -0.00576085    0.00946261
C   -0.74064005    0.63785496   -0.02238658    0.03121207   -0.01584323   -0.00091566
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C    0.36594279   -1.54775466   -0.01735047    0.00847324    0.01068146    0.00209656
C    1.72739694    1.29857929    0.06509440   -0.01767280    0.01722792    0.01623509
C    1.71054458   -1.15788900    0.00452816    0.01930125    0.03162397    0.00600161
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C    2.36748679    0.06097240   -0.06830397   -0.01231675   -0.02675259   -0.01285104
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   15
   -420.53325147
H   -2.60613939    0.62110207   -0.22444244    0.00495073    0.00398155   -0.00553252
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O   -2.05746830   -1.32245302    0.06447204   -0.00964178   -0.00617593    0.00932185
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C   -0.91625098   -0.82350959   -0.02414510   -0.03820193    0.00266146   -0.01123440
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C    1.72804228    1.30317687    0.06306061   -0.01838771    0.02119567    0.01559535
C    1.70734335   -1.15644226    0.00282790    0.02221672    0.03144779    0.00500688
H    0.09367034    2.52349766    0.05718911    0.00997628   -0.00450259   -0.00183486
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H    2.34269599   -2.04448071    0.04511235   -0.00404215   -0.00482935    0.00280477
C    2.36504366    0.05970815   -0.06403082   -0.01379070   -0.03020068   -0.01050216
H    3.46104131   -0.00980924   -0.14853799    0.00855033   -0.00621946   -0.00267073
   15
   -420.53369059
H   -2.60456395    0.60925517   -0.21627286    0.00160254    0.00011891   -0.00631015
O   -1.92758636    1.30463691   -0.04371389   -0.00365461    0.00767803    0.00608734
O   -2.05590739   -1.32311993    0.06390657   -0.00903728   -0.00668685    0.00916037
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C   -0.91432112   -0.82526499   -0.02399693   -0.03778048    0.00093348   -0.01084361
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C    1.72896466    1.30745405    0.06079123   -0.01827841    0.02509003    0.01477652
C    1.70380675   -1.15546955    0.00105183    0.02469417    0.03006705    0.00410611
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H    2.33311255   -2.03971389    0.04484031   -0.00718319   -0.00153217    0.00283730
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   15
   -420.53419996
H   -2.60327850    0.59738465   -0.20696971   -0.00160184   -0.00360087   -0.00691561
O   -1.92559057    1.30383352   -0.04360532    0.00156602    0.01102705    0.00676399
O   -2.05424365   -1.32371091    0.06323720   -0.00878984   -0.00728383    0.00897438
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C   -0.91182109   -0.82703444   -0.02368487   -0.03651125   -0.00085194   -0.01039024
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C    0.36105530   -1.56098255   -0.01780902    0.00909836   -0.00254156    0.00093800
C    1.73016244    1.31135213    0.05829864   -0.01738094    0.02877684    0.01378738
C    1.69989776   -1.15495040   -0.00078643    0.02637324    0.02784506    0.00328776
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H    2.28956629    2.25028932    0.02436401   -0.00409600    0.00811891   -0.00245383
H    2.32481914   -2.03467203    0.04405800   -0.01009944    0.00181910    0.00283313
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H    3.45336160   -0.01781638   -0.16827450    0.00798584   -0.00645736   -0.00442459
   15
   -420.53479013
H   -2.60171427    0.58615325   -0.19642584   -0.00415627   -0.00673722   -0.00722668
O   -1.92361222    1.30290569   -0.04357318    0.00644758    0.01371416    0.00713481
O   -2.05247988   -1.32421917    0.06246606   -0.00890916   -0.00796552    0.00875847
C   -0.73774587    0.65157421   -0.02591705    0.02892619    0.00233618   -0.00208096
C   -0.90877012   -0.82879100   -0.02321580   -0.03435357   -0.00267090   -0.00987850
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C    0.35915292   -1.56540483   -0.01799864    0.00896674   -0.00635285    0.00048155
C    1.73162214    1.31481560    0.05559779   -0.01577925    0.03206299    0.01264083
C    1.69559143   -1.15485183   -0.00267445    0.02688348    0.02528525    0.00251974
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H    2.29848401    2.24650266    0.02276337   -0.00382492    0.00632838   -0.00228167
H    2.31833515   -2.02995092    0.04276583   -0.01241872    0.00470709    0.00281310
C    2.35894524    0.05877265   -0.05039924   -0.01029328   -0.03384908   -0.00367581
H    3.44731553   -0.02008315   -0.17702478    0.00622361   -0.00633006   -0.00508865
   15
   -420.53547119
H   -2.59941582    0.57611961   -0.18458700   -0.00574952   -0.00893136   -0.00716849
O   -1.92170640    1.30182321   -0.04362167    0.01067911    0.01543076    0.00716418
O   -2.05061473   -1.32463702    0.06159561   -0.00938777   -0.00870748    0.00850392
C   -0.73816642    0.65508329   -0.02673236    0.02605576    0.00631631   -0.00240461
C   -0.90520080   -0.83050711   -0.02259742   -0.03130790   -0.00452336   -0.00931438
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C    0.35711526   -1.56973240   -0.01819553    0.00863497   -0.00912457    0.00000427
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   15
   -420.53629526
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   15
   -420.53723470
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   15
   -420.53823360
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   15
   -420.53914529
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   15
   -420.53978832
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O   -2.03946325   -1.32507045    0.05587439   -0.01539073   -0.01234576    0.00647338
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   15
   -420.54011779
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   15
   -420.54015225
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   15
   -420.53988652
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O   -2.03080849   -1.32371928    0.05152263   -0.01855095   -0.01365577    0.00468298
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   15
   -420.53945637
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   15
   -420.53893111
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O   -2.02400963   -1.32205286    0.04834460   -0.01883939   -0.01396461    0.00333254
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C    1.75475870    1.32026973    0.01823985    0.01346257    0.00210443   -0.00478541
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C    2.33666453    0.08390782   -0.00193642    0.00852539    0.02132040    0.01683880
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   15
   -420.53841943
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O   -2.02028983   -1.32098274    0.04669502   -0.01825727   -0.01393135    0.00263088
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C   -0.85165975   -0.83867903   -0.00878954    0.02574262   -0.02254412   -0.00122097
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C    1.63092045   -1.17825468   -0.02526346   -0.03617885    0.00857664   -0.00401970
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   15
   -420.53794293
H   -2.56414228    0.53637500    0.01923493    0.00575594    0.00043392    0.00217322
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O   -2.01636340   -1.31975472    0.04501561   -0.01716276   -0.01376507    0.00191826
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C   -0.84764893   -0.83778347   -0.00719036    0.02814669   -0.02300600   -0.00048707
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   15
   -420.53752600
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O   -2.01224275   -1.31837067    0.04331444   -0.01556001   -0.01346197    0.00120868
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   15
   -420.53709835
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O   -2.00794605   -1.31683405    0.04159953   -0.01347065   -0.01301339    0.00051343
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   15
   -420.53679396
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   15
   -420.53659877
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O   -1.99892424   -1.31332502    0.03815979   -0.00799066   -0.01169483   -0.00079426
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C    1.76032038    1.31454800   -0.00071220    0.02975919   -0.02000299   -0.01158220
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   15
   -420.53655546
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O   -1.99426120   -1.31136757    0.03644976   -0.00470311   -0.01084276   -0.00138028
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C    1.75989637    1.31447742   -0.00334060    0.03149675   -0.01933756   -0.01224088
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   15
   -420.53675829
H   -2.58833258    0.52677309    0.11304086   -0.00775335   -0.00747280    0.00776823
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O   -1.98954506   -1.30928722    0.03475532   -0.00113677   -0.00988520   -0.00190902
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C    1.75899697    1.31469791   -0.00578409    0.03256908   -0.01759710   -0.01276916
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   15
   -420.53717802
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O   -1.98481622   -1.30709482    0.03308249    0.00264318   -0.00884756   -0.00237601
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   15
   -420.53773673
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O   -1.98011749   -1.30480210    0.03143654    0.00656216   -0.00776511   -0.00277692
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C    1.75571977    1.31589573   -0.01008603    0.03221856   -0.01194993   -0.01348883
C    1.61561618   -1.20723478   -0.03744692   -0.02280011   -0.01211437   -0.00453948
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   15
   -420.53831249
H   -2.58631474    0.53778026    0.14344981   -0.00187902    0.00062771    0.00708535
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C    1.75334745    1.31678839   -0.01193360    0.03066177   -0.00861608   -0.01369357
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   15
   -420.53876202
H   -2.58435119    0.54200940    0.15092195    0.00136203    0.00459137    0.00621400
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C   -0.71874041    0.68029991   -0.02711732   -0.00184136   -0.01809815   -0.00704364
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C    1.75051262    1.31781129   -0.01357425    0.02820332   -0.00525677   -0.01380369
C    1.61672266   -1.21175752   -0.03940254   -0.02320664   -0.00245991   -0.00396467
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H    2.36003221   -1.99889326   -0.09732716   -0.00028268    0.00727427   -0.00196059
C    2.29789061    0.07398232    0.01968544    0.01224790    0.02488705    0.01532013
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   15
   -420.53902379
H   -2.58263087    0.54541378    0.15727671    0.00445142    0.00843663    0.00525424
O   -1.94162066    1.25437017   -0.05003266   -0.00844065   -0.00457731   -0.00498977
O   -1.96664710   -1.29744478    0.02670195    0.01819840   -0.00460262   -0.00360934
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C   -0.82815947   -0.80814999    0.00892107   -0.00566743   -0.00220669    0.00424343
C    0.34448275    1.59591023    0.06245843    0.00387295    0.01416990    0.00796113
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C    1.74725234    1.31891380   -0.01500630    0.02495169   -0.00200561   -0.01382042
C    1.61779947   -1.21392389   -0.04028802   -0.02353482    0.00339937   -0.00354556
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H    2.36238474   -2.00913018   -0.10419927    0.00240554    0.00331332   -0.00248502
C    2.29403455    0.06954712    0.01968704    0.01199823    0.01879505    0.01420028
H    3.37243764    0.04367940   -0.02033326   -0.00549850    0.00608545   -0.00102669
   15
   -420.53902164
H   -2.58170070    0.54731027    0.16268362    0.00676358    0.01153122    0.00442703
O   -1.94492308    1.25175472   -0.04976371   -0.01452720   -0.00780071   -0.00418898
O   -1.96251204   -1.29487241    0.02520201    0.02168611   -0.00370697   -0.00378200
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C   -0.82734411   -0.80443026    0.01008057   -0.01096279    0.00080405    0.00429487
C    0.34341866    1.60044174    0.06155648    0.00232018    0.01555486    0.00809082
C    0.31304385   -1.66090519   -0.00608189   -0.01901418   -0.01644907   -0.00373123
C    1.74361555    1.32004683   -0.01622951    0.02108387    0.00108447   -0.01374541
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   15
   -420.53886123
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O   -1.94806211    1.24922660   -0.04944694   -0.01907936   -0.00979413   -0.00372832
O   -1.95862261   -1.29225788    0.02374493    0.02477734   -0.00293974   -0.00391318
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   15
   -420.53860675
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O   -1.95501377   -1.28960985    0.02233220    0.02735331   -0.00233630   -0.00400926
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C   -0.82514301   -0.79707094    0.01220519   -0.02028486    0.00647505    0.00421354
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C    1.73545131    1.32221954   -0.01805529    0.01238085    0.00691036   -0.01332529
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C    2.28149352    0.05491837    0.01847865    0.00446036    0.00003829    0.01023705
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   15
   -420.53829910
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O   -1.95171464   -1.28693515    0.02096493    0.02930848   -0.00192418   -0.00407649
C   -0.69722217    0.68722398   -0.02067410    0.02914949   -0.02419040   -0.00647943
C   -0.82361677   -0.79351695    0.01317152   -0.02395918    0.00902859    0.00408852
C    0.34011533    1.61255312    0.05811125   -0.00243723    0.01841185    0.00825038
C    0.31633727   -1.66700722   -0.00145783   -0.01595098   -0.01740766   -0.00127871
C    1.73105492    1.32317095   -0.01866420    0.00799300    0.00978648   -0.01298673
C    1.62558663   -1.22393800   -0.04336148   -0.01841084    0.02244939   -0.00192483
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C    2.27711495    0.04991574    0.01773807    0.00059589   -0.00576103    0.00865209
H    3.36725839    0.02277958    0.05822289    0.00227983    0.00385474    0.00276626
   15
   -420.53798381
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O   -1.94874731   -1.28423841    0.01964386    0.03054272   -0.00171772   -0.00411575
C   -0.69387419    0.68967525   -0.01908242    0.03460412   -0.02360475   -0.00626336
C   -0.82172928   -0.79009919    0.01407608   -0.02677350    0.01134412    0.00391749
C    0.33905680    1.61604824    0.05671376   -0.00365352    0.01835707    0.00815427
C    0.31793779   -1.66852891    0.00014015   -0.01504626   -0.01902693   -0.00025659
C    1.72653739    1.32397432   -0.01907686    0.00384354    0.01273136   -0.01257231
C    1.62830672   -1.22713919   -0.04404341   -0.01500255    0.02449996   -0.00171657
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C    2.27272739    0.04499960    0.01686681   -0.00328310   -0.01107204    0.00696009
H    3.36604846    0.01550245    0.07707077    0.00476338    0.00294695    0.00387548
   15
   -420.53767530
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C   -0.69104869    0.69248270   -0.01739608    0.03952578   -0.02247511   -0.00600877
C   -0.81943812   -0.78685262    0.01492144   -0.02859308    0.01338516    0.00370399
C    0.33805313    1.61926665    0.05519311   -0.00453121    0.01758895    0.00796143
C    0.31976594   -1.66976224    0.00174191   -0.01423082   -0.02124409    0.00082914
C    1.72196128    1.32458506   -0.01929952    0.00006859    0.01578173   -0.01209147
C    1.63125280   -1.23070908   -0.04469923   -0.01084875    0.02509930   -0.00163843
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H    2.35683979   -2.06292868   -0.13310430    0.00508472   -0.00826973   -0.00442064
C    2.26838907    0.04025010    0.01589039   -0.00680059   -0.01576200    0.00521223
H    3.36398798    0.00769642    0.09522059    0.00677185    0.00194347    0.00499946
   15
   -420.53741854
H   -2.59778677    0.51429890    0.17807682   -0.00634291    0.00215318    0.00788909
O   -1.96021779    1.23809639   -0.04713637   -0.01828840   -0.00097406   -0.00753958
O   -1.94385481   -1.27878568    0.01714200    0.03059130   -0.00195487   -0.00413870
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C   -0.81671591   -0.78380804    0.01571083   -0.02934387    0.01511473    0.00345700
C    0.33711747    1.62221998    0.05355215   -0.00498269    0.01610083    0.00769332
C    0.32180933   -1.67067386    0.00333111   -0.01347765   -0.02387252    0.00193498
C    1.71738353    1.32495704   -0.01933944   -0.00321839    0.01894299   -0.01155798
C    1.63436227   -1.23465670   -0.04533010   -0.00613809    0.02422428   -0.00169913
H    0.06329567    2.66319985    0.15987375    0.00558761   -0.00222109    0.00345918
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H    2.35185766   -2.06731823   -0.13531324    0.00249515   -0.00675001   -0.00430965
C    2.26415286    0.03573808    0.01483518   -0.00967692   -0.01974091    0.00345970
H    3.36071966   -0.00045813    0.11247047    0.00802453    0.00087621    0.00608656
   15
   -420.53716079
H   -2.60020274    0.50421898    0.17676552   -0.00953505   -0.00083720    0.00881182
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O   -1.94193016   -1.27602705    0.01596146    0.02936680   -0.00238427   -0.00411953
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C   -0.81355139   -0.78099159    0.01644798   -0.02898617    0.01650103    0.00318181
C    0.33625660    1.62493066    0.05179497   -0.00497535    0.01397620    0.00734926
C    0.32405655   -1.67122436    0.00489107   -0.01277201   -0.02664786    0.00303097
C    1.71285380    1.32504251   -0.01920466   -0.00597180    0.02217464   -0.01097930
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H    2.34643440   -2.07050555   -0.13674779   -0.00069937   -0.00435666   -0.00406970
C    2.26006200    0.03152357    0.01372753   -0.01171715   -0.02291823    0.00178693
H    3.35601898   -0.00876961    0.12862597    0.00839566   -0.00023546    0.00707671
   15
   -420.53693816
H   -2.60091659    0.49427763    0.17387271   -0.01169806   -0.00299371    0.00939070
O   -1.96351248    1.23394187   -0.04570094   -0.01525352    0.00296981   -0.00906675
O   -1.94033789   -1.27324123    0.01482764    0.02733908   -0.00298194   -0.00408312
C   -0.68639709    0.70283708   -0.01181101    0.04974038   -0.01650308   -0.00497835
C   -0.80994999   -0.77842417    0.01713705   -0.02751612    0.01750698    0.00288931
C    0.33547037    1.62743058    0.04992672   -0.00449570    0.01139300    0.00695629
C    0.32649687   -1.67137224    0.00640524   -0.01204871   -0.02921185    0.00409727
C    1.70841370    1.32479275   -0.01890393   -0.00817368    0.02538058   -0.01037128
C    1.64078306   -1.24361110   -0.04651142    0.00385969    0.01847061   -0.00219427
H    0.07489631    2.67486335    0.15130255    0.00640102   -0.00031406    0.00359801
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H    2.39389194    2.17875803   -0.00705000    0.00117767    0.00611155   -0.00138839
H    2.34114125   -2.07291758   -0.13745104   -0.00423354   -0.00138325   -0.00372632
C    2.25614713    0.02765455    0.01259266   -0.01280762   -0.02524117    0.00025824
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   15
   -420.53684020
H   -2.59954141    0.48485916    0.16929556   -0.01264292   -0.00408565    0.00955764
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C   -0.80593383   -0.77612094    0.01778244   -0.02498759    0.01809558    0.00258630
C    0.33475157    1.62975850    0.04795333   -0.00356531    0.00860351    0.00653835
C    0.32911918   -1.67107923    0.00785750   -0.01122676   -0.03113604    0.00512342
C    1.70409658    1.32415945   -0.01844639   -0.00985947    0.02842694   -0.00975009
C    1.64394410   -1.24853167   -0.04705452    0.00839990    0.01417974   -0.00254366
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C    2.25242473    0.02416610    0.01145370   -0.01294352   -0.02669126   -0.00109767
H    3.34223244   -0.02506351    0.15696827    0.00626603   -0.00245834    0.00857886
   15
   -420.53687476
H   -2.59590849    0.47616035    0.16300370   -0.01232133   -0.00406154    0.00932734
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O   -1.93805061   -1.26755939    0.01269834    0.02121330   -0.00453695   -0.00395826
C   -0.68696178    0.71103820   -0.00770286    0.05158447   -0.01120763   -0.00407078
C   -0.80154104   -0.77409074    0.01838874   -0.02149842    0.01822993    0.00228008
C    0.33408618    1.63195626    0.04588108   -0.00222904    0.00587743    0.00613103
C    0.33191087   -1.67031670    0.00923233   -0.01018899   -0.03203076    0.00611081
C    1.69992800    1.32309669   -0.01784143   -0.01109590    0.03115264   -0.00912456
C    1.64697923   -1.25366629   -0.04755908    0.01201728    0.00957609   -0.00291942
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H    2.37971191    2.17477288   -0.00988817   -0.00204884    0.00408461   -0.00183598
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C    2.24889704    0.02108012    0.01033113   -0.01222949   -0.02725164   -0.00223501
H    3.33352793   -0.03264767    0.16888575    0.00390431   -0.00348243    0.00902698
   15
   -420.53709012
H   -2.59007587    0.46817775    0.15503951   -0.01077711   -0.00296610    0.00870824
O   -1.96715177    1.22747900   -0.04278263   -0.01528356    0.00127573   -0.00872165
O   -1.93728632   -1.26464589    0.01170147    0.01734861   -0.00537742   -0.00387510
C   -0.68840921    0.71541337   -0.00555294    0.05076147   -0.00842319   -0.00356262
C   -0.79682421   -0.77233560    0.01896055   -0.01717245    0.01788704    0.00197877
C    0.33345406    1.63406476    0.04371608   -0.00054807    0.00348077    0.00575620
C    0.33485629   -1.66907153    0.01051482   -0.00888061   -0.03151747    0.00706813
C    1.69592673    1.32156362   -0.01709849   -0.01195570    0.03332005   -0.00850574
C    1.64983427   -1.25894602   -0.04801959    0.01425883    0.00518790   -0.00324643
H    0.08377882    2.69202065    0.13357311    0.00590068    0.00404881    0.00371343
H    0.10487254   -2.72038475   -0.03831689    0.00283933    0.00503755   -0.00074165
H    2.37302354    2.17157676   -0.01083123   -0.00374797    0.00278961   -0.00202659
H    2.33223613   -2.08087598   -0.13582582   -0.01284833    0.00668423   -0.00258029
C    2.24555344    0.01840513    0.00924215   -0.01084532   -0.02698140   -0.00315410
H    3.32412996   -0.03960644    0.17918170    0.00090094   -0.00444076    0.00923858
   15
   -420.53747064
H   -2.58231805    0.46071594    0.14551146   -0.00821447   -0.00095820    0.00783679
O   -1.96802433    1.22527681   -0.04160696   -0.01623954   -0.00126411   -0.00803090
O   -1.93671851   -1.26167145    0.01074853    0.01315464   -0.00618610   -0.00376964
C   -0.69062269    0.71991590   -0.00334920    0.04872216   -0.00563303   -0.00302332
C   -0.79184852   -0.77085030    0.01950245   -0.01219058    0.01704650    0.00168501
C    0.33282993    1.63611994    0.04146401    0.00138535    0.00164178    0.00542267
C    0.33793553   -1.66735173    0.01169046   -0.00721805   -0.02939162    0.00801890
C    1.69210593    1.31952764   -0.01622695   -0.01257311    0.03473639   -0.00789857
C    1.65247585   -1.26430505   -0.04843114    0.01474739    0.00148009   -0.00348797
H    0.08454860    2.69662876    0.12633205    0.00547318    0.00511224    0.00368229
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   15
   -420.53798252
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   15
   -420.53859509
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   15
   -420.53917557
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C   -0.70146077    0.73377076    0.00350215    0.03561043    0.00230511   -0.00131607
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C    0.34769619   -1.65978509    0.01443174   -0.00009526   -0.01431073    0.01089635
C    1.68181153    1.31026675   -0.01293092   -0.01381578    0.03257860   -0.00620420
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H    2.35057880   -2.10611840   -0.12712518   -0.00838529    0.00188870   -0.00221569
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   15
   -420.53970611
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C    1.67879036    1.30616516   -0.01163357   -0.01409257    0.02948747   -0.00569502
C    1.66117258   -1.28562434   -0.04953525    0.00007500   -0.00498664   -0.00369679
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H    2.35416769    2.15145802   -0.00957582   -0.00714466    0.00066992   -0.00251945
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   15
   -420.54009285
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O   -1.96950291    1.21519463   -0.03454100   -0.01302765   -0.01383648   -0.00479989
O   -1.93514218   -1.24560615    0.00659394   -0.00698438   -0.00829052   -0.00295748
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C   -0.76590288   -0.76677401    0.02191075    0.01568811    0.00611508    0.00044023
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C    2.22811949    0.00994540    0.00401479   -0.00723250   -0.01020520   -0.00621830
H    3.28371098   -0.05979351    0.20647688   -0.01164417   -0.00803707    0.00875745
   15
   -420.54034804
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O   -1.96926875    1.21356876   -0.03294233   -0.00839979   -0.01326631   -0.00455578
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C   -0.71705221    0.74732272    0.01053342    0.01442601    0.00932359    0.00032595
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H    2.38069367   -2.12932370   -0.11638740    0.00232515   -0.00806658   -0.00213322
C    2.22555553    0.00940367    0.00343126   -0.00995436   -0.00554429   -0.00677722
H    3.28328050   -0.05855676    0.20544412   -0.01034067   -0.00822655    0.00890081
   15
   -420.54042514
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O   -1.93426335   -1.23854296    0.00518126   -0.01205474   -0.00785889   -0.00245481
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C   -0.75659127   -0.76606426    0.02280279    0.02448611   -0.00026772    0.00004189
C    0.32615967    1.64990771    0.02360974    0.01312953    0.00848133    0.00374414
C    0.36050670   -1.64719958    0.01572680    0.01094920    0.01051897    0.01387042
C    1.67100688    1.29145580   -0.00725299   -0.01352003    0.01477825   -0.00436509
C    1.66747264   -1.30087687   -0.04977225   -0.01630084   -0.00893133   -0.00417095
H    0.06800925    2.70389947    0.05897975    0.00141609   -0.00044986    0.00195467
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H    2.35740427    2.13745180   -0.00352259   -0.00378373    0.00407463   -0.00236199
H    2.39075027   -2.13491921   -0.11202364    0.00519915   -0.01025944   -0.00194142
C    2.22314326    0.00894544    0.00295022   -0.01356664   -0.00066978   -0.00734277
H    3.28469656   -0.05584312    0.20280688   -0.00813158   -0.00825555    0.00910307
   15
   -420.54040657
H   -2.51241874    0.37393271    0.03205762    0.00466671    0.00247303    0.00254491
O   -1.96858545    1.21074401   -0.02959275    0.00441719   -0.00860561   -0.00394956
O   -1.93363234   -1.23487601    0.00451816   -0.01362020   -0.00739015   -0.00213906
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C   -0.75245880   -0.76572786    0.02324637    0.02777917   -0.00352936   -0.00013748
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C    0.36339572   -1.64423314    0.01554977    0.01306528    0.01463324    0.01419162
C    1.66882916    1.28599766   -0.00565231   -0.01249751    0.00896705   -0.00398680
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C    2.22093682    0.00849726    0.00258013   -0.01773216    0.00424199   -0.00784249
H    3.28756712   -0.05164647    0.19853058   -0.00533103   -0.00809407    0.00930096
   15
   -420.54023186
H   -2.50737649    0.35815757    0.01497193    0.00296006   -0.00114522    0.00189486
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C    1.66683975    1.28040390   -0.00399130   -0.01094588    0.00321033   -0.00363898
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H    2.36332728    2.12486012    0.00265141   -0.00097640    0.00594704   -0.00204046
H    2.40772189   -2.14040356   -0.10230403    0.00836371   -0.01148755   -0.00128043
C    2.21899869    0.00798517    0.00232845   -0.02205988    0.00898275   -0.00820769
H    3.29139455   -0.04599555    0.19258097   -0.00232013   -0.00771862    0.00942236
   15
   -420.53994946
H   -2.50286647    0.34258623   -0.00245156    0.00127451   -0.00465988    0.00100082
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O   -1.93189842   -1.22729810    0.00326050   -0.01478550   -0.00596745   -0.00136338
C   -0.74028208    0.76328471    0.01980915   -0.01742551    0.01731261    0.00217239
C   -0.74548760   -0.76484702    0.02414224    0.03177039   -0.00976578   -0.00045740
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C    1.66501522    1.27476120   -0.00227525   -0.00887778   -0.00219848   -0.00331587
C    1.67588189   -1.31484497   -0.04943117   -0.02342364   -0.01860239   -0.00552567
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C    2.21739380    0.00733773    0.00220066   -0.02614817    0.01334540   -0.00837695
H    3.29564234   -0.03895819    0.18493757    0.00052270   -0.00711883    0.00938632
   15
   -420.53958373
H   -2.49858995    0.32784695   -0.02005197   -0.00011278   -0.00772748   -0.00012472
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O   -1.93078222   -1.22340328    0.00265714   -0.01445959   -0.00501845   -0.00090319
C   -0.74572809    0.76669258    0.02206253   -0.02460238    0.01897905    0.00257346
C   -0.74270917   -0.76420850    0.02459937    0.03244004   -0.01256706   -0.00058912
C    0.31857661    1.65560098    0.01209864    0.01207538    0.01524229    0.00204896
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C    1.66332438    1.26915101   -0.00050901   -0.00633285   -0.00700660   -0.00301598
C    1.67936408   -1.31901191   -0.04916054   -0.02262583   -0.02293367   -0.00609378
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C    2.21618364    0.00648915    0.00219926   -0.02965687    0.01714796   -0.00831625
H    3.29980125   -0.03064360    0.17560649    0.00290574   -0.00627291    0.00915049
   15
   -420.53912779
H   -2.49429959    0.31448918   -0.03762741   -0.00105204   -0.01014296   -0.00142572
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O   -1.92950246   -1.21945170    0.00206400   -0.01360703   -0.00390238   -0.00040215
C   -0.75080299    0.76981374    0.02427703   -0.03106059    0.02044738    0.00295469
C   -0.74042021   -0.76338033    0.02506535    0.03226450   -0.01505835   -0.00069332
C    0.31620070    1.65649450    0.00912575    0.01090919    0.01543715    0.00154229
C    0.37278952   -1.63488070    0.01270046    0.01564807    0.01787802    0.01328415
C    1.66172883    1.26364581    0.00130284   -0.00341228   -0.01102609   -0.00272799
C    1.68318642   -1.32283179   -0.04879777   -0.02022390   -0.02751006   -0.00666472
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H    0.09458125   -2.67988791   -0.11439270    0.00214459    0.00004972   -0.00562015
H    2.37315843    2.09807032    0.01454770    0.00145896    0.00526471   -0.00128454
H    2.42242278   -2.13423100   -0.08622337    0.00564244   -0.00513305    0.00012944
C    2.21542091    0.00538220    0.00232325   -0.03230989    0.02018548   -0.00798648
H    3.30344559   -0.02120285    0.16463026    0.00459429   -0.00523564    0.00869891
   15
   -420.53864113
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O   -1.96916554    1.20479819   -0.02060115    0.03626960    0.00319939    0.00099470
O   -1.92806877   -1.21545604    0.00147540   -0.01230254   -0.00262073    0.00012160
C   -0.75540936    0.77262603    0.02644688   -0.03660941    0.02167594    0.00331816
C   -0.73861806   -0.76232492    0.02554178    0.03128249   -0.01717653   -0.00076604
C    0.31366022    1.65715537    0.00612954    0.00943565    0.01502712    0.00103387
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C    1.66018463    1.25830618    0.00315595   -0.00027737   -0.01411488   -0.00245018
C    1.68731281   -1.32623582   -0.04833428   -0.01641845   -0.03201152   -0.00719524
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H    2.42492497   -2.12966191   -0.08079271    0.00308626   -0.00136565    0.00061075
C    2.21514560    0.00397111    0.00256768   -0.03397210    0.02232076   -0.00741367
H    3.30627212   -0.01082294    0.15209054    0.00548777   -0.00400566    0.00802937
   15
   -420.53815430
H   -2.48510155    0.29352942   -0.07175318   -0.00134867   -0.01286738   -0.00422277
O   -1.97026135    1.20357863   -0.01878285    0.03995518    0.00373720    0.00228307
O   -1.92649585   -1.21143080    0.00088540   -0.01062946   -0.00117284    0.00065232
C   -0.75946354    0.77511092    0.02856657   -0.04105748    0.02263089    0.00366843
C   -0.73728802   -0.76101029    0.02602976    0.02957981   -0.01888520   -0.00080254
C    0.31097737    1.65758969    0.00311768    0.00769390    0.01411217    0.00053917
C    0.37608509   -1.63182517    0.01004940    0.01342183    0.01374885    0.01177780
C    1.65864450    1.25317878    0.00504611    0.00292018   -0.01621886   -0.00217694
C    1.69168619   -1.32915642   -0.04776210   -0.01158679   -0.03603001   -0.00764693
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H    0.08680578   -2.66556253   -0.11198990    0.00260004    0.00613383   -0.00474189
H    2.37867219    2.07543557    0.02371113    0.00141839    0.00217319   -0.00067322
H    2.42687737   -2.12485132   -0.07547140    0.00015589    0.00268788    0.00105321
C    2.21538260    0.00222381    0.00292396   -0.03454131    0.02342130   -0.00662984
H    3.30812359    0.00027652    0.13810827    0.00550539   -0.00264571    0.00716102
   15
   -420.53766148
H   -2.48014060    0.28642277   -0.08780091   -0.00071466   -0.01333012   -0.00556774
O   -1.97180931    1.20231710   -0.01699036    0.04237177    0.00369686    0.00349714
O   -1.92480261   -1.20739246    0.00028804   -0.00867117    0.00044140    0.00116304
C   -0.76289840    0.77725405    0.03063080   -0.04426166    0.02327285    0.00401111
C   -0.73640445   -0.75941070    0.02652984    0.02724083   -0.02012871   -0.00080213
C    0.30817854    1.65781100    0.00009766    0.00567322    0.01289406    0.00005736
C    0.37741904   -1.63062621    0.00845080    0.01182253    0.01147259    0.01089369
C    1.65706040    1.24829549    0.00696920    0.00597363   -0.01736825   -0.00190738
C    1.69623414   -1.33153343   -0.04707442   -0.00625796   -0.03907462   -0.00799088
H    0.03814236    2.71269716   -0.03804852   -0.00485089    0.00078738   -0.00059806
H    0.08223625   -2.65978091   -0.10946613    0.00263792    0.00853241   -0.00429637
H    2.38103584    2.06337977    0.02850254    0.00103437    0.00007387   -0.00035451
H    2.42880086   -2.12052160   -0.07033865   -0.00270807    0.00652318    0.00143119
C    2.21614052    0.00012373    0.00338027   -0.03402350    0.02341461   -0.00566657
H    3.30899564    0.01185086    0.12283886    0.00471085   -0.00118603    0.00615290
   15
   -420.53729739
H   -2.47505800    0.28170797   -0.10284521    0.00036584   -0.01322651   -0.00680968
O   -1.97383671    1.20101411   -0.01523732    0.04341917    0.00313261    0.00457006
O   -1.92301122   -1.20335939   -0.00032249   -0.00650079    0.00223391    0.00163841
C   -0.76566571    0.77904569    0.03263440   -0.04607744    0.02358276    0.00434980
C   -0.73593210   -0.75750740    0.02704200    0.02436807   -0.02087807   -0.00075729
C    0.30529434    1.65783742   -0.00292324    0.00336700    0.01156288   -0.00041412
C    0.37857433   -1.62960116    0.00668755    0.01013120    0.00958211    0.00997703
C    1.65538642    1.24367375    0.00892113    0.00865825   -0.01764587   -0.00163593
C    1.70087683   -1.33332151   -0.04626609   -0.00103159   -0.04059430   -0.00819590
H    0.03683429    2.71521200   -0.05034975   -0.00542172    0.00229706   -0.00100027
H    0.07719641   -2.65552262   -0.10616838    0.00240047    0.01001715   -0.00389116
H    2.38321468    2.05131274    0.03335771    0.00053745   -0.00216135   -0.00003097
H    2.43120323   -2.11735544   -0.06546254   -0.00498159    0.00960906    0.00173815
C    2.21741176   -0.00232898    0.00392213   -0.03254359    0.02226669   -0.00458579
H    3.30903028    0.02363886    0.10646321    0.00321027    0.00029712    0.00504167
   15
   -420.53711221
H   -2.47004675    0.27936709   -0.11666632    0.00182165   -0.01263002   -0.00784318
O   -1.97635534    1.19967602   -0.01353597    0.04305985    0.00209532    0.00547205
O   -1.92114624   -1.19935174   -0.00095154   -0.00418649    0.00414181    0.00205261
C   -0.76773805    0.78048119    0.03457221   -0.04643224    0.02354130    0.00469053
C   -0.73582766   -0.75528905    0.02756556    0.02106873   -0.02112307   -0.00066867
C    0.30235949    1.65768894   -0.00593786    0.00084542    0.01029866   -0.00088645
C    0.37957625   -1.62872177    0.00477343    0.00853860    0.00833475    0.00905180
C    1.65358229    1.23931803    0.01089779    0.01075414   -0.01724199   -0.00136667
C    1.70553592   -1.33449823   -0.04533401    0.00352986   -0.04013320   -0.00825384
H    0.03650017    2.71731590   -0.06247073   -0.00572882    0.00355368   -0.00141764
H    0.07172882   -2.65304962   -0.10216915    0.00183881    0.01032276   -0.00355311
H    2.38529578    2.03963394    0.03821843    0.00009392   -0.00433505    0.00029356
H    2.43448731   -2.11590123   -0.06089823   -0.00621631    0.01145760    0.00197063
C    2.21917419   -0.00511702    0.00453329   -0.03029923    0.02000440   -0.00345307
H    3.30849500    0.03537431    0.08918088    0.00119491    0.00174717    0.00387968
   15
   -420.53710959
H   -2.46536681    0.27929262   -0.12907922    0.00356629   -0.01155376   -0.00862954
O   -1.97936114    1.19831445   -0.01189650    0.04131277    0.00064687    0.00615973
O   -1.91923383   -1.19539115   -0.00160382   -0.00179402    0.00616301    0.00239544
C   -0.76911014    0.78156112    0.03643910   -0.04528900    0.02316383    0.00503526
C   -0.73604138   -0.75275193    0.02809917    0.01744784   -0.02085272   -0.00053290
C    0.29941198    1.65738473   -0.00893915   -0.00186290    0.00919203   -0.00134753
C    0.38044877   -1.62796930    0.00272242    0.00714625    0.00783391    0.00811480
C    1.65161653    1.23522244    0.01289513    0.01206388   -0.01635866   -0.00110370
C    1.71014292   -1.33507089   -0.04427732    0.00703983   -0.03743613   -0.00816885
H    0.03719138    2.71878354   -0.07433776   -0.00574003    0.00446267   -0.00180217
H    0.06593424   -2.65241643   -0.09752928    0.00094617    0.00940884   -0.00328113
H    2.38735696    2.02873171    0.04302626   -0.00014902   -0.00624454    0.00062068
H    2.43887129   -2.11648720   -0.05668776   -0.00612935    0.01176236    0.00213846
C    2.22139409   -0.00820624    0.00519666   -0.02753517    0.01669240   -0.00231396
H    3.30774799    0.04679595    0.07119990   -0.00105625    0.00314614    0.00272711
   15
   -420.53721281
H   -2.46133288    0.28129186   -0.13994194    0.00556100   -0.01004522   -0.00916719
O   -1.98283437    1.19694598   -0.01032663    0.03824127   -0.00126470    0.00658160
O   -1.91730110   -1.19150053   -0.00228320    0.00061874    0.00824951    0.00265345
C   -0.76979929    0.78229118    0.03822984   -0.04266281    0.02247834    0.00539333
C   -0.73651863   -0.74990016    0.02864077    0.01361068   -0.02006440   -0.00035317
C    0.29649283    1.65694114   -0.01192003   -0.00475985    0.00839953   -0.00183113
C    0.38121293   -1.62733605    0.00054878    0.00597968    0.00798738    0.00712855
C    1.64946954    1.23137387    0.01490916    0.01241546   -0.01521269   -0.00084794
C    1.71464494   -1.33508018   -0.04309728    0.00937576   -0.03255536   -0.00795405
H    0.03891286    2.71945505   -0.08588075   -0.00556798    0.00488793   -0.00216475
H    0.05997320   -2.65346206   -0.09229835   -0.00025350    0.00744725   -0.00304202
H    2.38944015    2.01894708    0.04772224   -0.00006458   -0.00771137    0.00095413
H    2.44433916   -2.11916789   -0.05286155   -0.00469972    0.01049701    0.00225659
C    2.22403009   -0.01154672    0.00589506   -0.02459176    0.01244401   -0.00122113
H    3.30719024    0.05765228    0.05272739   -0.00324125    0.00444650    0.00161632
   15
   -420.53737802
H   -2.45830136    0.28509173   -0.14915821    0.00763885   -0.00805818   -0.00942145
O   -1.98674027    1.19559224   -0.00883117    0.03396788   -0.00358818    0.00673816
O   -1.91537539   -1.18770356   -0.00299259    0.00301623    0.01037921    0.00281573
C   -0.76984509    0.78268172    0.03993902   -0.03863930    0.02151414    0.00576563
C   -0.73720159   -0.74674563    0.02918766    0.00968497   -0.01877344   -0.00012509
C    0.29364580    1.65637009   -0.01487319   -0.00775950    0.00796581   -0.00233010
C    0.38188644   -1.62682407   -0.00173254    0.00501343    0.00854477    0.00606418
C    1.64713612    1.22775522    0.01693603    0.01172271   -0.01400054   -0.00060350
C    1.71900641   -1.33459948   -0.04179711    0.01071171   -0.02583801   -0.00762568
H    0.04163253    2.71925463   -0.09703441   -0.00512571    0.00479724   -0.00249351
H    0.05406058   -2.65583786   -0.08652005   -0.00165388    0.00473275   -0.00279726
H    2.39152935    2.01054237    0.05224637    0.00042465   -0.00861617    0.00129403
H    2.45063717   -2.12371914   -0.04944108   -0.00217579    0.00791203    0.00233907
C    2.22703807   -0.01507442    0.00661199   -0.02179078    0.00740930   -0.00019630
H    3.30721067    0.06770898    0.03396317   -0.00505396    0.00563991    0.00056167
   15
   -420.53748700
H   -2.45664425    0.29033660   -0.15668340    0.00967623   -0.00568369   -0.00940427
O   -1.99103054    1.19427955   -0.00741193    0.02867659   -0.00626938    0.00662855
O   -1.91348383   -1.18402420   -0.00373383    0.00533846    0.01247276    0.00289273
C   -0.76930825    0.78274726    0.04156100   -0.03334211    0.02031121    0.00615753
C   -0.73803096   -0.74330783    0.02973638    0.00575212   -0.01699914    0.00014525
C    0.29091613    1.65567814   -0.01779106   -0.01079650    0.00789970   -0.00286243
C    0.38248399   -1.62644137   -0.00410541    0.00418076    0.00917659    0.00489624
C    1.64462675    1.22434834    0.01897202    0.00998397   -0.01286324   -0.00036561
C    1.72320669   -1.33372963   -0.04038177    0.01140761   -0.01787591   -0.00720018
H    0.04527362    2.71819851   -0.10774202   -0.00450922    0.00418960   -0.00272311
H    0.04844655   -2.65906034   -0.08023856   -0.00311932    0.00164643   -0.00251081
H    2.39353580    2.00368007    0.05653745    0.00134797   -0.00892052    0.00163952
H    2.45731739   -2.12968230   -0.04644134    0.00100310    0.00446545    0.00239512
C    2.23037604   -0.01871345    0.00733198   -0.01942369    0.00177126    0.00075505
H    3.30813178    0.07675130    0.01509634   -0.00622988    0.00669326   -0.00042126
   15
   -420.53745422
H   -2.45672596    0.29660057   -0.16251858    0.01151122   -0.00303114   -0.00916987
O   -1.99564541    1.19303826   -0.00606764    0.02262405   -0.00920716    0.00627022
O   -1.91165273   -1.18048626   -0.00450781    0.00754536    0.01449996    0.00288400
C   -0.76826862    0.78250594    0.04308986   -0.02694098    0.01891441    0.00657205
C   -0.73894740   -0.73961358    0.03028286    0.00191443   -0.01476601    0.00045636
C    0.28834963    1.65486637   -0.02066560   -0.01377972    0.00815517   -0.00342809
C    0.38301827   -1.62619708   -0.00655217    0.00338511    0.00953519    0.00360897
C    1.64196759    1.22113612    0.02101353    0.00729748   -0.01186200   -0.00012846
C    1.72723472   -1.33259018   -0.03885766    0.01189431   -0.00936235   -0.00668948
H    0.04972392    2.71639452   -0.11796018   -0.00369844    0.00314495   -0.00290752
H    0.04339288   -2.66257977   -0.07350558   -0.00452059   -0.00139792   -0.00214945
H    2.39529430    1.99841564    0.06053338    0.00263051   -0.00866360    0.00198430
H    2.46381470   -2.13644498   -0.04387244    0.00433706    0.00070279    0.00242777
C    2.23400841   -0.02237884    0.00804062   -0.01765762   -0.00425183    0.00165075
H    3.31016287    0.08458983   -0.00369527   -0.00660512    0.00761861   -0.00137155
   15
   -420.53720376
H   -2.45887489    0.30340846   -0.16670548    0.01298781   -0.00028128   -0.00876980
O   -2.00051649    1.19190154   -0.00479432    0.01610624   -0.01224712    0.00572685
O   -1.90990710   -1.17711261   -0.00531444    0.00960029    0.01639129    0.00280247
C   -0.76682274    0.78197884    0.04451932   -0.01965363    0.01736367    0.00701390
C   -0.73989301   -0.73569657    0.03082238   -0.00174187   -0.01210679    0.00080974
C    0.28599132    1.65393102   -0.02348829   -0.01662741    0.00865451   -0.00401048
C    0.38350140   -1.62609635   -0.00905333    0.00256027    0.00934344    0.00219761
C    1.63919903    1.21810342    0.02305698    0.00383202   -0.01100277    0.00011985
C    1.73108270   -1.33130901   -0.03723248    0.01253602   -0.00098860   -0.00610570
H    0.05483874    2.71402873   -0.12765590   -0.00278289    0.00179889   -0.00303279
H    0.03914908   -2.66585277   -0.06638670   -0.00570004   -0.00405616   -0.00170356
H    2.39657598    1.99470427    0.06417215    0.00413647   -0.00795132    0.00232113
H    2.46953575   -2.14333685   -0.04174025    0.00735308   -0.00288645    0.00243673
C    2.23790849   -0.02597978    0.00872434   -0.01652241   -0.01041565    0.00251215
H    3.31337103    0.09105915   -0.02224040   -0.00615187    0.00839920   -0.00230826
   15
   -420.53682641
H   -2.46335345    0.31026957   -0.16931465    0.01387220    0.00227956   -0.00829541
O   -2.00557016    1.19090360   -0.00358585    0.00947872   -0.01508553    0.00506821
O   -1.90827022   -1.17392466   -0.00615280    0.01146546    0.01809825    0.00266724
C   -0.76508048    0.78118939    0.04584269   -0.01172628    0.01567617    0.00748245
C   -0.74081255   -0.73159698    0.03134962   -0.00514100   -0.00905837    0.00120082
C    0.28388406    1.65286472   -0.02625035   -0.01920814    0.00925047   -0.00459819
C    0.38394600   -1.62613596   -0.01158757    0.00161825    0.00837677    0.00067300
C    1.63637318    1.21523722    0.02509859   -0.00017489   -0.01024774    0.00039289
C    1.73474056   -1.33001204   -0.03551507    0.01361612    0.00666655   -0.00545855
H    0.06045283    2.71134177   -0.13680662   -0.00178602    0.00030054   -0.00310128
H    0.03592550   -2.66840567   -0.05896242   -0.00655247   -0.00602870   -0.00117046
H    2.39711217    1.99241987    0.06739339    0.00569661   -0.00693364    0.00263469
H    2.47394228   -2.14971806   -0.04004634    0.00971588   -0.00587310    0.00241910
C    2.24205902   -0.02942341    0.00937010   -0.01592185   -0.01644185    0.00336140
H    3.31767649    0.09601819   -0.04037001   -0.00498799    0.00903719   -0.00325351
   15
   -420.53631790
H   -2.47031924    0.31672856   -0.17042945    0.01400043    0.00431017   -0.00785689
O   -2.01073163    1.19007642   -0.00243483    0.00312238   -0.01743899    0.00439300
O   -1.90676318   -1.17094186   -0.00702138    0.01308766    0.01962462    0.00248672
C   -0.76316136    0.78016307    0.04705289   -0.00343100    0.01386732    0.00797493
C   -0.74165481   -0.72736087    0.03185866   -0.00818345   -0.00566193    0.00162740
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C    0.38436634   -1.62630118   -0.01413187    0.00053129    0.00652932   -0.00093578
C    1.63355036    1.21252598    0.02713421   -0.00447615   -0.00951060    0.00070885
C    1.73819186   -1.32881441   -0.03371518    0.01525689    0.01311075   -0.00476140
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C    2.24645062   -0.03261892    0.00996507   -0.01562919   -0.02208590    0.00419956
H    3.32287286    0.09935298   -0.05791322   -0.00330374    0.00946113   -0.00423117
   15
   -420.53583824
H   -2.47979226    0.32242350   -0.17012801    0.01320953    0.00552750   -0.00753571
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O   -1.90540433   -1.16818148   -0.00791813    0.01443060    0.02092250    0.00226409
C   -0.76119048    0.77892724    0.04814250    0.00495754    0.01192865    0.00848313
C   -0.74237389   -0.72303954    0.03234306   -0.01079458   -0.00195723    0.00207974
C    0.28057325    1.65030397   -0.03155729   -0.02320968    0.01022472   -0.00571122
C    0.38477886   -1.62656401   -0.01666195   -0.00070367    0.00377398   -0.00259063
C    1.63079529    1.20995851    0.02915905   -0.00881929   -0.00874076    0.00108036
C    1.74141179   -1.32781309   -0.03184336    0.01747627    0.01798510   -0.00402464
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H    0.03309342   -2.67008991   -0.04358789   -0.00715695   -0.00733308    0.00005236
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H    2.47728105   -2.15897032   -0.03795551    0.01166362   -0.00902097    0.00229980
C    2.25107860   -0.03548145    0.01049653   -0.01538720   -0.02701907    0.00503250
H    3.32866166    0.10098541   -0.07469537   -0.00140204    0.00970369   -0.00520492
   15
   -420.53539613
H   -2.49162867    0.32713767   -0.16846717    0.01143201    0.00575150   -0.00739420
O   -2.02109719    1.18903052   -0.00027601   -0.00756438   -0.01953335    0.00337534
O   -1.90420887   -1.16565822   -0.00884055    0.01544499    0.02198540    0.00201626
C   -0.75929430    0.77751124    0.04910385    0.01313684    0.00983780    0.00899460
C   -0.74293040   -0.71868892    0.03279599   -0.01289025    0.00200370    0.00255943
C    0.27942986    1.64879517   -0.03408541   -0.02441231    0.01034102   -0.00619454
C    0.38520215   -1.62688289   -0.01915287   -0.00205768    0.00018600   -0.00425268
C    1.62817332    1.20752307    0.03116748   -0.01298740   -0.00787448    0.00151981
C    1.74436685   -1.32708149   -0.02991071    0.02022478    0.02104163   -0.00326421
H    0.07852968    2.70393364   -0.16088533    0.00092886   -0.00311850   -0.00321567
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H    2.39162602    1.99222980    0.07402297    0.00886625   -0.00369033    0.00331970
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C    2.25593890   -0.03793653    0.01095194   -0.01488275   -0.03104349    0.00582182
H    3.33470331    0.10087540   -0.09054055    0.00044732    0.00966265   -0.00616751
   15
   -420.53500863
H   -2.50550890    0.33083122   -0.16547262    0.00872842    0.00495528   -0.00742839
O   -2.02618044    1.18883526    0.00074324   -0.01149377   -0.01907163    0.00311063
O   -1.90318826   -1.16338414   -0.00978581    0.01608895    0.02282027    0.00173831
C   -0.75759610    0.77594671    0.04992921    0.02081093    0.00756888    0.00949620
C   -0.74329276   -0.71436877    0.03321019   -0.01438904    0.00614797    0.00305830
C    0.27865485    1.64713043   -0.03651996   -0.02498263    0.01011569   -0.00661054
C    0.38565665   -1.62720371   -0.02157952   -0.00348839   -0.00410060   -0.00588174
C    1.62574732    1.20520654    0.03315281   -0.01682472   -0.00688936    0.00203713
C    1.74701563   -1.32666560   -0.02792873    0.02337746    0.02213714   -0.00249253
H    0.08442614    2.70236185   -0.16776369    0.00160114   -0.00336930   -0.00329967
H    0.03531340   -2.66671382   -0.02825035   -0.00610222   -0.00496638    0.00131169
H    2.38680228    1.99374267    0.07508481    0.00897035   -0.00298056    0.00343145
H    2.47246757   -2.16199548   -0.03751495    0.00951694   -0.00771223    0.00208479
C    2.26102367   -0.03992352    0.01131943   -0.01389646   -0.03397368    0.00653159
H    3.34066720    0.09903003   -0.10527564    0.00201912    0.00933820   -0.00708287
   15
   -420.53468228
H   -2.52094838    0.33364459   -0.16113879    0.00527942    0.00333125   -0.00759055
O   -2.03113420    1.18885541    0.00172703   -0.01444847   -0.01775204    0.00298710
O   -1.90234977   -1.16136868   -0.01075076    0.01632757    0.02342372    0.00143213
C   -0.75621160    0.77426800    0.05061103    0.02771992    0.00509413    0.00997053
C   -0.74343840   -0.71014169    0.03357814   -0.01521702    0.01040632    0.00357200
C    0.27825669    1.64531317   -0.03885465   -0.02482850    0.00954821   -0.00695234
C    0.38616391   -1.62746199   -0.02391734   -0.00492423   -0.00882382   -0.00743983
C    1.62357515    1.20299401    0.03510726   -0.02020106   -0.00578035    0.00263118
C    1.74931066   -1.32658205   -0.02590906    0.02677040    0.02129466   -0.00172233
H    0.09003654    2.70138837   -0.17404736    0.00212673   -0.00305652   -0.00342744
H    0.03812883   -2.66355543   -0.02087908   -0.00505986   -0.00269285    0.00188873
H    2.38037216    1.99579664    0.07552991    0.00849029   -0.00257830    0.00347784
H    2.46736889   -2.16133944   -0.03786786    0.00707640   -0.00544204    0.00195538
C    2.26631774   -0.04139830    0.01158832   -0.01223824   -0.03567895    0.00711780
H    3.34627442    0.09550826   -0.11873689    0.00310106    0.00871032   -0.00790210
   15
   -420.53432374
H   -2.53733069    0.33586527   -0.15543830    0.00137407    0.00120842   -0.00777061
O   -2.03592483    1.18907638    0.00267687   -0.01655206   -0.01588591    0.00293367
O   -1.90169610   -1.15961874   -0.01173193    0.01613643    0.02383893    0.00110081
C   -0.75524497    0.77251253    0.05114215    0.03362038    0.00239690    0.01040102
C   -0.74335482   -0.70607200    0.03389207   -0.01534141    0.01470098    0.00408998
C    0.27823309    1.64335182   -0.04108429   -0.02394958    0.00874280   -0.00723006
C    0.38674552   -1.62758670   -0.02614279   -0.00626612   -0.01365270   -0.00889723
C    1.62170781    1.20086879    0.03702183   -0.02306693   -0.00458951    0.00329979
C    1.75120093   -1.32681830   -0.02386334    0.03015418    0.01866572   -0.00096581
H    0.09526663    2.70095758   -0.17971318    0.00249405   -0.00222333   -0.00360412
H    0.04185199   -2.65991785   -0.01384691   -0.00382048   -0.00004069    0.00240180
H    2.37242147    1.99831944    0.07534992    0.00745066   -0.00249779    0.00345883
H    2.46100611   -2.15971577   -0.03857267    0.00395748   -0.00234711    0.00181942
C    2.27179594   -0.04233519    0.01174977   -0.00983354   -0.03610912    0.00754442
H    3.35133220    0.09042197   -0.13077758    0.00357789    0.00781799   -0.00858501
   15
   -420.53392218
H   -2.55395949    0.33787054   -0.14834021   -0.00262322   -0.00103704   -0.00787686
O   -2.04052831    1.18947743    0.00359344   -0.01801147   -0.01386112    0.00287391
O   -1.90122506   -1.15813910   -0.01272557    0.01551767    0.02406967    0.00074179
C   -0.75478523    0.77072109    0.05151608    0.03832853   -0.00051868    0.01077329
C   -0.74304016   -0.70222450    0.03414419   -0.01474015    0.01893562    0.00459925
C    0.27857075    1.64125840   -0.04320467   -0.02234594    0.00783556   -0.00745973
C    0.38742152   -1.62750531   -0.02823386   -0.00735561   -0.01817322   -0.01023405
C    1.62018859    1.19881292    0.03888644   -0.02540818   -0.00336594    0.00403748
C    1.75263570   -1.32733504   -0.02180301    0.03320591    0.01460469   -0.00022426
H    0.10004988    2.70092144   -0.18472958    0.00271603   -0.00099925   -0.00381581
H    0.04625852   -2.65627416   -0.00724616   -0.00243836    0.00264446    0.00284718
H    2.36313691    2.00129597    0.07454805    0.00589241   -0.00269845    0.00338440
H    2.45393613   -2.15767669   -0.03960502    0.00047487    0.00124071    0.00168172
C    2.27742192   -0.04272762    0.01179738   -0.00668339   -0.03530292    0.00777992
H    3.35575517    0.08393193   -0.14127514    0.00341276    0.00667357   -0.00910726
   15
   -420.53343672
H   -2.57012213    0.34005978   -0.13982616   -0.00633204   -0.00304967   -0.00783342
O   -2.04492780    1.19003597    0.00447748   -0.01908381   -0.01203362    0.00273437
O   -1.90092967   -1.15693235   -0.01372760    0.01448589    0.02411926    0.00035671
C   -0.75490342    0.76893770    0.05172720    0.04172055   -0.00361512    0.01107744
C   -0.74250350   -0.69866310    0.03432680   -0.01342000    0.02300260    0.00509579
C    0.27924545    1.63904640   -0.04521229   -0.02004422    0.00701075   -0.00766788
C    0.38820830   -1.62715005   -0.03017036   -0.00807971   -0.02194145   -0.01144493
C    1.61905293    1.19680806    0.04068995   -0.02725294   -0.00223709    0.00482863
C    1.75356929   -1.32807149   -0.01973926    0.03552093    0.00963624    0.00049916
H    0.10434559    2.70106195   -0.18905898    0.00281881    0.00044643   -0.00403503
H    0.05110508   -2.65310136   -0.00115712   -0.00113709    0.00495741    0.00323089
H    2.35279633    2.00476139    0.07313772    0.00397414   -0.00310651    0.00325602
H    2.44678013   -2.15586133   -0.04094008   -0.00296567    0.00485037    0.00154016
C    2.28314815   -0.04258768    0.01172760   -0.00287933   -0.03336682    0.00780661
H    3.35957268    0.07624316   -0.15013618    0.00263478    0.00533487   -0.00944562
   15
   -420.53296877
H   -2.58515303    0.34279063   -0.12990479   -0.00949380   -0.00453427   -0.00757779
O   -2.04911097    1.19073141    0.00533060   -0.01999043   -0.01062994    0.00247455
O   -1.90079825   -1.15599907   -0.01473366    0.01307044    0.02403265   -0.00005200
C   -0.75565076    0.76720912    0.05177093    0.04373216   -0.00683200    0.01130393
C   -0.74176477   -0.69544916    0.03443239   -0.01141719    0.02678504    0.00556449
C    0.28022245    1.63672809   -0.04710396   -0.01711655    0.00643782   -0.00788067
C    0.38911657   -1.62646442   -0.03193395   -0.00827755   -0.02455662   -0.01253491
C    1.61832879    1.19483725    0.04242041   -0.02867035   -0.00131072    0.00566325
C    1.75396724   -1.32895337   -0.01768304    0.03666029    0.00442421    0.00121320
H    0.10813506    2.70112169   -0.19266235    0.00283351    0.00191839   -0.00423543
H    0.05615858   -2.65081010    0.00435090   -0.00001333    0.00652873    0.00356859
H    2.34174368    2.00878711    0.07114185    0.00182677   -0.00359609    0.00308374
H    2.44015000   -2.15491245   -0.04255219   -0.00589535    0.00794391    0.00138141
C    2.28891736   -0.04194442    0.01154003    0.00140316   -0.03045688    0.00762396
H    3.36292326    0.06759610   -0.15729971    0.00135347    0.00385808   -0.00960158
   15
   -420.53259894
H   -2.59848657    0.34632728   -0.11862260   -0.01184306   -0.00529459   -0.00709266
O   -2.05306735    1.19154803    0.00615578   -0.02092093   -0.00987802    0.00207010
O   -1.90081480   -1.15533829   -0.01573910    0.01132948    0.02383815   -0.00048005
C   -0.75705759    0.76558386    0.05164385    0.04434059   -0.01007158    0.01144834
C   -0.74085418   -0.69263969    0.03445390   -0.00880204    0.03015545    0.00599507
C    0.28145762    1.63431193   -0.04887644   -0.01367359    0.00627922   -0.00812587
C    0.39014925   -1.62540929   -0.03350816   -0.00786872   -0.02570622   -0.01351157
C    1.61803777    1.19288669    0.04406520   -0.02977218   -0.00074881    0.00653001
C    1.75381285   -1.32990271   -0.01564520    0.03620564   -0.00035498    0.00193978
H    0.11141564    2.70083863   -0.19550376    0.00277171    0.00322037   -0.00439645
H    0.06121871   -2.64967928    0.00921674    0.00081697    0.00708316    0.00388660
H    2.33036307    2.01345914    0.06859131   -0.00038217   -0.00401414    0.00287808
H    2.43456697   -2.15537792   -0.04441258   -0.00787529    0.00994941    0.00118896
C    2.29466507   -0.04084159    0.01123742    0.00591758   -0.02676992    0.00724935
H    3.36603480    0.05825552   -0.16273717   -0.00024920    0.00231440   -0.00959855
   15
   -420.53243074
H   -2.60970182    0.35080424   -0.10606742   -0.01322846   -0.00519735   -0.00637875
O   -2.05678623    1.19247725    0.00695755   -0.02202871   -0.00984542    0.00154596
O   -1.90095965   -1.15494781   -0.01673911    0.00934122    0.02355193   -0.00091664
C   -0.75913320    0.76411077    0.05134378    0.04359500   -0.01321974    0.01150747
C   -0.73981111   -0.69028550    0.03438482   -0.00566968    0.03298188    0.00637427
C    0.28289904    1.63180022   -0.05052599   -0.00983602    0.00662058   -0.00841876
C    0.39130009   -1.62396741   -0.03487821   -0.00680023   -0.02527282   -0.01438211
C    1.61819661    1.19094808    0.04561124   -0.03062563   -0.00070529    0.00741711
C    1.75311330   -1.33084787   -0.01363672    0.03389337   -0.00416205    0.00269594
H    0.11419813    2.69998057   -0.19755473    0.00265670    0.00419739   -0.00449057
H    0.06613637   -2.64980713    0.01338288    0.00132335    0.00650338    0.00420354
H    2.31904941    2.01885031    0.06552313   -0.00245884   -0.00420930    0.00263970
H    2.43038328   -2.15761309   -0.04648619   -0.00858803    0.01048262    0.00093940
C    2.30032339   -0.03933470    0.01082540    0.01036564   -0.02250840    0.00672384
H    3.36919259    0.04849842   -0.16644847   -0.00195250    0.00077144   -0.00947236
   15
   -420.53246098
H   -2.61855078    0.35620380   -0.09236675   -0.01356145   -0.00421041   -0.00548432
O   -2.06025497    1.19351881    0.00774185   -0.02339608   -0.01059109    0.00091956
O   -1.90121033   -1.15482444   -0.01772873    0.00720145    0.02322000   -0.00135405
C   -0.76186640    0.76283727    0.05086983    0.04157970   -0.01613949    0.01148018
C   -0.73868279   -0.68842929    0.03421942   -0.00214477    0.03517748    0.00670132
C    0.28448888    1.62918777   -0.05204820   -0.00575973    0.00749989   -0.00876762
C    0.39255300   -1.62214526   -0.03603093   -0.00511305   -0.02333324   -0.01514412
C    1.61881827    1.18902092    0.04704511   -0.03130077   -0.00131285    0.00831342
C    1.75190360   -1.33173164   -0.01166906    0.02969476   -0.00671425    0.00349757
H    0.11650266    2.69837318   -0.19879851    0.00251241    0.00473812   -0.00450305
H    0.07082056   -2.65109044    0.01679223    0.00150445    0.00487218    0.00452362
H    2.30817405    2.02499438    0.06198028   -0.00424179   -0.00404178    0.00237094
H    2.42772640   -2.16171124   -0.04872769   -0.00796900    0.00937250    0.00060932
C    2.30582543   -0.03748796    0.01031182    0.01443492   -0.01786536    0.00609269
H    3.37269948    0.03860094   -0.16845604   -0.00349300   -0.00070272   -0.00927497
   15
   -420.53264125
H   -2.62497387    0.36234936   -0.07768043   -0.01285337   -0.00237450   -0.00447169
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O   -1.90154265   -1.15496445   -0.01870301    0.00500887    0.02286789   -0.00178076
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   15
   -420.53289931
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O   -1.90193182   -1.15536388   -0.01965712    0.00287509    0.02252538   -0.00219021
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   15
   -420.53316337
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O   -1.90235376   -1.15601887   -0.02058640    0.00090437    0.02222891   -0.00257666
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C   -0.73533645   -0.68612005    0.03310096    0.00953084    0.03692645    0.00727900
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   15
   -420.53334429
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O   -1.90278620   -1.15692606   -0.02148648   -0.00079974    0.02199640   -0.00293208
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C    1.62609894    1.18177278    0.05138680   -0.03195000   -0.01047744    0.01192962
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   15
   -420.53348733
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O   -1.90320991   -1.15808280   -0.02235332   -0.00214786    0.02184447   -0.00325691
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C    1.62913009    1.18024930    0.05205544   -0.03115833   -0.01381240    0.01281544
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   15
   -420.53368712
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O   -1.90360964   -1.15948739   -0.02318325   -0.00307207    0.02178523   -0.00354960
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C    2.33301045   -0.02331129    0.00565885    0.01990238    0.01041333    0.00204758
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   15
   -420.53395386
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O   -1.90397496   -1.16113921   -0.02397294   -0.00351871    0.02183141   -0.00381130
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C    1.63658245    1.17787804    0.05279856   -0.02770897   -0.02007858    0.01448827
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   15
   -420.53442067
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O   -1.90430082   -1.16303869   -0.02471942   -0.00346414    0.02192114   -0.00404659
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   15
   -420.53497970
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O   -1.90458785   -1.16518693   -0.02542002   -0.00290388    0.02210976   -0.00425792
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   15
   -420.53565536
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   15
   -420.53630926
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O   -1.90507613   -1.17023851   -0.02667415   -0.00038163    0.02258310   -0.00462595
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H    0.10798244   -2.63697158   -0.00639613    0.00353517   -0.00044123    0.00372544
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C    2.34774908   -0.01489367    0.00088567    0.01116755    0.02438190   -0.00274253
H    3.44201900   -0.02303958   -0.08929413    0.00745942   -0.00661166   -0.00543645
   15
   -420.53686904
H   -2.61837833    0.37357504    0.10080665   -0.00451333   -0.00195273    0.00511646
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C    1.73054416   -1.33112539    0.00447268   -0.02163842   -0.02918304    0.00904988
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H    2.26659578    2.08853756    0.00543150   -0.00719048    0.00653653   -0.00235549
H    2.39562322   -2.19201394   -0.06164621   -0.00075391   -0.00188547   -0.00238068
C    2.35009895   -0.01419112   -0.00001056    0.01050360    0.02506029   -0.00398963
H    3.44523593   -0.02182565   -0.07435924    0.00733454   -0.00613925   -0.00455680
   15
   -420.53726298
H   -2.61487150    0.36876403    0.11472275   -0.00533072   -0.00504701    0.00619626
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C   -0.82691309    0.77293455    0.03069207   -0.03098539    0.00037509    0.00490598
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   15
   -420.53756428
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C   -0.83106106    0.77505361    0.02833707   -0.03499075    0.00494481    0.00416265
C   -0.74302904   -0.71116896    0.02086206    0.02601074   -0.00728419    0.00480169
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   15
   -420.53778408
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O   -1.90619836   -1.18343296   -0.02854112    0.00852691    0.02318776   -0.00507845
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C    2.35619318   -0.01432510   -0.00225969    0.01130177    0.02177466   -0.00778005
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   15
   -420.53804050
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O   -1.90665212   -1.18738628   -0.02886635    0.01104183    0.02314927   -0.00510782
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C    0.29393653    1.55987984   -0.05509269   -0.00143743   -0.00710183   -0.00859435
C    0.40044077   -1.57677757   -0.02332777    0.01029665    0.00077892   -0.00531442
C    1.68425966    1.18365809    0.04431727    0.01061923   -0.01176129    0.01727019
C    1.73132148   -1.32094591    0.00568881   -0.00911063   -0.03626131    0.00745261
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C    2.35789310   -0.01506176   -0.00279928    0.01197584    0.01890625   -0.00892664
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   15
   -420.53833060
H   -2.59164222    0.36213229    0.15763643   -0.00186241   -0.00982858    0.00895657
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O   -1.90723106   -1.19160208   -0.02913368    0.01348673    0.02299600   -0.00509552
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C   -0.75326317   -0.71990595    0.01570964    0.01977672   -0.01947460    0.00358921
C    0.29328532    1.55440470   -0.05394437   -0.00583641   -0.01152631   -0.00795909
C    0.39935231   -1.57396646   -0.02110110    0.00903573    0.00267506   -0.00378297
C    1.68968500    1.18572497    0.04207754    0.01425605   -0.00823701    0.01698386
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C    2.35941215   -0.01608330   -0.00320404    0.01247215    0.01523065   -0.00996602
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   15
   -420.53858647
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O   -1.90796285   -1.19607861   -0.02934326    0.01577191    0.02271570   -0.00503476
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C   -0.75731887   -0.72230494    0.01387558    0.01715726   -0.02238544    0.00320960
C    0.29272252    1.54910338   -0.05267571   -0.01037127   -0.01557239   -0.00731514
C    0.39812721   -1.57119651   -0.01881735    0.00779064    0.00516307   -0.00216267
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C    1.73273942   -1.31264089    0.00559531   -0.00544437   -0.02759234    0.00676203
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C    2.36074318   -0.01733426   -0.00345826    0.01253560    0.01084490   -0.01089004
H    3.44459072    0.00386928    0.02649267   -0.00165800   -0.00072803    0.00091865
   15
   -420.53877237
H   -2.57711890    0.36888646    0.16985023    0.00353678   -0.00743461    0.00883366
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O   -1.90887332   -1.20081268   -0.02949576    0.01781882    0.02228544   -0.00492696
C   -0.84306846    0.78317436    0.01583315   -0.04310654    0.02597201    0.00076715
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C    0.29231653    1.54403691   -0.05129644   -0.01490429   -0.01912404   -0.00667477
C    0.39678431   -1.56850490   -0.01650099    0.00654983    0.00787117   -0.00046886
C    1.69984861    1.19018467    0.03683403    0.01914690   -0.00221807    0.01609478
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H    3.44377399    0.00969334    0.04363291   -0.00265333    0.00038294    0.00169259
   15
   -420.53883362
H   -2.57055559    0.37439695    0.17356041    0.00661145   -0.00531125    0.00839739
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O   -1.90998564   -1.20579936   -0.02959241    0.01956137    0.02167299   -0.00478095
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C   -0.76616632   -0.72605645    0.01006718    0.01157606   -0.02610013    0.00252129
C    0.29213572    1.53925892   -0.04981627   -0.01929362   -0.02213026   -0.00602312
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C    1.73449640   -1.30270318    0.00509306   -0.00362831   -0.01189782    0.00602355
H    0.11909047    2.61770417   -0.10450337   -0.00074414    0.00156250   -0.00065965
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H    2.37553019   -2.17727382   -0.04035190   -0.00357274    0.00014188   -0.00126432
C    2.36284720   -0.02025098   -0.00346084    0.01073048    0.00045540   -0.01241654
H    3.44342588    0.01544846    0.06046859   -0.00302461    0.00148062    0.00244447
   15
   -420.53872095
H   -2.56518164    0.38085877    0.17576139    0.00961277   -0.00285084    0.00779001
O   -2.07628056    1.24799638    0.03004533   -0.00042935    0.00256077   -0.00525301
O   -1.91131953   -1.21103169   -0.02963485    0.02094318    0.02084810   -0.00460287
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C   -0.77087388   -0.72735291    0.00810325    0.00876273   -0.02683171    0.00221321
C    0.29224626    1.53481483   -0.04824500   -0.02339141   -0.02456248   -0.00537819
C    0.39382132   -1.56351606   -0.01187331    0.00386819    0.01240890    0.00300061
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C    1.73546331   -1.29740205    0.00470247   -0.00260629   -0.00304493    0.00555059
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C    2.36364761   -0.02176001   -0.00318610    0.00876989   -0.00522444   -0.01304653
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   15
   -420.53849217
H   -2.56153105    0.38783167    0.17656151    0.01222438   -0.00034867    0.00710000
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O   -1.91289061   -1.21650026   -0.02962509    0.02191603    0.01977749   -0.00440396
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C   -0.77571401   -0.72824463    0.00610584    0.00601621   -0.02678130    0.00192968
C    0.29271002    1.53074149   -0.04659242   -0.02706935   -0.02646591   -0.00472718
C    0.39224180   -1.56128663   -0.00961433    0.00238739    0.01358521    0.00468458
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C    2.36431610   -0.02318998   -0.00271420    0.00624508   -0.01096532   -0.01359291
H    3.44429256    0.02596957    0.09268571   -0.00199353    0.00355086    0.00394491
   15
   -420.53820161
H   -2.56007079    0.39487234    0.17608326    0.01417610    0.00177470    0.00643282
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O   -1.91470989   -1.22219295   -0.02956539    0.02244181    0.01845438   -0.00418752
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C   -0.78064526   -0.72873238    0.00407922    0.00339876   -0.02594405    0.00166912
C    0.29358238    1.52706778   -0.04486842   -0.03016103   -0.02789315   -0.00407051
C    0.39062631   -1.55926136   -0.00742606    0.00080914    0.01374922    0.00627996
C    1.71664917    1.19929108    0.02351564    0.01994795    0.00427053    0.01284595
C    1.73749102   -1.28679007    0.00367850    0.00095191    0.01332567    0.00431358
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H    2.38090667    2.06592909   -0.00577366    0.00506055    0.00005182   -0.00284508
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C    2.36489057   -0.02445435   -0.00203689    0.00338920   -0.01654594   -0.01405118
H    3.44532571    0.03036327    0.10779615   -0.00085401    0.00447082    0.00469812
   15
   -420.53798605
H   -2.56114896    0.40160428    0.17444523    0.01519724    0.00315680    0.00587905
O   -2.07592104    1.25638237    0.03523261   -0.00880569   -0.00209274   -0.00305513
O   -1.91678331   -1.22809471   -0.02945820    0.02249821    0.01684311   -0.00396357
C   -0.83949972    0.78182084    0.00302163   -0.02921825    0.03625232   -0.00214186
C   -0.78562812   -0.72882880    0.00202735    0.00094166   -0.02433230    0.00142928
C    0.29490990    1.52381534   -0.04308285   -0.03254755   -0.02892325   -0.00342577
C    0.38899862   -1.55744264   -0.00533257   -0.00080704    0.01281682    0.00774217
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C    1.73849785   -1.28172550    0.00306380    0.00366454    0.01982829    0.00355848
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H    2.39316547    2.06543126   -0.00355548    0.00734677    0.00105522   -0.00262761
H    2.38804301   -2.18106447   -0.02413091    0.00557166   -0.01211649   -0.00083623
C    2.36541388   -0.02546901   -0.00114725    0.00047227   -0.02174871   -0.01439580
H    3.44651031    0.03395448    0.12206124    0.00044554    0.00524790    0.00543170
   15
   -420.53794163
H   -2.56494687    0.40778292    0.17174640    0.01509949    0.00351105    0.00549478
O   -2.07564414    1.25920652    0.03704191   -0.01120187   -0.00205381   -0.00248321
O   -1.91911148   -1.23418728   -0.02930605    0.02206740    0.01494594   -0.00373563
C   -0.83723400    0.77998588    0.00052152   -0.02440965    0.03626804   -0.00273053
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   15
   -420.53814289
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   15
   -420.53855990
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   15
   -420.53912611
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   15
   -420.53971861
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   15
   -420.54022854
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   15
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   15
   -420.54096615
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   15
   -420.54120156
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   15
   -420.54143322
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   15
   -420.54161100
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   15
   -420.54165827
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   15
   -420.54146407
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   15
   -420.54097049
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O   -2.05624889    1.29012223    0.06133657   -0.03119025    0.00164625    0.00474177
O   -1.96382721   -1.31785290   -0.02457341   -0.01174699   -0.01983016    0.00033210
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C   -0.84805394   -0.71954884   -0.02755624   -0.00446153    0.04050855   -0.00147875
C    0.35496779    1.52283033   -0.01673457    0.02449726   -0.00368972    0.00415810
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   15
   -420.54021362
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O   -1.96727685   -1.32352359   -0.02412304   -0.01386845   -0.02152654    0.00067386
C   -0.79484407    0.71807348   -0.02649443    0.00858461   -0.02671110   -0.00836105
C   -0.85181672   -0.72114358   -0.02960563   -0.00421889    0.04278492   -0.00166851
C    0.35955603    1.52490622   -0.01508123    0.03032490    0.00137271    0.00461720
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C    1.74350732    1.21897162   -0.04562603    0.00148661   -0.00890725   -0.01390056
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C    2.37745054    0.00954990    0.03439559    0.00553588    0.00811958    0.00082818
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   15
   -420.53928334
H   -2.69971746    0.56550956    0.03468326   -0.00007120    0.00967521   -0.00029685
O   -2.04942540    1.29351033    0.06467712   -0.03705319   -0.00516424    0.00517469
O   -1.97056957   -1.32895040   -0.02368030   -0.01554181   -0.02289112    0.00100428
C   -0.79245724    0.71400799   -0.02760662    0.00843422   -0.03037369   -0.00845263
C   -0.85551537   -0.72338390   -0.03162981   -0.00425658    0.04396265   -0.00183852
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C    0.37320150   -1.52881266    0.00394564    0.00787967    0.01232676    0.01380576
C    1.74388104    1.21960091   -0.04928625   -0.00096181   -0.01387394   -0.01548381
C    1.71843163   -1.24221280   -0.00560673   -0.00676498    0.00506084   -0.00861445
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C    2.37796655    0.01366911    0.03749052    0.00431019    0.01362109    0.00231320
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   15
   -420.53840196
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O   -2.04539919    1.29527347    0.06626030   -0.03830781   -0.00701325    0.00522423
O   -1.97368644   -1.33411786   -0.02324895   -0.01672555   -0.02392256    0.00131611
C   -0.79019800    0.71040055   -0.02859107    0.00834936   -0.03307361   -0.00849686
C   -0.85914926   -0.72628752   -0.03362622   -0.00460605    0.04398165   -0.00198579
C    0.36728332    1.52892147   -0.01199066    0.03960471    0.01091392    0.00547373
C    0.37240378   -1.52688359    0.00270413    0.00973455    0.01495532    0.01281226
C    1.74426887    1.22043949   -0.05271248   -0.00304480   -0.01844893   -0.01694875
C    1.71523053   -1.24101656   -0.00548954   -0.01180272    0.00386575   -0.00910227
H    0.11698773    2.58454552    0.05473849   -0.00104440   -0.00157997    0.00162706
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C    2.37841753    0.01758302    0.04055044    0.00298662    0.01859685    0.00381717
H    3.45860617   -0.03090634    0.17945062    0.00157757   -0.00498227    0.00452825
   15
   -420.53764617
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O   -1.97661406   -1.33901425   -0.02283250   -0.01740993   -0.02462092    0.00160800
C   -0.78806513    0.70729192   -0.02944711    0.00835246   -0.03474997   -0.00848931
C   -0.86271309   -0.72985469   -0.03559264   -0.00527908    0.04281911   -0.00210763
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C    0.37145943   -1.52517947    0.00126915    0.01115216    0.01661950    0.01162114
C    1.74470208    1.22155606   -0.05588265   -0.00459592   -0.02226888   -0.01825699
C    1.71220637   -1.23987773   -0.00523488   -0.01558812    0.00182654   -0.00946300
H    0.11747773    2.58354479    0.06046623   -0.00078523   -0.00266490    0.00170810
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H    2.40909418   -2.10500750    0.04278401    0.01251763   -0.00797793    0.00203717
C    2.37882316    0.02121659    0.04355255    0.00183116    0.02287004    0.00536999
H    3.46221673   -0.03491759    0.17318322    0.00327631   -0.00570541    0.00416789
   15
   -420.53713544
H   -2.71000222    0.59816845   -0.00113536   -0.00079549    0.01078575   -0.00109789
O   -2.03605222    1.29903869    0.06924812   -0.03579027   -0.00631705    0.00543633
O   -1.97934464   -1.34363172   -0.02243426   -0.01759549   -0.02496546    0.00187675
C   -0.78605858    0.70470742   -0.03017486    0.00841259   -0.03537915   -0.00842612
C   -0.86619660   -0.73406796   -0.03752723   -0.00629943    0.04052544   -0.00220117
C    0.37263465    1.53228771   -0.00923037    0.04513196    0.01816995    0.00615843
C    0.37034702   -1.52372549   -0.00034137    0.01209090    0.01732137    0.01029114
C    1.74520403    1.22300812   -0.05877704   -0.00551141   -0.02507102   -0.01938070
C    1.70941617   -1.23876552   -0.00483732   -0.01795526   -0.00104259   -0.00968284
H    0.11810937    2.58302061    0.06588642   -0.00050169   -0.00344412    0.00179332
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H    2.40601914   -2.10341937    0.04408505    0.01232822   -0.00780594    0.00190555
C    2.37920062    0.02450544    0.04647340    0.00106874    0.02627601    0.00697315
H    3.46524339   -0.03790399    0.16616671    0.00456415   -0.00626560    0.00372386
   15
   -420.53687544
H   -2.71340432    0.60503035   -0.01275544   -0.00341368    0.00854763   -0.00162787
O   -2.03075984    1.30103318    0.07065024   -0.03221963   -0.00414647    0.00573541
O   -1.98187608   -1.34796628   -0.02205730   -0.01730540   -0.02499954    0.00212554
C   -0.78417930    0.70265661   -0.03077529    0.00852621   -0.03499510   -0.00830559
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C    0.37430575    1.53358480   -0.00798741    0.04639940    0.02046976    0.00639634
C    0.36905253   -1.52253232   -0.00210738    0.01247413    0.01710887    0.00885983
C    1.74578846    1.22483775   -0.06137863   -0.00573697   -0.02663610   -0.02031747
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H    0.14017590   -2.59547824   -0.02105556    0.00124331   -0.00516740   -0.00188608
H    2.36059873    2.12769449    0.04815562   -0.00061166    0.00552835    0.00566827
H    2.40073984   -2.10044264    0.04504447    0.01108373   -0.00648155    0.00167400
C    2.37956123    0.02739820    0.04928877    0.00086350    0.02869660    0.00862314
H    3.46745678   -0.03976518    0.15848111    0.00529326   -0.00663165    0.00319823
   15
   -420.53681698
H   -2.71618385    0.61036235   -0.02408019   -0.00657496    0.00569695   -0.00232495
O   -2.02510288    1.30307413    0.07198719   -0.02767889   -0.00138120    0.00616759
O   -1.98421162   -1.35201754   -0.02170442   -0.01656912   -0.02473190    0.00235013
C   -0.78242893    0.70113374   -0.03125020    0.00864013   -0.03364981   -0.00812667
C   -0.87285738   -0.74427793   -0.04129563   -0.00912339    0.03281258   -0.00231284
C    0.37527651    1.53457364   -0.00684103    0.04667007    0.02174558    0.00653480
C    0.36757007   -1.52159698   -0.00400728    0.01233044    0.01617110    0.00738071
C    1.74645879    1.22706847   -0.06367327   -0.00526813   -0.02685024   -0.02105441
C    1.70465824   -1.23643636   -0.00360236   -0.01827431   -0.00890288   -0.00969065
H    0.11959446    2.58386809    0.07573768    0.00003490   -0.00354312    0.00203708
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H    2.35428091    2.13429716    0.04515090   -0.00164714    0.00586621    0.00576159
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C    2.37990801    0.02985837    0.05197372    0.00129406    0.03004789    0.01031001
H    3.46872619   -0.04043568    0.15022077    0.00540946   -0.00677991    0.00260864
   15
   -420.53690807
H   -2.71778082    0.61466939   -0.03498526   -0.00966961    0.00278789   -0.00312343
O   -2.01913227    1.30513075    0.07325409   -0.02276026    0.00140376    0.00668238
O   -1.98635958   -1.35578849   -0.02137818   -0.01543917   -0.02420670    0.00255061
C   -0.78080916    0.70011861   -0.03160231    0.00872706   -0.03144154   -0.00788983
C   -0.87599210   -0.75015833   -0.04312774   -0.01081497    0.02766156   -0.00233398
C    0.37554287    1.53523493   -0.00579336    0.04593556    0.02200319    0.00659676
C    0.36590178   -1.52090566   -0.00601879    0.01169263    0.01481159    0.00589737
C    1.74720798    1.22970351   -0.06564981   -0.00414468   -0.02570156   -0.02159676
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H    2.34826313    2.13985321    0.04111066   -0.00293747    0.00554837    0.00572136
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C    2.38023446    0.03186558    0.05450279    0.00236167    0.03028960    0.01200363
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   15
   -420.53705760
H   -2.71764576    0.61846914   -0.04532812   -0.01217003    0.00027940   -0.00392917
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O   -1.98833270   -1.35928506   -0.02108086   -0.01397961   -0.02345303    0.00272905
C   -0.77932125    0.69957791   -0.03183520    0.00873154   -0.02846762   -0.00759498
C   -0.87896321   -0.75645618   -0.04492459   -0.01258097    0.02186687   -0.00233608
C    0.37511595    1.53556465   -0.00484531    0.04420721    0.02131944    0.00657120
C    0.36405723   -1.52043816   -0.00811948    0.01061864    0.01336277    0.00443568
C    1.74801916    1.23272560   -0.06730004   -0.00245120   -0.02327915   -0.02195608
C    1.70097964   -1.23356186   -0.00178395   -0.01352256   -0.01805697   -0.00917408
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H    0.14768739   -2.58224853    0.02152669    0.00289756    0.00397247    0.00066504
H    2.34277655    2.14441842    0.03604214   -0.00440348    0.00465650    0.00555439
H    2.37474912   -2.08644973    0.04637430    0.00231229    0.00281235    0.00046942
C    2.38052451    0.03341615    0.05685040    0.00398569    0.02944129    0.01367197
H    3.46846175   -0.03813920    0.13240768    0.00383189   -0.00639499    0.00131777
   15
   -420.53720900
H   -2.71533425    0.62220779   -0.05496473   -0.01367005   -0.00148949   -0.00465808
O   -2.00647016    1.30917103    0.07555481   -0.01370268    0.00534039    0.00760474
O   -1.99014749   -1.36251578   -0.02081447   -0.01225656   -0.02251315    0.00288418
C   -0.77796522    0.69946686   -0.03195331    0.00861073   -0.02484844   -0.00724822
C   -0.88174411   -0.76308407   -0.04668613   -0.01433679    0.01560472   -0.00232432
C    0.37402181    1.53557302   -0.00399651    0.04151974    0.01981124    0.00646345
C    0.36205251   -1.52017306   -0.01028725    0.00921836    0.01224496    0.00299213
C    1.74886686    1.23609837   -0.06861850   -0.00030248   -0.01977218   -0.02215043
C    1.69946743   -1.23175028   -0.00066445   -0.01004029   -0.02210207   -0.00877711
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H    0.14927169   -2.57850540    0.03567666    0.00319394    0.00663488    0.00139908
H    2.33808354    2.14815150    0.02997515   -0.00592945    0.00333127    0.00528540
H    2.36444677   -2.08194773    0.04654138   -0.00131281    0.00654812   -0.00001248
C    2.38075385    0.03452285    0.05899137    0.00600225    0.02754915    0.01526956
H    3.46720897   -0.03524051    0.12308649    0.00234177   -0.00589840    0.00067340
   15
   -420.53736419
H   -2.71057996    0.62620125   -0.06376529   -0.01391638   -0.00233698   -0.00521547
O   -1.99988082    1.31111051    0.07657832   -0.01020154    0.00595671    0.00784674
O   -1.99182341   -1.36549125   -0.02058077   -0.01034444   -0.02143731    0.00301732
C   -0.77673919    0.69973086   -0.03196189    0.00833120   -0.02070290   -0.00685315
C   -0.88430836   -0.76994756   -0.04841254   -0.01599215    0.00906422   -0.00230501
C    0.37230105    1.53528264   -0.00324536    0.03789509    0.01766532    0.00629110
C    0.35990868   -1.52009386   -0.01250027    0.00758562    0.01179292    0.00154980
C    1.74971878    1.23976911   -0.06960224    0.00213762   -0.01546074   -0.02220114
C    1.69810696   -1.22960588    0.00058771   -0.00648345   -0.02503646   -0.00833500
H    0.12220070    2.59163341    0.09074305    0.00086655    0.00112405    0.00283727
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H    2.35437563   -2.07861605    0.04671038   -0.00457778    0.00970291   -0.00047216
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   15
   -420.53760503
H   -2.70333981    0.63060096   -0.07163033   -0.01282113   -0.00219417   -0.00554672
O   -1.99317496    1.31298335    0.07751304   -0.00756280    0.00555037    0.00785589
O   -1.99338207   -1.36822366   -0.02038128   -0.00833395   -0.02026541    0.00312759
C   -0.77563888    0.70030738   -0.03186690    0.00785365   -0.01614467   -0.00641630
C   -0.88663105   -0.77694800   -0.05010410   -0.01745754    0.00243618   -0.00228478
C    0.37000840    1.53472570   -0.00258927    0.03339375    0.01507430    0.00606748
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C    1.75053822    1.24367306   -0.07025046    0.00469506   -0.01069372   -0.02212635
C    1.69684509   -1.22708497    0.00196587   -0.00337101   -0.02626965   -0.00788428
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H    2.34511714   -2.07701426    0.04696354   -0.00702467    0.01169327   -0.00087031
C    2.38090712    0.03553296    0.06255861    0.01025319    0.02104521    0.01809522
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   15
   -420.53786080
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O   -1.99484623   -1.37072620   -0.02021727   -0.00629303   -0.01906285    0.00322364
C   -0.77465706    0.70112763   -0.03167494    0.00716551   -0.01128399   -0.00594437
C   -0.88869011   -0.78398536   -0.05176110   -0.01865840   -0.00411252   -0.00227160
C    0.36721181    1.53394115   -0.00202486    0.02809308    0.01223102    0.00581197
C    0.35530462   -1.52048141   -0.01697434    0.00392015    0.01375104   -0.00142523
C    1.75128677    1.24773859   -0.07056428    0.00716778   -0.00585237   -0.02194308
C    1.69563519   -1.22416949    0.00346327   -0.00108471   -0.02535449   -0.00745290
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H    2.33138079    2.15687886    0.00632358   -0.00932904   -0.00104277    0.00416313
H    2.33710627   -2.07749462    0.04737212   -0.00830468    0.01208471   -0.00117854
C    2.38076740    0.03553422    0.06394224    0.01194585    0.01672746    0.01924994
H    3.46215663   -0.02068769    0.09481840   -0.00250977   -0.00352262   -0.00097433
   15
   -420.53811626
H   -2.68242044    0.64034979   -0.08436584   -0.00693010    0.00078887   -0.00540154
O   -1.97952415    1.31655879    0.07911879   -0.00462530    0.00190132    0.00709522
O   -1.99623897   -1.37301246   -0.02008981   -0.00430377   -0.01788456    0.00330629
C   -0.77378334    0.70211825   -0.03139314    0.00626623   -0.00622503   -0.00544582
C   -0.89046748   -0.79096080   -0.05338375   -0.01952814   -0.01042663   -0.00227401
C    0.36399130    1.53297180   -0.00154831    0.02209379    0.00929986    0.00554183
C    0.35289967   -1.52097755   -0.01919038    0.00197020    0.01605934   -0.00299691
C    1.75192729    1.25189296   -0.07054645    0.00936480   -0.00130073   -0.02165509
C    1.69444285   -1.22087346    0.00507340    0.00021771   -0.02215440   -0.00705908
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H    2.33228143    2.15983246   -0.00315295   -0.00954817   -0.00180697    0.00375216
H    2.33057167   -2.08012410    0.04799134   -0.00830740    0.01067708   -0.00138455
C    2.38044785    0.03528318    0.06503506    0.01301105    0.01189899    0.02020691
H    3.46100516   -0.01435884    0.08562350   -0.00346634   -0.00254700   -0.00139575
   15
   -420.53825694
H   -2.66979344    0.64516850   -0.08926112   -0.00269686    0.00319949   -0.00498796
O   -1.97261296    1.31830233    0.07979837   -0.00385393   -0.00088701    0.00639712
O   -1.99758278   -1.37509577   -0.01999984   -0.00244165   -0.01678400    0.00338286
C   -0.77300412    0.70320286   -0.03102902    0.00516377   -0.00106313   -0.00493061
C   -0.89195004   -0.79777905   -0.05497199   -0.02002931   -0.01636379   -0.00230052
C    0.36043743    1.53186177   -0.00115554    0.01552587    0.00642538    0.00527262
C    0.35046501   -1.52171717   -0.02136107   -0.00004891    0.01892132   -0.00460796
C    1.75242674    1.25606770   -0.07020135    0.01113843    0.00267983   -0.02124962
C    1.69324831   -1.21724497    0.00679030    0.00061091   -0.01688293   -0.00669268
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H    0.14912478   -2.58103670    0.10008372    0.00103383    0.00488842    0.00523879
H    2.33489227    2.16310159   -0.01330653   -0.00912902   -0.00189503    0.00336284
H    2.32551647   -2.08465215    0.04885843   -0.00717898    0.00765561   -0.00149561
C    2.37993253    0.03485264    0.06582261    0.01329454    0.00673793    0.02096177
H    3.46046855   -0.00757192    0.07667899   -0.00379018   -0.00153417   -0.00175816
   15
   -420.53819492
H   -2.65668386    0.64940927   -0.09326003    0.00175322    0.00571911   -0.00446660
O   -1.96565813    1.32005604    0.08040548   -0.00300424   -0.00379466    0.00560264
O   -1.99889871   -1.37698858   -0.01994825   -0.00077439   -0.01580732    0.00345990
C   -0.77230276    0.70430354   -0.03059037    0.00388561    0.00411160   -0.00440796
C   -0.89313025   -0.80435048   -0.05652540   -0.02013642   -0.02180795   -0.00235981
C    0.35664935    1.53065440   -0.00084251    0.00854838    0.00371435    0.00501547
C    0.34803117   -1.52274304   -0.02346211   -0.00215107    0.02193385   -0.00621560
C    1.75275841    1.26020282   -0.06953514    0.01239815    0.00591968   -0.02070456
C    1.69204524   -1.21336310    0.00860840    0.00039827   -0.01007302   -0.00634163
H    0.12122461    2.59567769    0.09787381    0.00294767    0.00477689    0.00339558
H    0.14803465   -2.58533435    0.11073176    0.00015077    0.00219212    0.00614549
H    2.33913734    2.16670198   -0.02406520   -0.00805330   -0.00127016    0.00295018
H    2.32174206   -2.09054203    0.04999383   -0.00525993    0.00348229   -0.00153507
C    2.37921722    0.03432042    0.06629347    0.01274924    0.00141111    0.02151601
H    3.46060422   -0.00050901    0.06805039   -0.00342728   -0.00050861   -0.00207535
   15
   -420.53782629
H   -2.64388444    0.65262575   -0.09645427    0.00581615    0.00784635   -0.00398848
O   -1.95866977    1.32185244    0.08094896   -0.00154930   -0.00631080    0.00486839
O   -2.00020563   -1.37870193   -0.01993591    0.00063854   -0.01499642    0.00354062
C   -0.77165997    0.70534214   -0.03008506    0.00246346    0.00921463   -0.00388715
C   -0.89400650   -0.81059291   -0.05804309   -0.01985159   -0.02666575   -0.00246035
C    0.35273238    1.52939055   -0.00060533    0.00131945    0.00124406    0.00477671
C    0.34562994   -1.52410021   -0.02546925   -0.00434296    0.02469116   -0.00775697
C    1.75290328    1.26424937   -0.06855608    0.01312739    0.00838243   -0.01999116
C    1.69083644   -1.20932992    0.01052237   -0.00006688   -0.00244583   -0.00598001
H    0.11979946    2.59409049    0.09750327    0.00352019    0.00417015    0.00335209
H    0.14691603   -2.59002675    0.12027369   -0.00069525   -0.00049472    0.00702759
H    2.34482357    2.17052172   -0.03535427   -0.00638331   -0.00000130    0.00249373
H    2.31890939   -2.09705102    0.05140477   -0.00299344   -0.00124245   -0.00152269
C    2.37831005    0.03376686    0.06643925    0.01145543   -0.00390894    0.02187892
H    3.46134780    0.00664559    0.05979491   -0.00243699    0.00050865   -0.00235865
   15
   -420.53721423
H   -2.63211764    0.65444262   -0.09892747    0.00887972    0.00907762   -0.00370567
O   -1.95166484    1.32371959    0.08143704    0.00100607   -0.00790320    0.00434991
O   -2.00151951   -1.38024496   -0.01996373    0.00175381   -0.01440111    0.00363120
C   -0.77105432    0.70624161   -0.02952096    0.00094309    0.01416002   -0.00337797
C   -0.89458307   -0.81643296   -0.05952351   -0.01918774   -0.03086734   -0.00260770
C    0.34879553    1.52810755   -0.00044039   -0.00595722   -0.00096257    0.00456454
C    0.34329437   -1.52582993   -0.02735927   -0.00659781    0.02682633   -0.00916552
C    1.75285025    1.26817000   -0.06727501    0.01337825    0.01016137   -0.01907864
C    1.68962845   -1.20525989    0.01252674   -0.00041256    0.00527745   -0.00559611
H    0.11774056    2.59175855    0.09653003    0.00408094    0.00315841    0.00325115
H    0.14591971   -2.59463602    0.12855211   -0.00142228   -0.00280482    0.00781829
H    2.35165227    2.17433515   -0.04709132   -0.00425881    0.00171954    0.00197094
H    2.31661609   -2.10333866    0.05308976   -0.00078716   -0.00586568   -0.00149583
C    2.37723035    0.03327220    0.06625446    0.00960838   -0.00906185    0.02205724
H    3.46252321    0.01370913    0.05196368   -0.00097294    0.00149619   -0.00261732
   15
   -420.53637730
H   -2.62192868    0.65464451   -0.10072857    0.01051266    0.00901155   -0.00374982
O   -1.94467262    1.32567519    0.08187548    0.00498711   -0.00818809    0.00416118
O   -2.00285298   -1.38162443   -0.02003275    0.00252897   -0.01402708    0.00373822
C   -0.77046286    0.70692729   -0.02890577   -0.00063784    0.01885911   -0.00288834
C   -0.89486995   -0.82180717   -0.06096445   -0.01818476   -0.03435929   -0.00280816
C    0.34494850    1.52683866   -0.00034446   -0.01306323   -0.00289843    0.00436559
C    0.34105860   -1.52796417   -0.02911094   -0.00889479    0.02806930   -0.01038568
C    1.75259541    1.27193763   -0.06570575    0.01325599    0.01142198   -0.01795045
C    1.68842624   -1.20126896    0.01461565   -0.00040429    0.01243810   -0.00517080
H    0.11494659    2.58886357    0.09497104    0.00460343    0.00184753    0.00311739
H    0.14517701   -2.59874964    0.13542521   -0.00200562   -0.00448188    0.00846246
H    2.35924379    2.17783601   -0.05918200   -0.00186463    0.00363681    0.00136395
H    2.31447002   -2.10857988    0.05504394    0.00101303   -0.00987323   -0.00146424
C    2.37600572    0.03291415    0.06573638    0.00748324   -0.01388205    0.02205764
H    3.46387020    0.02050409    0.04460328    0.00074024    0.00243324   -0.00285247
   15
   -420.53546020
H   -2.61360940    0.65324437   -0.10184941    0.01057429    0.00755686   -0.00415445
O   -1.93773830    1.32772236    0.08226634    0.01040651   -0.00703639    0.00436468
O   -2.00421480   -1.38284457   -0.02014420    0.00293963   -0.01389908    0.00386344
C   -0.76986173    0.70732825   -0.02824687   -0.00223892    0.02320916   -0.00243054
C   -0.89488225   -0.82666280   -0.06236286   -0.01687611   -0.03710865   -0.00306332
C    0.34129847    1.52561322   -0.00031450   -0.01977915   -0.00460583    0.00417084
C    0.33895729   -1.53052149   -0.03070590   -0.01117503    0.02822555   -0.01135638
C    1.75214045    1.27553292   -0.06386534    0.01288221    0.01237066   -0.01660462
C    1.68722953   -1.19746479    0.01678268    0.00009848    0.01853719   -0.00469981
H    0.11132422    2.58563900    0.09285025    0.00503797    0.00038936    0.00296472
H    0.14479285   -2.60206857    0.14077751   -0.00240895   -0.00532337    0.00891941
H    2.36717024    2.18068325   -0.07151697    0.00059048    0.00547041    0.00066812
H    2.31215046   -2.11205851    0.05726208    0.00219366   -0.01286571   -0.00145130
C    2.37466791    0.03276539    0.06488501    0.00538548   -0.01821342    0.02188236
H    3.46508399    0.02686208    0.03775599    0.00245229    0.00329564   -0.00305915
   15
   -420.53458728
H   -2.60717374    0.65050099   -0.10221773    0.00925608    0.00492024   -0.00487467
O   -1.93092302    1.32984817    0.08260740    0.01694217   -0.00461376    0.00488892
O   -2.00560962   -1.38390683   -0.02029949    0.00297301   -0.01401963    0.00400966
C   -0.76922676    0.70737886   -0.02755116   -0.00383417    0.02709863   -0.00201471
C   -0.89463971   -0.83095828   -0.06371488   -0.01530320   -0.03909929   -0.00337678
C    0.33794675    1.52445722   -0.00034761   -0.02588973   -0.00615853    0.00398514
C    0.33702485   -1.53350414   -0.03212948   -0.01337423    0.02720664   -0.01204892
C    1.75149088    1.27894132   -0.06177412    0.01238079    0.01320413   -0.01505665
C    1.68603069   -1.19393918    0.01902072    0.00113351    0.02321961   -0.00418566
H    0.10679675    2.58234391    0.09019584    0.00532166   -0.00103393    0.00279860
H    0.14483926   -2.60444266    0.14452739   -0.00259926   -0.00523223    0.00914989
H    2.37499241    2.18255046   -0.08397111    0.00290868    0.00696985   -0.00010447
H    2.30944679   -2.11323910    0.05974185    0.00262918   -0.01460474   -0.00146248
C    2.37324828    0.03289125    0.06370299    0.00360863   -0.02191196    0.02152847
H    3.46585958    0.03262815    0.03145891    0.00393760    0.00405974   -0.00322916
   15
   -420.53384954
H   -2.60239078    0.64688216   -0.10170602    0.00699816    0.00156023   -0.00576781
O   -1.92430042    1.33202553    0.08289283    0.02403378   -0.00131823    0.00561285
O   -2.00703779   -1.38480983   -0.02050027    0.00261721   -0.01437896    0.00417007
C   -0.76853384    0.70702044   -0.02682493   -0.00541225    0.03041356   -0.00165149
C   -0.89416606   -0.83466352   -0.06501577   -0.01350824   -0.04032620   -0.00374940
C    0.33498546    1.52339417   -0.00044102   -0.03117363   -0.00760581    0.00380466
C    0.33529444   -1.53689671   -0.03337125   -0.01542401    0.02501329   -0.01244595
C    1.75065415    1.28215004   -0.05945546    0.01185146    0.01406944   -0.01333418
C    1.68481409   -1.19076265    0.02132200    0.00267287    0.02626047   -0.00363037
H    0.10131371    2.57923310    0.08703717    0.00541977   -0.00225955    0.00264914
H    0.14535060   -2.60588830    0.14663344   -0.00258248   -0.00421041    0.00914507
H    2.38229561    2.18317027   -0.09640580    0.00491000    0.00794822   -0.00092595
H    2.30628123   -2.11181038    0.06248534    0.00227336   -0.01496458   -0.00150346
C    2.37177340    0.03334749    0.06219570    0.00239657   -0.02485431    0.02099198
H    3.46593251    0.03766520    0.02574244    0.00499706    0.00469643   -0.00335021
   15
   -420.53327131
H   -2.59886238    0.64298633   -0.10015606    0.00436704   -0.00204458   -0.00665756
O   -1.91795034    1.33421752    0.08311456    0.03102166    0.00232697    0.00637724
O   -2.00849529   -1.38554954   -0.02074837    0.00188046   -0.01494737    0.00434747
C   -0.76775914    0.70620307   -0.02607365   -0.00695898    0.03302327   -0.00135067
C   -0.89348837   -0.83775997   -0.06625990   -0.01154029   -0.04079379   -0.00417455
C    0.33249426    1.52244611   -0.00059192   -0.03542618   -0.00902049    0.00359825
C    0.33379697   -1.54066619   -0.03442520   -0.01725457    0.02175118   -0.01255335
C    1.74963815    1.28514587   -0.05693536    0.01137947    0.01507126   -0.01147856
C    1.68355655   -1.18798104    0.02367813    0.00464579    0.02754913   -0.00303861
H    0.09485893    2.57652389    0.08340169    0.00529614   -0.00310261    0.00251357
H    0.14632412   -2.60658808    0.14709642   -0.00237549   -0.00235143    0.00891385
H    2.38872141    2.18236890   -0.10867339    0.00646286    0.00825724   -0.00176737
H    2.30271775   -2.10770785    0.06549998    0.00113476   -0.01392367   -0.00157675
C    2.37026139    0.03417847    0.06037124    0.00192108   -0.02693977    0.02026896
H    3.46511369    0.04185884    0.02062830    0.00550439    0.00518675   -0.00341255
   15
   -420.53289590
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O   -2.00997380   -1.38611953   -0.02104579    0.00078991   -0.01569299    0.00453286
C   -0.76687924    0.70488738   -0.02530187   -0.00848145    0.03482809   -0.00112220
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   15
   -420.53272796
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O   -2.01146099   -1.38651137   -0.02139463   -0.00061706   -0.01658059    0.00472365
C   -0.76587107    0.70304617   -0.02451302   -0.00998070    0.03573175   -0.00096951
C   -0.89164174   -0.84210930   -0.06855145   -0.00725618   -0.03953306   -0.00516834
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   15
   -420.53276056
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O   -2.01294091   -1.38671508   -0.02179704   -0.00231811   -0.01753932    0.00490596
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C   -0.89053746   -0.84338118   -0.06958385   -0.00504329   -0.03786174   -0.00571988
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C    1.74557926    1.29269162   -0.04845248    0.01049878    0.01899585   -0.00555393
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C    2.36551162    0.03916411    0.05311819    0.00532306   -0.02753948    0.01699485
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   15
   -420.53297822
H   -2.58873625    0.63631670   -0.08092634   -0.00138541   -0.01045116   -0.00782152
O   -1.89669872    1.34235501    0.08321849    0.04780538    0.01274243    0.00752426
O   -2.01439434   -1.38671977   -0.02225509   -0.00423756   -0.01854869    0.00507937
C   -0.76338035    0.69774780   -0.02289223   -0.01278911    0.03455852   -0.00089574
C   -0.88935690   -0.84408138   -0.07052973   -0.00285722   -0.03555100   -0.00629318
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C    1.74390414    1.29466053   -0.04541677    0.01029516    0.02037187   -0.00359285
C    1.67746553   -1.18081853    0.03346563    0.01389610    0.01768927   -0.00044540
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C    2.36380018    0.04166696    0.05016228    0.00773236   -0.02585478    0.01555935
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   15
   -420.53338259
H   -2.58590383    0.63877222   -0.07259936   -0.00059888   -0.01010030   -0.00730808
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O   -2.01579956   -1.38651406   -0.02277075   -0.00631105   -0.01955486    0.00523465
C   -0.76185548    0.69430842   -0.02206141   -0.01400825    0.03244060   -0.00096783
C   -0.88813303   -0.84424477   -0.07138046   -0.00076213   -0.03265401   -0.00687594
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C    0.33059701   -1.56310539   -0.03693800   -0.02078681   -0.00016167   -0.01041752
C    1.74207344    1.29632174   -0.04232668    0.01001572    0.02151430   -0.00168020
C    1.67550233   -1.17983190    0.03595423    0.01523623    0.01351002    0.00017720
H    0.05033304    2.57117947    0.05879514    0.00110579   -0.00029659    0.00203419
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C    2.36197152    0.04455968    0.04697130    0.01039464   -0.02331033    0.01397918
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   15
   -420.53394580
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O   -1.88916593    1.34566156    0.08276543    0.04636983    0.01322253    0.00655798
O   -2.01713312   -1.38608657   -0.02334576   -0.00845766   -0.02052336    0.00537139
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C   -0.88689745   -0.84391508   -0.07212722    0.00117502   -0.02923252   -0.00745364
C    0.32964801    1.52030726   -0.00251945   -0.03310210   -0.01477909    0.00227414
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C    1.74009156    1.29765822   -0.03921111    0.00952312    0.02221016    0.00017558
C    1.67331018   -1.17905026    0.03844024    0.01543184    0.00992630    0.00073156
H    0.04003752    2.57102957    0.05270580   -0.00026105    0.00104633    0.00191650
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H    2.40018149    2.15338611   -0.17101795    0.00469707   -0.00288060   -0.00525725
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C    2.35998577    0.04780389    0.04356911    0.01299606   -0.01998338    0.01227765
H    3.44369166    0.04650877    0.00236646   -0.00168352    0.00460516   -0.00245677
   15
   -420.53467210
H   -2.58025335    0.64885343   -0.05214678    0.00345621   -0.00655887   -0.00558834
O   -1.88619523    1.34708990    0.08242418    0.04331269    0.01238806    0.00583231
O   -2.01837075   -1.38542633   -0.02398168   -0.01060212   -0.02141999    0.00548524
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C   -0.88567937   -0.84314397   -0.07276132    0.00289201   -0.02534675   -0.00801096
C    0.33113503    1.52068225   -0.00297954   -0.02826826   -0.01428329    0.00212603
C    0.33148400   -1.57253719   -0.03678300   -0.01850185   -0.00421423   -0.00943711
C    1.73796612    1.29865970   -0.03609812    0.00867315    0.02222126    0.00199409
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H    0.02978967    2.57069302    0.04627200   -0.00166241    0.00227192    0.00174974
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H    2.29559779   -2.04304052    0.09579525   -0.01359899    0.01017884   -0.00219490
C    2.35780401    0.05134941    0.03998140    0.01519998   -0.01596827    0.01048262
H    3.43945810    0.04403135    0.00112157   -0.00305089    0.00399134   -0.00215789
   15
   -420.53550360
H   -2.57815794    0.65584771   -0.04032803    0.00622260   -0.00379774   -0.00456812
O   -1.88371475    1.34837811    0.08201684    0.03908225    0.01112334    0.00504919
O   -2.01948823   -1.38452316   -0.02467981   -0.01264800   -0.02223289    0.00557387
C   -0.75595609    0.68125590   -0.01947187   -0.01599604    0.02046757   -0.00151734
C   -0.88450469   -0.84199008   -0.07327434    0.00431747   -0.02107595   -0.00853470
C    0.33304843    1.52127238   -0.00347183   -0.02256270   -0.01310221    0.00201973
C    0.33235686   -1.57717036   -0.03648793   -0.01648986   -0.00435287   -0.00899296
C    1.73571015    1.29932629   -0.03301527    0.00733029    0.02131797    0.00379555
C    1.66825108   -1.17790589    0.04337281    0.01120096    0.00666341    0.00148064
H    0.01984066    2.56995173    0.03952389   -0.00301855    0.00321180    0.00153847
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H    2.30201692   -2.03662120    0.10165293   -0.01270229    0.01018071   -0.00198697
C    2.35539328    0.05513563    0.03623527    0.01671274   -0.01135902    0.00862155
H    3.43576576    0.04083697    0.00026508   -0.00386731    0.00326769   -0.00185364
   15
   -420.53628917
H   -2.57718203    0.66352309   -0.02768657    0.00893971   -0.00085940   -0.00357902
O   -1.88167696    1.34954023    0.08155219    0.03416743    0.00978356    0.00431663
O   -2.02046239   -1.38336792   -0.02544113   -0.01452617   -0.02291927    0.00563326
C   -0.75351482    0.67619448   -0.01856711   -0.01580934    0.01495050   -0.00177338
C   -0.88339483   -0.84051791   -0.07365837    0.00538230   -0.01649103   -0.00901170
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C    0.33347855   -1.58173892   -0.03605696   -0.01403490   -0.00350457   -0.00851607
C    1.73334406    1.29967191   -0.02998984    0.00540493    0.01932347    0.00560894
C    1.66544822   -1.17749416    0.04580810    0.00668999    0.00726171    0.00164599
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H    2.31070279   -2.03201002    0.10786623   -0.01042296    0.00849632   -0.00162520
C    2.35273098    0.05909301    0.03235884    0.01731938   -0.00625456    0.00671811
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   15
   -420.53697294
H   -2.57780738    0.67135725   -0.01439889    0.01108797    0.00179394   -0.00271126
O   -1.88002665    1.35059106    0.08103844    0.02915291    0.00878647    0.00371778
O   -2.02127199   -1.38195284   -0.02626633   -0.01616823   -0.02347667    0.00566577
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C   -0.88236586   -0.83879667   -0.07390623    0.00605447   -0.01167482   -0.00943287
C    0.33780081    1.52301553   -0.00454712   -0.00950641   -0.00860777    0.00191654
C    0.33481195   -1.58625523   -0.03549737   -0.01118938   -0.00203991   -0.00795653
C    1.73089701    1.29972674   -0.02704921    0.00286206    0.01618360    0.00743762
C    1.66254571   -1.17719358    0.04821865    0.00096029    0.00896641    0.00168250
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H    2.32124906   -2.02890992    0.11437037   -0.00703624    0.00554930   -0.00113362
C    2.34980801    0.06314449    0.02838086    0.01693442   -0.00076460    0.00479504
H    3.43046255    0.03283523   -0.00050113   -0.00340481    0.00154347   -0.00125296
   15
   -420.53742574
H   -2.58041283    0.67887945   -0.00062026    0.01214188    0.00369793   -0.00201286
O   -1.87870752    1.35154155    0.08048236    0.02466586    0.00854396    0.00325852
O   -2.02189848   -1.38027160   -0.02715576   -0.01750198   -0.02387816    0.00566077
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C   -0.88142784   -0.83689907   -0.07401154    0.00627539   -0.00672052   -0.00978866
C    0.34044310    1.52410088   -0.00512855   -0.00268973   -0.00543660    0.00190885
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C    1.72840737    1.29953819   -0.02422105   -0.00022099    0.01195121    0.00928861
C    1.65962948   -1.17702928    0.05060386   -0.00545777    0.01123119    0.00163816
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H    2.33305276   -2.02679883    0.12107703   -0.00299140    0.00193603   -0.00053884
C    2.34663017    0.06720720    0.02433039    0.01559944    0.00499065    0.00286981
H    3.42876922    0.02833792   -0.00051889   -0.00217829    0.00056779   -0.00095885
   15
   -420.53759997
H   -2.58518282    0.68575134    0.01352346    0.01173567    0.00454570   -0.00147137
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O   -2.02232675   -1.37831964   -0.02810939   -0.01849384   -0.02411315    0.00563119
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C   -0.88058416   -0.83489991   -0.07396893    0.00604953   -0.00172463   -0.01007687
C    0.34312629    1.52526786   -0.00573886    0.00399587   -0.00178238    0.00191815
C    0.33793879   -1.59522011   -0.03402870   -0.00491097    0.00098944   -0.00638055
C    1.72592156    1.29917001   -0.02153332   -0.00369216    0.00682978    0.01112212
C    1.65679588   -1.17703477    0.05296432   -0.01197463    0.01347892    0.00156542
H   -0.01247237    2.56074925    0.01025931   -0.00672803    0.00238042    0.00032047
H    0.17105230   -2.67627196    0.05366110   -0.00025378   -0.00602142    0.00359840
H    2.38232145    2.13982123   -0.20050790    0.00087213   -0.00855658   -0.00706625
H    2.34539257   -2.02503634    0.12787993    0.00122292   -0.00168834    0.00010663
C    2.34321740    0.07119430    0.02023652    0.01348693    0.01086813    0.00095945
H    3.42746206    0.02373850   -0.00036417   -0.00051743   -0.00044042   -0.00066212
   15
   -420.53747924
H   -2.59204236    0.69182183    0.02793422    0.00974982    0.00422912   -0.00103916
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O   -2.02254559   -1.37609430   -0.02912685   -0.01910762   -0.02415889    0.00556041
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   15
   -420.53711909
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O   -2.02254802   -1.37359509   -0.03020735   -0.01933841   -0.02400556    0.00545906
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C   -0.87915960   -0.83089767   -0.07342364    0.00430194    0.00797003   -0.01043899
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C    1.72117229    1.29821163   -0.01668859   -0.01081551   -0.00475777    0.01449232
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   15
   -420.53653322
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O   -2.02233145   -1.37082380   -0.03134976   -0.01917231   -0.02362355    0.00532544
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C    0.34307196   -1.60877845   -0.03114776    0.00383379    0.00078325   -0.00296848
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   15
   -420.53585086
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O   -2.02189774   -1.36778476   -0.03255255   -0.01863141   -0.02301012    0.00516020
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C    0.35234611    1.52960440   -0.00847242    0.02556431    0.01354772    0.00195130
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C    1.71706980    1.29753665   -0.01271596   -0.01650787   -0.01549353    0.01699547
C    1.64810714   -1.17929094    0.06217085   -0.02966027    0.01528854    0.00193623
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H    0.17975853   -2.70350100   -0.00357230   -0.00006481   -0.01032960    0.00016743
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   15
   -420.53515862
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O   -2.02125302   -1.36448492   -0.03381383   -0.01772132   -0.02216781    0.00496529
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C    0.35386499    1.53031557   -0.00922951    0.02903764    0.01634846    0.00193819
C    0.34628285   -1.61787042   -0.02897324    0.00779407   -0.00417457   -0.00047982
C    1.71537237    1.29751076   -0.01110613   -0.01831585   -0.01962066    0.01778344
C    1.64693096   -1.18044783    0.06440665   -0.03056414    0.01336829    0.00237160
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H    2.39187026   -2.00313968    0.15948291    0.01212387   -0.00705330    0.00248840
C    2.32392294    0.08698682    0.00010443    0.00065316    0.03540113   -0.00778240
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   15
   -420.53455061
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O   -2.02040759   -1.36093384   -0.03513142   -0.01648046   -0.02108862    0.00474730
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C    0.35494591    1.53078066   -0.01001590    0.03162257    0.01825333    0.00192342
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C    1.71395084    1.29778008   -0.00976477   -0.01928123   -0.02255204    0.01822938
C    1.64621488   -1.18180584    0.06660637   -0.02983604    0.01059155    0.00298071
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H    2.39535082   -1.99477603    0.16471678    0.01108143   -0.00472532    0.00259501
C    2.31989279    0.08879481   -0.00366926   -0.00074557    0.03797379   -0.00925034
H    3.41131412    0.00381663    0.00119100    0.00525856   -0.00513310    0.00101622
   15
   -420.53408221
H   -2.64553525    0.72227310    0.11518445   -0.01193896   -0.00348235    0.00256406
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O   -2.01937551   -1.35714370   -0.03650284   -0.01493284   -0.01980816    0.00451040
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C   -0.87625943   -0.82405632   -0.06929669   -0.00565781    0.02495477   -0.01019958
C    0.35554980    1.53097106   -0.01083139    0.03329299    0.01909494    0.00192044
C    0.34903266   -1.62669434   -0.02676792    0.00972356   -0.01213995    0.00165945
C    1.71281975    1.29838871   -0.00869862   -0.01935949   -0.02411320    0.01833561
C    1.64594804   -1.18332311    0.06876085   -0.02755701    0.00711278    0.00374939
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H    0.18632813   -2.70587820   -0.04739643    0.00118475   -0.00325223   -0.00259020
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C    2.31587313    0.09003002   -0.00730324   -0.00151308    0.03942090   -0.01059005
H    3.40555158    0.00310642    0.00108106    0.00408994   -0.00531739    0.00120287
   15
   -420.53371512
H   -2.65020140    0.72867686    0.12883934   -0.01262668   -0.00257235    0.00318746
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O   -2.01817427   -1.35312914   -0.03792539   -0.01312258   -0.01828885    0.00425590
C   -0.71697103    0.62634336   -0.00595859    0.01321265   -0.04405372   -0.00407010
C   -0.87555969   -0.82365766   -0.06800143   -0.00814144    0.02624024   -0.00998513
C    0.35565143    1.53087414   -0.01167593    0.03402963    0.01878224    0.00193646
C    0.35019320   -1.63086250   -0.02569500    0.00997487   -0.01647933    0.00249869
C    1.71198031    1.29936018   -0.00790932   -0.01856738   -0.02423206    0.01812739
C    1.64609618   -1.18494737    0.07085845   -0.02391135    0.00318029    0.00467058
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C    2.31187567    0.09067062   -0.01077727   -0.00172406    0.03968569   -0.01179329
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   15
   -420.53345992
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O   -2.01682438   -1.34890731   -0.03939621   -0.01107945   -0.01660088    0.00398930
C   -0.71384923    0.62453319   -0.00448515    0.01657959   -0.04548331   -0.00406557
C   -0.87473686   -0.82365473   -0.06655525   -0.01062363    0.02666074   -0.00972542
C    0.35523971    1.53049463   -0.01254977    0.03379595    0.01733349    0.00197716
C    0.35120350   -1.63478193   -0.02465965    0.00979684   -0.02046819    0.00317571
C    1.71142063    1.30069632   -0.00739375   -0.01698872   -0.02294255    0.01764244
C    1.64660465   -1.18661959    0.07288530   -0.01926218   -0.00085825    0.00569848
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H    0.18977156   -2.70375676   -0.07457076    0.00210452    0.00318583   -0.00396328
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C    2.30790380    0.09071264   -0.01407316   -0.00155504    0.03876286   -0.01285375
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   15
   -420.53327533
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O   -1.87877240    1.35073115    0.07251096    0.00681477    0.01971541    0.00007720
O   -2.01534898   -1.34449734   -0.04091227   -0.00885584   -0.01475263    0.00371154
C   -0.71097799    0.62340942   -0.00295031    0.01985751   -0.04584101   -0.00400741
C   -0.87375342   -0.82405381   -0.06496207   -0.01306257    0.02618408   -0.00942589
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C    0.35206588   -1.63839283   -0.02367214    0.00937239   -0.02365408    0.00370319
C    1.71111670    1.30237780   -0.00714471   -0.01468552   -0.02038030    0.01694458
C    1.64740382   -1.18827930    0.07482595   -0.01415353   -0.00449705    0.00676295
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H    2.39403462   -1.95944926    0.18119820   -0.00142905    0.01126210    0.00178433
C    2.30395521    0.09017018   -0.01717487   -0.00123624    0.03666723   -0.01377129
H    3.38522169    0.00663811   -0.00063009   -0.00212644   -0.00461097    0.00143991
   15
   -420.53314265
H   -2.65149798    0.74909790    0.16609091   -0.00644667    0.00531746    0.00386340
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O   -2.01377324   -1.33992014   -0.04247042   -0.00650155   -0.01277980    0.00342842
C   -0.70840690    0.62297745   -0.00135493    0.02303881   -0.04512904   -0.00390412
C   -0.87257265   -0.82484772   -0.06322642   -0.01536593    0.02483595   -0.00908574
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C    0.35278678   -1.64164759   -0.02274052    0.00876173   -0.02561568    0.00414046
C    1.71103417    1.30436617   -0.00715166   -0.01187952   -0.01678098    0.01608354
C    1.64841716   -1.18987215    0.07666441   -0.00921159   -0.00719402    0.00777615
H   -0.01173647    2.55031896   -0.06347575   -0.00275060   -0.00201590   -0.00320506
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H    2.32114585    2.19515999   -0.13068632   -0.00439118    0.00031804   -0.00478199
H    2.39271863   -1.95375600    0.18438784   -0.00468672    0.01478470    0.00151664
C    2.30002551    0.08907460   -0.02006854   -0.00108230    0.03355179   -0.01454496
H    3.37866704    0.00956211   -0.00170878   -0.00428095   -0.00404178    0.00141763
   15
   -420.53309029
H   -2.64892317    0.75473540    0.17713556   -0.00267058    0.00884737    0.00364732
O   -1.88077046    1.34751744    0.07091081   -0.00300854    0.01254848    0.00049619
O   -2.01212381   -1.33519806   -0.04406746   -0.00408184   -0.01071256    0.00313663
C   -0.70618392    0.62322653    0.00029943    0.02606825   -0.04336442   -0.00375549
C   -0.87115981   -0.82601612   -0.06135346   -0.01745644    0.02266401   -0.00870955
C    0.35103432    1.52795741   -0.01535549    0.02712893    0.00732200    0.00224968
C    0.35337532   -1.64451682   -0.02187144    0.00806111   -0.02613460    0.00451235
C    1.71113087    1.30660740   -0.00740166   -0.00875532   -0.01246953    0.01511747
C    1.64957080   -1.19135804    0.07838547   -0.00509709   -0.00839807    0.00864466
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H    0.19203370   -2.70554210   -0.10976159    0.00245286    0.00734121   -0.00556016
H    2.31560592    2.19920680   -0.11680678   -0.00608782   -0.00070747   -0.00381780
H    2.39223122   -1.95070541    0.18730259   -0.00689797    0.01699882    0.00137653
C    2.29611275    0.08747283   -0.02274247   -0.00139677    0.02953837   -0.01517790
H    3.37287675    0.01321193   -0.00304198   -0.00599270   -0.00335209    0.00134867
   15
   -420.53318363
H   -2.64586536    0.75878397    0.18752500    0.00096496    0.01209409    0.00331593
O   -1.88174697    1.34567577    0.07010379   -0.00741640    0.00898851    0.00087293
O   -2.01042809   -1.33035451   -0.04570007   -0.00165072   -0.00859872    0.00283926
C   -0.70435490    0.62413009    0.00201051    0.02892332   -0.04062794   -0.00356405
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   15
   -420.53343260
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   15
   -420.53379470
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   15
   -420.53419885
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   15
   -420.53451211
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   15
   -420.53467155
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   15
   -420.53464927
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   15
   -420.53451465
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   15
   -420.53438602
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   15
   -420.53438034
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   15
   -420.53455616
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   15
   -420.53490727
H   -2.61374713    0.66563917    0.25197193   -0.00944230   -0.00116820    0.00878034
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   15
   -420.53535542
H   -2.60334352    0.65264038    0.25032345   -0.00644721   -0.00038532    0.00847348
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O   -1.99419155   -1.27080395   -0.06671630    0.00578307    0.00907030   -0.00185361
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   15
   -420.53576416
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   15
   -420.53607882
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   15
   -420.53625543
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   15
   -420.53640859
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   15
   -420.53666674
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   15
   -420.53707034
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   15
   -420.53765615
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   15
   -420.53831896
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   15
   -420.53898974
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   15
   -420.53957757
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   15
   -420.54011952
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   15
   -420.54065470
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O   -1.98373560   -1.22353442   -0.08444594   -0.00815384    0.00949679   -0.00738186
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C   -0.79091260   -0.82088559    0.00351025    0.02400983   -0.02346514    0.01113438
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   15
   -420.54123794
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   15
   -420.54195825
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   15
   -420.54278754
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   15
   -420.54367149
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   15
   -420.54448489
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   15
   -420.54510323
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   15
   -420.54541446
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   15
   -420.54537128
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O   -1.97084208   -1.20084227   -0.09038580   -0.00603913    0.00943251   -0.00597817
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   15
   -420.54502926
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   15
   -420.54444840
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   15
   -420.54379249
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C    0.31389679    1.62102685   -0.03814626   -0.00597698    0.01627486   -0.00974208
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   15
   -420.54305660
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O   -1.96264638   -1.19204763   -0.09162931   -0.00420432    0.01028107   -0.00416147
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C   -0.79399351   -0.74879732    0.01251919   -0.01704396    0.02325538    0.01228473
C    0.31238269    1.62351591   -0.03671514   -0.01003989    0.01381063   -0.00916030
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C    1.70662421   -1.28392275    0.01981783    0.01420408   -0.01194511   -0.00165146
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   15
   -420.54228357
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O   -1.96046392   -1.19013382   -0.09180863   -0.00363433    0.01056824   -0.00365216
C   -0.71540263    0.72561930    0.04284543    0.04584231   -0.01162673    0.00323666
C   -0.79369143   -0.74386988    0.01197029   -0.01898687    0.02497274    0.01162322
C    0.31102029    1.62579579   -0.03514563   -0.01404315    0.01165499   -0.00847941
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C    1.68328149    1.24106182   -0.04467572   -0.00098341   -0.00898754   -0.00008028
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   15
   -420.54137664
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O   -1.95824025   -1.18833995   -0.09194654   -0.00304432    0.01089468   -0.00312472
C   -0.71443211    0.73010751    0.04228298    0.05122727   -0.00882111    0.00280959
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C    0.30987002    1.62789875   -0.03344802   -0.01786029    0.01005601   -0.00771055
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C    1.68334411    1.23727934   -0.04446112    0.00006204   -0.00948170    0.00073350
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C    2.30575726   -0.00001526    0.01505345    0.00801536   -0.00722926    0.00548046
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   15
   -420.54037292
H   -2.56135204    0.38424121   -0.13673295   -0.00224347    0.00276795   -0.00706871
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O   -1.95598201   -1.18666970   -0.09204902   -0.00247068    0.01125271   -0.00258150
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C   -0.79220523   -0.73516293    0.01035695   -0.02146452    0.02668324    0.01003979
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C    0.36807903   -1.63507659    0.02469632    0.00297367   -0.01268930   -0.00722014
C    1.68340628    1.23364062   -0.04425759    0.00066523   -0.01033307    0.00154095
C    1.71247450   -1.28496706    0.00729839    0.01117971    0.00704845   -0.00676917
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H    2.43442617   -2.10154643    0.02164318    0.00325698    0.00237881   -0.00043527
C    2.30719875   -0.00466154    0.01708355    0.00523978   -0.01190454    0.00594409
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   15
   -420.53924928
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O   -1.95369572   -1.18512711   -0.09212223   -0.00193760    0.01163652   -0.00202988
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C   -0.79098374   -0.73140932    0.00931644   -0.02191500    0.02668652    0.00914053
C    0.30842954    1.63165792   -0.02971591   -0.02413086    0.00922626   -0.00599679
C    0.36698113   -1.63177021    0.02844263    0.00152695   -0.01011009   -0.00600732
C    1.68345889    1.23015845   -0.04407739    0.00086369   -0.01144152    0.00235594
C    1.71405633   -1.28539285    0.00329560    0.00954985    0.01327655   -0.00841372
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C    2.30856104   -0.00912826    0.01902382    0.00243671   -0.01622591    0.00637165
H    3.39951790    0.02480400    0.04357436    0.00289218    0.00158947    0.00220586
   15
   -420.53814541
H   -2.56925951    0.37033339   -0.16164438   -0.00740470   -0.00126544   -0.00951316
O   -2.01743006    1.17479268    0.07416676   -0.02151289   -0.02127334    0.00639166
O   -1.95138738   -1.18371653   -0.09217240   -0.00147594    0.01203856   -0.00147862
C   -0.71639823    0.74419334    0.04036413    0.05996807   -0.00004696    0.00169692
C   -0.78943160   -0.72805858    0.00813779   -0.02179943    0.02616409    0.00818679
C    0.30823389    1.63332675   -0.02770726   -0.02627392    0.01003851   -0.00510338
C    0.36586049   -1.62831023    0.03227951   -0.00017897   -0.00816339   -0.00460418
C    1.68349878    1.22684934   -0.04393282    0.00076506   -0.01261368    0.00314903
C    1.71549328   -1.28601808   -0.00058006    0.00831681    0.01842065   -0.00998804
H    0.09315414    2.70660822   -0.03007307    0.00109053    0.00696190    0.00207636
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H    2.44470455   -2.11714599    0.01290357    0.01008348   -0.00494725   -0.00004741
C    2.30988609   -0.01335028    0.02086778   -0.00002963   -0.02003066    0.00677096
H    3.40375571    0.02837770    0.04707755    0.00494344    0.00244415    0.00251665
   15
   -420.53719218
H   -2.57143933    0.36354207   -0.17164182   -0.00912630   -0.00255637   -0.01051451
O   -2.02122475    1.17027017    0.07472659   -0.02021912   -0.02205518    0.00734092
O   -1.94906219   -1.18244252   -0.09220580   -0.00111574    0.01244711   -0.00094432
C   -0.71882582    0.74894862    0.03966604    0.05988713    0.00259278    0.00135588
C   -0.78755058   -0.72510280    0.00683542   -0.02109530    0.02513981    0.00718815
C    0.30843442    1.63484289   -0.02562145   -0.02752857    0.01160374   -0.00421034
C    0.36474290   -1.62472588    0.03618579   -0.00215540   -0.00697602   -0.00303750
C    1.68352732    1.22373078   -0.04383580    0.00048600   -0.01365170    0.00388321
C    1.71680374   -1.28692000   -0.00430480    0.00770054    0.02206838   -0.01147921
H    0.10459789    2.70701818   -0.03741560    0.00218979    0.00502478    0.00162905
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H    2.34914194    2.07812345   -0.19409837   -0.00242501    0.00328910   -0.00659397
H    2.44741702   -2.12392931    0.00856361    0.01222567   -0.00735598    0.00010699
C    2.31121077   -0.01727025    0.02260938   -0.00183946   -0.02317984    0.00715830
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   15
   -420.53646762
H   -2.57198837    0.35720005   -0.17975056   -0.00998442   -0.00310349   -0.01124065
O   -2.02478992    1.16599837    0.07520336   -0.01912433   -0.02342562    0.00806515
O   -1.94672424   -1.18130968   -0.09222843   -0.00086953    0.01284816   -0.00041602
C   -0.72215688    0.75366501    0.03894745    0.05815136    0.00496487    0.00101393
C   -0.78535133   -0.72252658    0.00542441   -0.01980548    0.02367053    0.00615191
C    0.30905000    1.63618291   -0.02347196   -0.02780586    0.01371574   -0.00333123
C    0.36365822   -1.62103511    0.04013782   -0.00439623   -0.00655863   -0.00132895
C    1.68354861    1.22081828   -0.04379738    0.00013198   -0.01438279    0.00451601
C    1.71799690   -1.28815344   -0.00785610    0.00779855    0.02396124   -0.01287871
H    0.11564815    2.70652856   -0.04505142    0.00322885    0.00274108    0.00118380
H    0.07933173   -2.68104372    0.12987438   -0.00315916   -0.00870250    0.00490534
H    2.34840538    2.07666285   -0.20694418   -0.00179839    0.00460649   -0.00743426
H    2.44794425   -2.12940483    0.00420488    0.01328126   -0.00862900    0.00022839
C    2.31256223   -0.02084067    0.02424274   -0.00278406   -0.02555683    0.00754358
H    3.40932878    0.03406933    0.05267623    0.00708075    0.00387965    0.00302976
   15
   -420.53604594
H   -2.57075255    0.35140475   -0.18584097   -0.00994548   -0.00283491   -0.01162082
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O   -1.94437632   -1.18032257   -0.09224627   -0.00074898    0.01323483    0.00010304
C   -0.72636517    0.75830672    0.03821355    0.05475694    0.00701693    0.00065885
C   -0.78285333   -0.72030773    0.00392040   -0.01793938    0.02178205    0.00509455
C    0.31008473    1.63731526   -0.02127208   -0.02703915    0.01607537   -0.00246686
C    0.36264026   -1.61724436    0.04410985   -0.00684598   -0.00683557    0.00047283
C    1.68356787    1.21812269   -0.04382710   -0.00019942   -0.01465949    0.00500657
C    1.71907126   -1.28974688   -0.01121279    0.00863167    0.02396610   -0.01418219
H    0.12611965    2.70554658   -0.05290144    0.00411966    0.00039113    0.00077448
H    0.07771010   -2.67444178    0.12696204   -0.00257300   -0.00686353    0.00434875
H    2.34799506    2.07437944   -0.21845379   -0.00134231    0.00547786   -0.00814841
H    2.44609718   -2.13334455   -0.00019450    0.01318639   -0.00867498    0.00031677
C    2.31395458   -0.02402572    0.02576203   -0.00274894   -0.02707313    0.00793760
H    3.41028263    0.03592971    0.05467958    0.00692277    0.00439192    0.00321514
   15
   -420.53593006
H   -2.56773906    0.34610820   -0.18984453   -0.00902368   -0.00176657   -0.01164055
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O   -1.94201979   -1.17948555   -0.09226518   -0.00074836    0.01359249    0.00058363
C   -0.73139941    0.76284274    0.03746972    0.04974787    0.00875063    0.00028295
C   -0.78008475   -0.71841778    0.00233938   -0.01552722    0.01952656    0.00402414
C    0.31152698    1.63820467   -0.01903487   -0.02520386    0.01834764   -0.00161270
C    0.36172596   -1.61334960    0.04807463   -0.00941410   -0.00763324    0.00233999
C    1.68359004    1.21564811   -0.04393231   -0.00045386   -0.01440413    0.00531361
C    1.72001428   -1.29170035   -0.01435516    0.01015431    0.02206458   -0.01539087
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H    0.07654889   -2.66661654    0.12326779   -0.00175852   -0.00422768    0.00372257
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H    2.44189270   -2.13574009   -0.00465049    0.01195466   -0.00748611    0.00037457
C    2.31538728   -0.02680252    0.02716130   -0.00172157   -0.02767881    0.00834287
H    3.41000237    0.03700190    0.05610483    0.00592064    0.00472998    0.00335015
   15
   -420.53599596
H   -2.56311241    0.34111981   -0.19175732   -0.00732296   -0.00001075   -0.01132657
O   -2.03421901    1.15487615    0.07606918   -0.01708386   -0.03094580    0.00856344
O   -1.93965467   -1.17880268   -0.09229069   -0.00084847    0.01391833    0.00103711
C   -0.73718399    0.76724681    0.03672165    0.04323013    0.01018490   -0.00011576
C   -0.77708199   -0.71682268    0.00069754   -0.01263024    0.01695224    0.00294323
C    0.31334913    1.63881722   -0.01677330   -0.02239251    0.02015474   -0.00074030
C    0.36095403   -1.60933912    0.05200403   -0.01198370   -0.00866735    0.00420051
C    1.68361891    1.21339064   -0.04411759   -0.00058873   -0.01358222    0.00541091
C    1.72080311   -1.29398526   -0.01726494    0.01224515    0.01834906   -0.01650334
H    0.14471561    2.70373313   -0.06894593    0.00532255   -0.00321763   -0.00003822
H    0.07570234   -2.65803847    0.11890385   -0.00078699   -0.00109045    0.00306342
H    2.34787581    2.06681573   -0.23697912   -0.00122113    0.00557137   -0.00908173
H    2.43555123   -2.13680448   -0.00917354    0.00967675   -0.00515172    0.00040696
C    2.31684490   -0.02916191    0.02843441    0.00019318   -0.02737354    0.00876316
H    3.40866733    0.03722495    0.05692755    0.00416980    0.00488699    0.00343891
   15
   -420.53613081
H   -2.55717592    0.33612575   -0.19163482   -0.00503525    0.00225462   -0.01075117
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O   -1.93727987   -1.17827765   -0.09232793   -0.00102026    0.01420781    0.00145781
C   -0.74362058    0.77149720    0.03597535    0.03537372    0.01136315   -0.00053624
C   -0.77388875   -0.71548355   -0.00098880   -0.00931701    0.01410910    0.00186358
C    0.31550870    1.63912585   -0.01450056   -0.01866770    0.02123732    0.00016771
C    0.36036309   -1.60519770    0.05586998   -0.01439489   -0.00959456    0.00601259
C    1.68365656    1.21133789   -0.04438442   -0.00061410   -0.01222987    0.00529273
C    1.72140633   -1.29654568   -0.01992532    0.01472234    0.01305046   -0.01751951
H    0.15262254    2.70354438   -0.07699364    0.00557769   -0.00395873   -0.00046209
H    0.07499664   -2.64926605    0.11398836    0.00023501    0.00218172    0.00241292
H    2.34814512    2.06151947   -0.24382730   -0.00158577    0.00475114   -0.00925209
H    2.42748051   -2.13695586   -0.01376961    0.00654251   -0.00184148    0.00042239
C    2.31829878   -0.03110849    0.02957501    0.00278878   -0.02619172    0.00919077
H    3.40658963    0.03657078    0.05713189    0.00186875    0.00486891    0.00347814
   15
   -420.53617763
H   -2.55033761    0.33072259   -0.18957901   -0.00242585    0.00474147   -0.01002845
O   -2.03952559    1.14916761    0.07616396   -0.01566901   -0.03749306    0.00782874
O   -1.93489346   -1.17791375   -0.09238170   -0.00121892    0.01444692    0.00185011
C   -0.75059063    0.77557603    0.03523718    0.02639191    0.01233667   -0.00097461
C   -0.77055504   -0.71435748   -0.00270333   -0.00568409    0.01104888    0.00079171
C    0.31794950    1.63911450   -0.01223047   -0.01418043    0.02140801    0.00114849
C    0.35998937   -1.60091185    0.05964519   -0.01644260   -0.00998126    0.00771781
C    1.68370330    1.20946949   -0.04473102   -0.00052362   -0.01042499    0.00496414
C    1.72178681   -1.29930198   -0.02232093    0.01729722    0.00657203   -0.01843738
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H    3.40417949    0.03504222    0.05671056   -0.00071449    0.00469475    0.00348330
   15
   -420.53610660
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O   -1.93249325   -1.17771368   -0.09245641   -0.00139694    0.01462488    0.00221075
C   -0.75795871    0.77946853    0.03451376    0.01656143    0.01315362   -0.00141909
C   -0.76713563   -0.71339828   -0.00442986   -0.00184435    0.00783567   -0.00026055
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   15
   -420.53589646
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O   -1.93007724   -1.17767945   -0.09255618   -0.00149982    0.01472296    0.00253716
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C   -0.76368839   -0.71255749   -0.00615248    0.00205949    0.00454656   -0.00128624
C    0.32339602    1.63813532   -0.00775850   -0.00373711    0.01910874    0.00332057
C    0.36000823   -1.59189941    0.06682215   -0.01868683   -0.00765977    0.01072316
C    1.68381855    1.20617297   -0.04564101   -0.00029986   -0.00611304    0.00379598
C    1.72173100   -1.30500457   -0.02626391    0.02097419   -0.00740986   -0.01995575
H    0.17038329    2.70690825   -0.10027305    0.00495190   -0.00113100   -0.00208116
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H    2.39893755   -2.13830300   -0.02801816   -0.00455607    0.00977596    0.00044094
C    2.32222671   -0.03470685    0.03213747    0.01127394   -0.01837975    0.01042295
H    3.40019403    0.02950881    0.05399141   -0.00537547    0.00399464    0.00342095
   15
   -420.53561403
H   -2.52901149    0.30782211   -0.17307869    0.00419795    0.00992454   -0.00830528
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O   -1.92764435   -1.17781208   -0.09268469   -0.00147441    0.01470713    0.00282687
C   -0.77328763    0.78664657    0.03313785   -0.00438078    0.01449844   -0.00227106
C   -0.76027224   -0.71178541   -0.00785568    0.00590718    0.00124189   -0.00227666
C    0.32624445    1.63720184   -0.00558943    0.00178080    0.01697893    0.00449425
C    0.36043429   -1.58720842    0.07017850   -0.01857107   -0.00455280    0.01201230
C    1.68388386    1.20468013   -0.04618686   -0.00032356   -0.00401009    0.00304955
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C    2.32324982   -0.03529013    0.03268450    0.01302903   -0.01480533    0.01078266
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   15
   -420.53533028
H   -2.52294995    0.29692944   -0.16447719    0.00515881    0.00985684   -0.00816943
O   -2.04817757    1.14305172    0.07531423   -0.00631165   -0.04310698    0.00731956
O   -1.92519486   -1.17811148   -0.09284523   -0.00128931    0.01459014    0.00307253
C   -0.78093270    0.78991171    0.03249820   -0.01478942    0.01508465   -0.00264441
C   -0.75694517   -0.71103225   -0.00952445    0.00954946   -0.00197372   -0.00324564
C    0.32906610    1.63601197   -0.00348831    0.00718888    0.01456383    0.00568878
C    0.36114001   -1.58245006    0.07335341   -0.01754347   -0.00023175    0.01317067
C    1.68395435    1.20324830   -0.04677878   -0.00057176   -0.00223063    0.00227193
C    1.72043302   -1.31027792   -0.02900265    0.01947288   -0.01773385   -0.02092819
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C    2.32407727   -0.03564986    0.03306854    0.01371180   -0.01099305    0.01110902
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   15
   -420.53506953
H   -2.51780588    0.28427778   -0.15440187    0.00534592    0.00872081   -0.00823436
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O   -1.92273093   -1.17857623   -0.09304057   -0.00090719    0.01433177    0.00325933
C   -0.78835478    0.79294881    0.03189848   -0.02469080    0.01563022   -0.00296758
C   -0.75376208   -0.71024944   -0.01114422    0.01285294   -0.00503237   -0.00417448
C    0.33177944    1.63460190   -0.00147317    0.01228460    0.01214759    0.00685388
C    0.36210990   -1.57768925    0.07632931   -0.01563056    0.00496896    0.01422042
C    1.68403386    1.20185084   -0.04740507   -0.00113700   -0.00097439    0.00151246
C    1.71933355   -1.31254873   -0.02990079    0.01605516   -0.02011645   -0.02113321
H    0.18026582    2.71163853   -0.12012856    0.00324558    0.00498490   -0.00402606
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H    2.36008110    2.02199134   -0.25111645   -0.00497474   -0.00523233   -0.00734034
H    2.37672239   -2.15414610   -0.04297194   -0.00830365    0.01187741    0.00035398
C    2.32469882   -0.03584349    0.03328465    0.01321934   -0.00708477    0.01140433
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   15
   -420.53482821
H   -2.51361482    0.27006924   -0.14284291    0.00487654    0.00668064   -0.00837460
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O   -1.92025691   -1.17920340   -0.09327282   -0.00032207    0.01392039    0.00337659
C   -0.79540455    0.79574964    0.03134354   -0.03375933    0.01613137   -0.00322847
C   -0.75077279   -0.70939084   -0.01270091    0.01571866   -0.00784546   -0.00506729
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C    0.36331518   -1.57300407    0.07909032   -0.01294216    0.01058414    0.01517367
C    1.68413101    1.20046890   -0.04805430   -0.00207005   -0.00036807    0.00080742
C    1.71799328   -1.31451780   -0.03047968    0.01104048   -0.02053785   -0.02110914
H    0.18224773    2.71190313   -0.12545414    0.00267092    0.00643269   -0.00460143
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H    2.36479996    2.01699330   -0.24725554   -0.00457580   -0.00603082   -0.00694954
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C    2.32512185   -0.03592999    0.03332835    0.01162354   -0.00319795    0.01167822
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   15
   -420.53452662
H   -2.51029504    0.25466651   -0.12977626    0.00394741    0.00403395   -0.00846620
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O   -1.91777940   -1.17998833   -0.09354328    0.00046174    0.01333920    0.00339815
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C    0.36471543   -1.56847882    0.08162202   -0.00965368    0.01611076    0.01603578
C    1.68425988    1.19909339   -0.04871582   -0.00336858   -0.00045521    0.00017059
C    1.71648747   -1.31617826   -0.03073969    0.00489842   -0.01938229   -0.02084206
H    0.18374774    2.71101905   -0.12995250    0.00217775    0.00722863   -0.00508884
H    0.05993941   -2.61549057    0.06717449   -0.00026027   -0.00114236   -0.00153342
H    2.37033482    2.01307258   -0.24214260   -0.00366884   -0.00622740   -0.00662380
H    2.36892599   -2.17506340   -0.05325798   -0.00437733    0.00462995    0.00000048
C    2.32537019   -0.03596797    0.03319549    0.00916409    0.00055481    0.01194203
H    3.40828818    0.00465125    0.03666089   -0.00256616    0.00144633    0.00288627
   15
   -420.53409239
H   -2.50768130    0.23854116   -0.11518954    0.00273077    0.00111076   -0.00829657
O   -2.05580481    1.14445074    0.07309813    0.00968547   -0.03033335    0.00869292
O   -1.91530730   -1.18092444   -0.09385220    0.00141717    0.01259828    0.00334192
C   -0.80785713    0.80061305    0.03038283   -0.04829265    0.01694867   -0.00355540
C   -0.74554061   -0.70728134   -0.01557157    0.01982775   -0.01244637   -0.00673890
C    0.33854035    1.62939070    0.00388594    0.02409933    0.00716807    0.00980694
C    0.36626115   -1.56419644    0.08391137   -0.00596287    0.02105845    0.01680654
C    1.68444005    1.19772551   -0.04937998   -0.00497201   -0.00116421   -0.00041523
C    1.71490815   -1.31754689   -0.03068486   -0.00172620   -0.01722438   -0.02034190
H    0.18485426    2.70884468   -0.13353647    0.00178538    0.00726010   -0.00545315
H    0.05708757   -2.61447986    0.06168960   -0.00114292   -0.00376737   -0.00201075
H    2.37652343    2.01026462   -0.23583646   -0.00230305   -0.00583991   -0.00635211
H    2.36641551   -2.18714000   -0.05841884   -0.00150030   -0.00034149   -0.00030611
C    2.32548061   -0.03601405    0.03288208    0.00618727    0.00407056    0.01220183
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   15
   -420.53355031
H   -2.50555956    0.22221590   -0.09911297    0.00148799   -0.00181709   -0.00783655
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O   -1.91285139   -1.18200343   -0.09419878    0.00250436    0.01172959    0.00314433
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C    0.36789676   -1.56023127    0.08594677   -0.00208508    0.02504513    0.01746630
C    1.68469560    1.19637584   -0.05003789   -0.00674714   -0.00235922   -0.00098483
C    1.71335470   -1.31865557   -0.03032274   -0.00819980   -0.01468201   -0.01962700
H    0.18563756    2.70537461   -0.13614096    0.00151970    0.00649686   -0.00567411
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H    2.38312139    2.00850143   -0.22838650   -0.00058093   -0.00498864   -0.00610191
H    2.36417527   -2.19915557   -0.06352366    0.00132084   -0.00531035   -0.00068028
C    2.32549766   -0.03612127    0.03238419    0.00307314    0.00724511    0.01245723
H    3.41669861   -0.00778292    0.02592684    0.00288267    0.00026771    0.00238538
   15
   -420.53293795
H   -2.50370705    0.20621505   -0.08163028    0.00033232   -0.00454471   -0.00701778
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O   -1.91042390   -1.18321551   -0.09458079    0.00365050    0.01076338    0.00280304
C   -0.81741961    0.80445343    0.02963593   -0.05678958    0.01737009   -0.00363605
C   -0.74149534   -0.70442790   -0.01803543    0.02156580   -0.01529613   -0.00824081
C    0.34133178    1.62532748    0.00674351    0.02807812    0.00682427    0.01102403
C    0.36956389   -1.55664325    0.08771821    0.00176904    0.02779239    0.01801544
C    1.68505316    1.19506216   -0.05068088   -0.00852067   -0.00382735   -0.00157951
C    1.71192440   -1.31954208   -0.02966407   -0.01398498   -0.01227980   -0.01874356
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H    0.05212772   -2.61010025    0.05188836   -0.00241634   -0.00684092   -0.00289044
H    2.38982115    2.00763179   -0.21983874    0.00133241   -0.00382722   -0.00581988
H    2.36170409   -2.21022337   -0.06850532    0.00366143   -0.00971144   -0.00109899
C    2.32546796   -0.03633751    0.03169796    0.00019342    0.00999045    0.01270986
H    3.42037565   -0.01412633    0.01989179    0.00527295   -0.00034587    0.00206695
   15
   -420.53235691
H   -2.50191777    0.19102871   -0.06288906   -0.00060881   -0.00698765   -0.00584545
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O   -1.90803782   -1.18454962   -0.09499449    0.00482719    0.00967593    0.00233917
C   -0.82094189    0.80598106    0.02934476   -0.05856626    0.01738678   -0.00359350
C   -0.73995639   -0.70266414   -0.01908604    0.02159725   -0.01596378   -0.00891722
C    0.34210407    1.62314114    0.00792654    0.02877340    0.00747320    0.01137950
C    0.37120468   -1.55347381    0.08921743    0.00534851    0.02916190    0.01843964
C    1.68553933    1.19380640   -0.05129992   -0.01010860   -0.00534266   -0.00224141
C    1.71070419   -1.32024229   -0.02872216   -0.01865863   -0.01039531   -0.01773425
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H    0.05024682   -2.60618298    0.04772947   -0.00266694   -0.00693196   -0.00323727
H    2.39628109    2.00744947   -0.21024389    0.00324526   -0.00254533   -0.00548044
H    2.35858461   -2.21955736   -0.07328884    0.00525281   -0.01311335   -0.00153590
C    2.32543470   -0.03670416    0.03081958   -0.00215889    0.01220737    0.01294903
H    3.42311245   -0.02040736    0.01348513    0.00704357   -0.00096461    0.00171512
   15
   -420.53189899
H   -2.50002418    0.17709670   -0.04309980   -0.00125709   -0.00914171   -0.00438258
O   -2.06501382    1.15128760    0.06936656    0.01506479   -0.01230751    0.00649755
O   -1.90570636   -1.18599353   -0.09543467    0.00593507    0.00854153    0.00175908
C   -0.82358063    0.80724601    0.02910786   -0.05871834    0.01726008   -0.00350243
C   -0.73874344   -0.70065973   -0.02000196    0.02115156   -0.01608273   -0.00951519
C    0.34244233    1.62084141    0.00893768    0.02862590    0.00844468    0.01158699
C    0.37276514   -1.55074356    0.09043800    0.00850854    0.02908996    0.01872955
C    1.68617790    1.19263120   -0.05188496   -0.01133423   -0.00669045   -0.00300002
C    1.70976439   -1.32078442   -0.02751221   -0.02193277   -0.00925240   -0.01664800
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H    0.04884133   -2.60103255    0.04415223   -0.00261379   -0.00600204   -0.00350139
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   15
   -420.53162114
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   15
   -420.53156203
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   15
   -420.53165180
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   15
   -420.53183079
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   15
   -420.53201036
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   15
   -420.53214989
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O   -1.89344791   -1.19623012   -0.09819370    0.00868462    0.00194027   -0.00296085
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   15
   -420.53227211
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O   -1.89174248   -1.19808124   -0.09858887    0.00824806    0.00112004   -0.00361620
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   15
   -420.53243141
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O   -1.89013040   -1.19994519   -0.09894313    0.00758297    0.00043538   -0.00414317
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   15
   -420.53269904
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   15
   -420.53312166
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C   -0.74135802   -0.67107007   -0.02053960    0.01135594    0.01043540   -0.00905836
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   15
   -420.53363195
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   15
   -420.53413187
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O   -1.88444200   -1.20740125   -0.09985748    0.00412161   -0.00079808   -0.00479426
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C    0.32281224    1.58551373    0.00754769   -0.00975411   -0.01812179    0.00834336
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C    1.71728370   -1.31212813    0.00207637    0.01026645   -0.00234919   -0.00270138
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   15
   -420.53448271
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   15
   -420.53452877
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   15
   -420.53435599
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   15
   -420.53408096
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C    0.31591106    1.57755702    0.00243111   -0.02129489   -0.02057624    0.00283409
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   15
   -420.53397741
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   15
   -420.53425946
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C    0.31422780    1.57544415   -0.00047288   -0.02373070   -0.01580940   -0.00035478
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C    2.33020956   -0.05882119   -0.02231234   -0.01650389   -0.03281787    0.00692567
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   15
   -420.53491826
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O   -1.87651777   -1.22019462   -0.09945427    0.01117931    0.00114238   -0.00411502
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C    0.31391634    1.57476608   -0.00192894   -0.02380142   -0.01258853   -0.00194679
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C    1.71925255   -1.30288537    0.02401444    0.00432891    0.02683879    0.00740236
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C    2.33148285   -0.05759573   -0.02670026   -0.01499638   -0.03192411    0.00572689
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   15
   -420.53565765
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C   -0.76233657   -0.65754503   -0.00862709    0.00045793    0.03807933    0.00061064
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C    2.33298138   -0.05588881   -0.03117458   -0.01226676   -0.03003400    0.00438178
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   15
   -420.53628648
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C   -0.76498696   -0.65895505   -0.00722746   -0.00261016    0.03787914    0.00166410
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   15
   -420.53648678
H   -2.65473507    0.37465633    0.17377367   -0.01325054   -0.00463767    0.00834786
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O   -1.87463758   -1.22578443   -0.09856651    0.02059556    0.00440983   -0.00410741
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C   -0.76759794   -0.66093704   -0.00585299   -0.00562483    0.03706735    0.00271171
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   15
   -420.53639694
H   -2.67850181    0.38170541    0.16826815   -0.02090016   -0.01059754    0.00891926
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O   -1.87442902   -1.22772958   -0.09817725    0.02376529    0.00576334   -0.00406494
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H    3.42014305   -0.02974856   -0.11225840   -0.00273431    0.00022554   -0.00230491
   15
   -420.53614971
H   -2.69853313    0.39063182    0.16116355   -0.02667706   -0.01447305    0.00902069
O   -2.09282943    1.21164731    0.04837766   -0.01659691   -0.00247767   -0.00720475
O   -1.87448980   -1.22974015   -0.09774193    0.02670256    0.00714674   -0.00400428
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C   -0.77252348   -0.66655951   -0.00324277   -0.01084298    0.03378150    0.00477928
C    0.31730806    1.57329843   -0.00829370   -0.01115401   -0.00027695   -0.00979138
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C    1.71145896    1.18261212   -0.02703054    0.01234155   -0.01302645   -0.00366084
C    1.71815581   -1.30621309    0.03682778    0.00745452   -0.00474908    0.01050576
H    0.12894043    2.63368929    0.08934261   -0.00054618   -0.00540987    0.00393380
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H    2.35328212    2.06084082    0.04796912   -0.00309859    0.00277054    0.00530340
H    2.39919941   -2.14218126   -0.00639339   -0.00023558    0.00872267   -0.00378720
C    2.34020904   -0.04499409   -0.04950535    0.00520526   -0.01561200   -0.00185634
H    3.41870427   -0.02674471   -0.11223535   -0.00511661    0.00022560   -0.00198047
   15
   -420.53606244
H   -2.71379358    0.40213098    0.15244171   -0.03021676   -0.01610091    0.00866337
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   15
   -420.53631937
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   15
   -420.53700362
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   15
   -420.53794548
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   15
   -420.53886691
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   15
   -420.53945887
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   15
   -420.53957251
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   15
   -420.53936735
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   15
   -420.53920267
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   15
   -420.53945978
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   15
   -420.54016276
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O   -1.89848702   -1.25949451   -0.09013211    0.02525782    0.00987161   -0.00373677
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C   -0.78647459   -0.72415613    0.00291674   -0.00008842   -0.00186256    0.01341837
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   15
   -420.54102343
H   -2.67494531    0.53814795   -0.00701069    0.00547991    0.01531670    0.00036476
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O   -1.90274069   -1.26297278   -0.08919142    0.02247622    0.00853309   -0.00376447
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C   -0.78703535   -0.73023094    0.00244571    0.00278358   -0.00453460    0.01372118
C    0.32462737    1.56886692   -0.00424071    0.02495407    0.01441255   -0.01707619
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C    1.69789993    1.20298928    0.00365850   -0.00938646   -0.01128768    0.01255397
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H    2.41147767   -2.16003100    0.17465969    0.01125640   -0.01111851    0.00494052
C    2.35042053   -0.00488956   -0.09624616    0.00677364    0.01895226   -0.01770218
H    3.44996977    0.00840082   -0.09687212    0.00869592   -0.00014198    0.00109996
   15
   -420.54170820
H   -2.67548487    0.53037637   -0.02374980   -0.00266176    0.00479331   -0.00103767
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   15
   -420.54194519
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   15
   -420.54180129
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   15
   -420.54147158
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   15
   -420.54108354
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   15
   -420.54083952
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   15
   -420.54077720
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   15
   -420.54086365
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   15
   -420.54097704
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   15
   -420.54087769
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   15
   -420.54040822
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O   -1.95788924   -1.30296254   -0.07629655   -0.01612492   -0.01111419   -0.00139403
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   15
   -420.53958782
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C   -0.80750942   -0.79132127   -0.01866106    0.02205351   -0.01245244    0.00674832
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   15
   -420.53870795
H   -2.54480860    0.59619441   -0.14877813    0.03245365    0.01740868   -0.00001283
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C   -0.81114177   -0.79514973   -0.02144031    0.02066697   -0.01193017    0.00532545
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   15
   -420.53816173
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   15
   -420.53812700
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   15
   -420.53851720
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C   -0.82376477   -0.80558442   -0.03016753    0.01191350   -0.01042582    0.00055181
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C    1.69164638    1.24453866    0.00314631    0.00081715    0.00549035    0.01173576
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   15
   -420.53901779
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O   -1.98266260   -1.32020664   -0.06821273   -0.02201075   -0.01442932    0.00175663
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C    1.69128512    1.24594371    0.00115897    0.00011495    0.00260729    0.01044080
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H    2.39518985   -2.11490979    0.25200392    0.00246045   -0.01349555    0.00993723
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   15
   -420.53929627
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C    0.30030889    1.54165284    0.05691756   -0.03850256   -0.01091173    0.00633928
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C    1.69092210    1.24730911   -0.00098613   -0.00056253   -0.00009742    0.00906504
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   15
   -420.53927006
H   -2.60070623    0.62536803   -0.17223275   -0.00358135   -0.01344901   -0.00917979
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C    1.69056753    1.24867558   -0.00326821   -0.00119668   -0.00248084    0.00762496
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C    2.32427270    0.02033274   -0.09372975   -0.01134029   -0.02046545   -0.01150362
H    3.41740550    0.05069729   -0.13273530    0.00401441    0.00126212    0.00051590
   15
   -420.53899165
H   -2.61749895    0.63063328   -0.17285184   -0.01152090   -0.01849929   -0.01076744
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O   -1.99174563   -1.32668431   -0.06435214   -0.01805860   -0.01334603    0.00348520
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C   -0.84273836   -0.81730877   -0.04179592   -0.00597679   -0.00911483   -0.00620578
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C    1.69023103    1.25007904   -0.00566554   -0.00180668   -0.00443830    0.00615140
C    1.73280180   -1.23928774    0.04257334    0.01406105    0.02056470   -0.00324163
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C    2.32313928    0.02343586   -0.09099849   -0.00883799   -0.01831387   -0.01034044
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   15
   -420.53864693
H   -2.63224911    0.63919395   -0.17154409   -0.01728446   -0.02113915   -0.01155596
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O   -1.99434070   -1.32853325   -0.06313588   -0.01631028   -0.01258215    0.00398448
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C    2.32213880    0.02681513   -0.08811085   -0.00580050   -0.01553825   -0.00921473
H    3.40635239    0.05042518   -0.14227425   -0.00155659    0.00060284    0.00013742
   15
   -420.53837898
H   -2.64392296    0.65152526   -0.16816752   -0.02058613   -0.02138426   -0.01153815
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C    1.68964926    1.25310813   -0.01071677   -0.00307243   -0.00698587    0.00319758
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   15
   -420.53826288
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C    0.39707994   -1.62068990    0.03866140    0.01071196   -0.01700529    0.00245695
C    1.68942324    1.25477241   -0.01332606   -0.00382970   -0.00768339    0.00176631
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   15
   -420.53830656
H   -2.65615957    0.68725162   -0.15535753   -0.01893996   -0.01477934   -0.00924422
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C    1.68925531    1.25655258   -0.01596212   -0.00473545   -0.00815545    0.00039614
C    1.72567116   -1.23606274    0.04190978    0.01360370   -0.00367121    0.00172700
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H    2.45050657   -2.02372207    0.16627283   -0.00196837    0.00993244    0.00234965
C    2.31948141    0.03815661   -0.07867834    0.00206312   -0.00480140   -0.00589612
H    3.39299444    0.04935622   -0.15671131   -0.00809954   -0.00039280   -0.00032405
   15
   -420.53830392
H   -2.65702384    0.70945914   -0.14633570   -0.01365576   -0.00803489   -0.00709391
O   -1.92568120    1.37162001    0.03621032    0.01219884    0.02990570    0.00834549
O   -2.00307304   -1.33461126   -0.05877001   -0.00947850   -0.00853774    0.00546321
C   -0.74164193    0.68808079    0.01240382    0.02651681    0.00540276   -0.00143246
C   -0.86403171   -0.82887022   -0.05406641   -0.02434869   -0.00818252   -0.01349193
C    0.32511525    1.54311534    0.07991576    0.00525603    0.00382473    0.01431487
C    0.39604694   -1.62227963    0.04047159    0.01198261   -0.01374809    0.00295860
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   15
   -420.53805595
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   15
   -420.53734138
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   15
   -420.53622108
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C    1.68948690    1.26498060   -0.02637902   -0.01051942   -0.01092696   -0.00418783
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   15
   -420.53502205
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   15
   -420.53417075
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   15
   -420.53384388
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O   -2.01313228   -1.34099622   -0.05411068   -0.00449203   -0.00454367    0.00644019
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C    1.69125483    1.27301712   -0.03359444   -0.01579073   -0.01511808   -0.00655977
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C    2.31289722    0.06439856   -0.05448037   -0.00870318    0.02011220    0.00365781
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   15
   -420.53390142
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C    2.31219324    0.06731425   -0.05107236   -0.01040803    0.02223837    0.00495128
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   15
   -420.53397200
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   15
   -420.53389380
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C    2.31126707    0.07211694   -0.04449815   -0.01118007    0.02449096    0.00713442
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   15
   -420.53368964
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O   -2.01866642   -1.34410171   -0.05243710   -0.00639581   -0.00535892    0.00630136
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C    2.31105644    0.07397001   -0.04136492   -0.01014758    0.02452030    0.00799454
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   15
   -420.53353882
H   -2.72604054    0.81141506   -0.02870109   -0.03048677   -0.00329302   -0.00150250
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O   -2.01988956   -1.34473616   -0.05219959   -0.00755141   -0.00592261    0.00614541
C   -0.74389933    0.64128868    0.01181002   -0.00508041   -0.02422880   -0.00049208
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C    1.69824478   -1.21673893    0.03505633   -0.01277203   -0.00341048    0.00803678
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C    2.31099822    0.07545323   -0.03835237   -0.00828101    0.02381612    0.00870000
H    3.39478571    0.05963933   -0.18958097    0.00377301   -0.00023642   -0.00422840
   15
   -420.53362608
H   -2.72783636    0.80820593   -0.01762607   -0.03342819   -0.00518500   -0.00101122
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O   -2.02102684   -1.34530334   -0.05203175   -0.00892798   -0.00656971    0.00593793
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C   -0.87588854   -0.84553216   -0.06005119   -0.01742949   -0.00198990   -0.01873442
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C    0.37300685   -1.62698550    0.04760974    0.00570177   -0.00850626    0.00367732
C    1.70135375    1.29527062   -0.04514441   -0.01357167   -0.00948988   -0.00944724
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   15
   -420.53399214
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   15
   -420.53457051
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   15
   -420.53512880
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O   -2.02375938   -1.34652441   -0.05191972   -0.01378512   -0.00878966    0.00500381
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C    1.70935868    1.30866245   -0.04908041   -0.00403760    0.00521421   -0.01044063
C    1.69397606   -1.20705639    0.02946031    0.00748477   -0.00316636    0.00686312
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   15
   -420.53537754
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O   -2.02438268   -1.34674341   -0.05200110   -0.01541685   -0.00950911    0.00459055
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C    1.69283434   -1.20451505    0.02778482    0.01255346   -0.00250008    0.00623578
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   15
   -420.53516013
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C    0.33491570    1.52150882    0.09248351   -0.00315933   -0.00003437    0.00729230
C    0.35779005   -1.62660663    0.04844055   -0.00666764   -0.01853147    0.00369074
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   15
   -420.53448462
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O   -2.02508814   -1.34685039   -0.05231472   -0.01818735   -0.01078241    0.00362118
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   15
   -420.53364671
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O   -2.02513903   -1.34672394   -0.05253597   -0.01915189   -0.01130422    0.00306798
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C    0.33046982    1.51550477    0.09059979   -0.01457088   -0.01087424    0.00435194
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C    2.31208951    0.07711152   -0.01962150   -0.00038446    0.00207178    0.01287808
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   15
   -420.53302131
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C   -0.74254139    0.63117709    0.01201636   -0.01462269   -0.01854856    0.00090289
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C    0.32853433    1.51270884    0.08954796   -0.02001758   -0.01531993    0.00287960
C    0.34955170   -1.62324919    0.04826452   -0.01059065   -0.00918837    0.00305870
C    1.72315924    1.32827752   -0.05245698    0.01249379    0.02948198   -0.01080814
C    1.68586564   -1.19429344    0.02023180    0.02074476    0.00970446    0.00404637
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C    2.31215879    0.07667801   -0.01806624   -0.00344137   -0.00073042    0.01347837
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   15
   -420.53275426
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O   -2.02458353   -1.34608169   -0.05307603   -0.01988528   -0.01208263    0.00183975
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C    0.32690109    1.51014337    0.08845249   -0.02512830   -0.01879204    0.00148610
C    0.34710414   -1.62177887    0.04810903   -0.01124227   -0.00530958    0.00289624
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C    1.68336813   -1.19195484    0.01817217    0.01956138    0.01456645    0.00365322
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C    2.31228049    0.07625503   -0.01671464   -0.00683869   -0.00310730    0.01398611
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   15
   -420.53273193
H   -2.59614677    0.73955348    0.09066643    0.01749709    0.01473416    0.00156774
O   -1.86030556    1.35028101   -0.00505398    0.01774937    0.00086013   -0.00330330
O   -2.02396888   -1.34555704   -0.05338092   -0.01957513   -0.01232906    0.00117260
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C   -0.85913107   -0.85314293   -0.03581319    0.01794658   -0.01112070   -0.00864364
C    0.32564723    1.50786067    0.08733437   -0.02976534   -0.02113746    0.00023834
C    0.34482622   -1.62022776    0.04790966   -0.01163679   -0.00180688    0.00279677
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C    1.68057591   -1.18983631    0.01605734    0.01752386    0.01928484    0.00324947
H    0.05450144    2.56164148    0.26459314    0.00583743    0.00969593    0.00693977
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C    2.31250532    0.07587843   -0.01557438   -0.01008178   -0.00496776    0.01435143
H    3.39703650    0.06532347   -0.14312747    0.00158220    0.00386124   -0.00287179
   15
   -420.53260895
H   -2.59530278    0.71647404    0.10072769    0.00782918    0.00553503    0.00323391
O   -1.85969332    1.34898733   -0.00678235    0.02841868    0.01056643   -0.00513724
O   -2.02313262   -1.34489264   -0.05369908   -0.01879918   -0.01246998    0.00048045
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C    0.32484263    1.50589613    0.08621244   -0.03375233   -0.02230643   -0.00082351
C    0.34272402   -1.61864851    0.04766790   -0.01184595    0.00102502    0.00276470
C    1.72960294    1.33532732   -0.05253265    0.01578179    0.03330253   -0.00958607
C    1.67751939   -1.18800857    0.01389342    0.01494290    0.02335581    0.00279951
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H    3.40225198    0.06246875   -0.13593871    0.00432206    0.00377682   -0.00284854
   15
   -420.53228213
H   -2.59587258    0.69239806    0.11020302   -0.00158411   -0.00370979    0.00513613
O   -1.85940267    1.34757372   -0.00845225    0.03827411    0.02034012   -0.00718652
O   -2.02208350   -1.34408686   -0.05402268   -0.01758515   -0.01250556   -0.00022500
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C   -0.85758244   -0.85335005   -0.02878763    0.01930281   -0.01469929   -0.00572197
C    0.32454737    1.50426745    0.08510269   -0.03692608   -0.02232355   -0.00166604
C    0.34080079   -1.61708369    0.04738424   -0.01191081    0.00295970    0.00280255
C    1.73128685    1.33668237   -0.05225820    0.01564800    0.03271014   -0.00897442
C    1.67423726   -1.18653260    0.01168727    0.01208766    0.02633374    0.00226293
H    0.05154350    2.54690710    0.28706016    0.00625316    0.00537063    0.00785467
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   15
   -420.53176404
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O   -2.02083528   -1.34313935   -0.05434371   -0.01597242   -0.01241804   -0.00093507
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C   -0.85724230   -0.85313379   -0.02513397    0.01885233   -0.01642435   -0.00424143
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C    1.67077243   -1.18545309    0.00944705    0.00915657    0.02792528    0.00161038
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   15
   -420.53131536
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O   -1.86020193    1.34396297   -0.01152579    0.05034244    0.03516838   -0.01076362
O   -2.01940617   -1.34205112   -0.05465416   -0.01403302   -0.01219142   -0.00162622
C   -0.73290165    0.63749270    0.01166015   -0.00405360   -0.00480360    0.00205213
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C    0.33749312   -1.61409868    0.04668830   -0.01169646    0.00377784    0.00303608
C    1.73395535    1.33792902   -0.05131227    0.01413559    0.02989897   -0.00765779
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C    2.31525727    0.07526297   -0.01319175   -0.01476875   -0.00648167    0.01379951
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   15
   -420.53117352
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C   -0.73088664    0.63899632    0.01150445   -0.00193056   -0.00300727    0.00206842
C   -0.85739781   -0.85193268   -0.01765654    0.01599186   -0.01943239   -0.00129981
C    0.32711835    1.50133047    0.08195724   -0.03990978   -0.01750038   -0.00297650
C    0.33610554   -1.61269090    0.04627251   -0.01146599    0.00274727    0.00320439
C    1.73496250    1.33786260   -0.05066062    0.01298414    0.02811213   -0.00702609
C    1.66347062   -1.18455572    0.00490566    0.00354376    0.02643268   -0.00004245
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C    2.31649719    0.07536042   -0.01313023   -0.01298550   -0.00549002    0.01317879
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   15
   -420.53146061
H   -2.58436437    0.61498785    0.13591884   -0.01619924   -0.02301636    0.01009733
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O   -2.01609594   -1.33946471   -0.05521233   -0.00945874   -0.01125753   -0.00289694
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C   -0.85785052   -0.85090250   -0.01387721    0.01377057   -0.02060302    0.00014163
C    0.32917748    1.50092089    0.08099217   -0.03825053   -0.01537501   -0.00320164
C    0.33489124   -1.61132369    0.04580824   -0.01115530    0.00097952    0.00338506
C    1.73577351    1.33737114   -0.04990266    0.01168072    0.02630321   -0.00645504
C    1.65971827   -1.18471530    0.00262944    0.00101428    0.02337762   -0.00100664
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C    2.31793209    0.07554040   -0.01326779   -0.01005879   -0.00406281    0.01241302
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   15
   -420.53222306
H   -2.57475895    0.60469863    0.13818481   -0.01353779   -0.02243666    0.01008741
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O   -2.01426657   -1.33797708   -0.05544566   -0.00696321   -0.01056802   -0.00345338
C   -0.72679487    0.64211892    0.01110054    0.00126113   -0.00040583    0.00185443
C   -0.85851095   -0.84956118   -0.01009999    0.01113359   -0.02147510    0.00155377
C    0.33181324    1.50074422    0.08007551   -0.03511951   -0.01362570   -0.00345190
C    0.33384547   -1.60997083    0.04529280   -0.01072939   -0.00116877    0.00355814
C    1.73640798    1.33648187   -0.04904700    0.01028942    0.02458431   -0.00596223
C    1.65595038   -1.18522679    0.00036850   -0.00133311    0.01901440   -0.00202410
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C    2.31951801    0.07578167   -0.01359298   -0.00621494   -0.00235915    0.01156301
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   15
   -420.53321363
H   -2.56274849    0.59841588    0.13864278   -0.00859065   -0.01962620    0.00951357
O   -1.86855034    1.33179101   -0.01614458    0.04119466    0.03741771   -0.01230195
O   -2.01235825   -1.33636969   -0.05563988   -0.00442159   -0.00975007   -0.00393789
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C   -0.85933935   -0.84789559   -0.00634622    0.00819529   -0.02200098    0.00293357
C    0.33497821    1.50077439    0.07921115   -0.03051585   -0.01255041   -0.00380307
C    0.33296171   -1.60860033    0.04472357   -0.01013652   -0.00329094    0.00371034
C    1.73688697    1.33522068   -0.04810109    0.00882578    0.02302975   -0.00555839
C    1.65220248   -1.18602451   -0.00186181   -0.00354312    0.01361273   -0.00305961
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H    2.36171002    2.23119857   -0.15660261    0.00407817    0.00632725   -0.00549634
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C    2.32119715    0.07605828   -0.01409292   -0.00175823   -0.00039087    0.01065212
H    3.40745440    0.02641486   -0.07437509    0.00067700    0.00102394    0.00035239
   15
   -420.53420678
H   -2.54922114    0.59563236    0.13739658   -0.00154703   -0.01450101    0.00835242
O   -1.87193677    1.32764060   -0.01694698    0.03294914    0.03186270   -0.01126080
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C   -0.72277141    0.64527335    0.01058624    0.00292125    0.00076220    0.00128778
C   -0.86029140   -0.84589780   -0.00263674    0.00504127   -0.02215646    0.00426905
C    0.33860289    1.50099527    0.07840443   -0.02453479   -0.01225780   -0.00427034
C    0.33223095   -1.60718071    0.04409829   -0.00931939   -0.00488824    0.00383520
C    1.73723258    1.33361107   -0.04707105    0.00731295    0.02164851   -0.00523793
C    1.64850811   -1.18702726   -0.00404589   -0.00573494    0.00757516   -0.00406215
H    0.00743669    2.49646788    0.32136507    0.00142911   -0.01127262    0.00815918
H    0.13677808   -2.66662071    0.03584010   -0.00249053    0.00836943   -0.00033175
H    2.35392930    2.23321580   -0.15375758    0.00246463    0.00584644   -0.00542164
H    2.29991199   -2.05959709   -0.04530312   -0.00728614   -0.00434610   -0.00166248
C    2.32290265    0.07634059   -0.01475388    0.00286480    0.00174401    0.00972791
H    3.40491929    0.01982992   -0.06498739   -0.00217261    0.00051574    0.00093439
   15
   -420.53490648
H   -2.53543988    0.59542790    0.13465443    0.00717608   -0.00720549    0.00667068
O   -1.87569521    1.32313095   -0.01762214    0.02281232    0.02394627   -0.00967965
O   -2.00842007   -1.33283356   -0.05588970    0.00064662   -0.00789414   -0.00472096
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C   -0.86131949   -0.84356548    0.00100825    0.00174811   -0.02192941    0.00555149
C    0.34259711    1.50140238    0.07766236   -0.01738674   -0.01269006   -0.00482054
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C    1.73746769    1.33167401   -0.04596173    0.00575335    0.02038387   -0.00499426
C    1.64490068   -1.18814441   -0.00616864   -0.00810264    0.00140676   -0.00499393
H   -0.00171422    2.49558125    0.32058634   -0.00077467   -0.01003203    0.00866666
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H    2.34570931    2.23418702   -0.14993791    0.00054071    0.00490734   -0.00525349
H    2.30085376   -2.05047274   -0.03848825   -0.00858975   -0.00056058   -0.00097924
C    2.32456512    0.07659634   -0.01556193    0.00719948    0.00399558    0.00881901
H    3.40277094    0.01315282   -0.05576703   -0.00471983   -0.00001939    0.00144981
   15
   -420.53514769
H   -2.52296209    0.59649813    0.13071570    0.01669562    0.00159131    0.00469435
O   -1.87971139    1.31835124   -0.01818783    0.01156058    0.01433200   -0.00773423
O   -2.00644764   -1.33092580   -0.05593641    0.00310915   -0.00695508   -0.00503572
C   -0.71892076    0.64838828    0.00999589    0.00385129    0.00062244    0.00034897
C   -0.86237391   -0.84090207    0.00456937   -0.00162739   -0.02130591    0.00677873
C    0.34685318    1.50200199    0.07699321   -0.00939200   -0.01364020   -0.00539173
C    0.33117445   -1.60411457    0.04267227   -0.00680498   -0.00479612    0.00402853
C    1.73761590    1.32942872   -0.04477679    0.00415286    0.01913594   -0.00481810
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H    2.33739520    2.23427907   -0.14517321   -0.00157060    0.00364387   -0.00501289
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C    2.32611967    0.07679154   -0.01650336    0.01076785    0.00633785    0.00794357
H    3.40146208    0.00647966   -0.04680660   -0.00656934   -0.00058582    0.00188395
   15
   -420.53502848
H   -2.51347979    0.59727762    0.12593157    0.02550993    0.01054572    0.00276875
O   -1.88385894    1.31340918   -0.01866581    0.00059378    0.00447967   -0.00577523
O   -2.00451039   -1.32893903   -0.05592603    0.00548345   -0.00610910   -0.00531285
C   -0.71707951    0.64993046    0.00968907    0.00450153    0.00019504   -0.00025910
C   -0.86340369   -0.83791701    0.00802808   -0.00502767   -0.02028278    0.00794267
C    0.35125072    1.50280813    0.07640548   -0.00094096   -0.01479854   -0.00587079
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C    1.73770140    1.32689426   -0.04351895    0.00249287    0.01775771   -0.00468291
C    1.63809660   -1.19035732   -0.01017530   -0.01423397   -0.00921409   -0.00655680
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H    2.32936453    2.23371688   -0.13950675   -0.00372033    0.00225163   -0.00471896
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C    2.32751280    0.07689081   -0.01756493    0.01320236    0.00874650    0.00710345
H    3.40132140   -0.00008813   -0.03818470   -0.00742269   -0.00117415    0.00225430
   15
   -420.53480072
H   -2.50855167    0.59618704    0.12064222    0.03167350    0.01751702    0.00134184
O   -1.88801519    1.30841464   -0.01907787   -0.00820101   -0.00355390   -0.00424798
O   -2.00263524   -1.32688283   -0.05585541    0.00774299   -0.00538753   -0.00556298
C   -0.71530679    0.65146988    0.00938627    0.00551911   -0.00036836   -0.00095108
C   -0.86435746   -0.83462580    0.01136678   -0.00842305   -0.01886146    0.00904139
C    0.35566254    1.50383790    0.07590627    0.00751103   -0.01584539   -0.00615015
C    0.33052361   -1.60078538    0.04100263   -0.00314918    0.00054043    0.00421348
C    1.73774931    1.32409167   -0.04219027    0.00077222    0.01608309   -0.00457491
C    1.63499313   -1.19129362   -0.01203559   -0.01836287   -0.01276776   -0.00718098
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H    2.32200162    2.23274818   -0.13299087   -0.00573946    0.00094379   -0.00440300
H    2.31341597   -2.02481125   -0.01741921   -0.00894058    0.00728001    0.00071992
C    2.32870794    0.07685779   -0.01873394    0.01429139    0.01119533    0.00628701
H    3.40250033   -0.00644391   -0.02996796   -0.00712868   -0.00180744    0.00257567
   15
   -420.53479222
H   -2.50926077    0.59200178    0.11509767    0.03340599    0.02048686    0.00083161
O   -1.89208207    1.30345689   -0.01944101   -0.01304884   -0.00775645   -0.00352812
O   -2.00084779   -1.32476537   -0.05572170    0.00984651   -0.00483936   -0.00580039
C   -0.71361809    0.65301493    0.00909794    0.00701555   -0.00098741   -0.00171911
C   -0.86518395   -0.83104988    0.01456885   -0.01175729   -0.01705191    0.01007220
C    0.35996133    1.50510684    0.07549974    0.01554575   -0.01652889   -0.00616296
C    0.33028405   -1.59911001    0.04007296   -0.00111977    0.00459829    0.00431110
C    1.73778561    1.32104645   -0.04079238   -0.00100001    0.01395315   -0.00449416
C    1.63216813   -1.19203871   -0.01378742   -0.02319661   -0.01482673   -0.00772342
H   -0.03244739    2.50602208    0.30087784   -0.01033222   -0.00076360    0.01039761
H    0.15883373   -2.66661921    0.00903113    0.00102691    0.00482754   -0.00169296
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H    2.32091386   -2.01838782   -0.01052820   -0.00721675    0.00775682    0.00120501
C    2.32968862    0.07665548   -0.01999801    0.01403820    0.01365570    0.00547793
H    3.40494689   -0.01247380   -0.02221449   -0.00574111   -0.00247984    0.00286728
   15
   -420.53520922
H   -2.51590861    0.58420007    0.10938896    0.02999805    0.01856912    0.00130425
O   -1.89600526    1.29858274   -0.01976329   -0.01320058   -0.00721515   -0.00371311
O   -1.99917185   -1.32259282   -0.05552220    0.01173455   -0.00450156   -0.00602881
C   -0.71203608    0.65457491    0.00883566    0.00900967   -0.00160928   -0.00253740
C   -0.86583287   -0.82721662    0.01761873   -0.01493591   -0.01486110    0.01103104
C    0.36402603    1.50662500    0.07518598    0.02277977   -0.01664491   -0.00585069
C    0.33006148   -1.59750449    0.03907812    0.00084312    0.00891366    0.00440428
C    1.73783706    1.31779093   -0.03932652   -0.00280644    0.01126541   -0.00443163
C    1.62969446   -1.19256141   -0.01542252   -0.02851883   -0.01543139   -0.00820945
H   -0.03650776    2.51003623    0.29141013   -0.01201977    0.00089368    0.01030793
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H    2.31067409    2.23046990   -0.11763878   -0.00879267   -0.00062938   -0.00378071
H    2.32969794   -2.01334539   -0.00385406   -0.00459800    0.00717126    0.00168488
C    2.33045845    0.07624678   -0.02134490    0.01263822    0.01605427    0.00466167
H    3.40841442   -0.01805690   -0.01497710   -0.00348929   -0.00316980    0.00315184
   15
   -420.53586402
H   -2.52789309    0.57311548    0.10343492    0.02221671    0.01253499    0.00248490
O   -1.89978240    1.29378681   -0.02004285   -0.00932713   -0.00270156   -0.00454058
O   -1.99762877   -1.32036902   -0.05525431    0.01334543   -0.00437446   -0.00625206
C   -0.71059084    0.65615919    0.00861178    0.01143649   -0.00221135   -0.00338141
C   -0.86625626   -0.82315907    0.02050192   -0.01784961   -0.01232199    0.01191128
C    0.36774764    1.50839398    0.07496025    0.02890103   -0.01607451   -0.00519264
C    0.32982648   -1.59603345    0.03801669    0.00253580    0.01294077    0.00447816
C    1.73793088    1.31436575   -0.03779363   -0.00460435    0.00798940   -0.00439573
C    1.62765206   -1.19285227   -0.01693356   -0.03392668   -0.01479721   -0.00865302
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H    0.16704860   -2.67531733    0.00006271    0.00169415   -0.00246578   -0.00238287
H    2.30725616    2.22943974   -0.10891416   -0.00960462   -0.00059601   -0.00349021
H    2.33930059   -2.00958311    0.00251659   -0.00134578    0.00580128    0.00217409
C    2.33103820    0.07559550   -0.02276225    0.01043161    0.01831097    0.00383198
H    3.41250263   -0.02306961   -0.00830719   -0.00073318   -0.00383809    0.00343906
   15
   -420.53642412
H   -2.54384087    0.55980526    0.09702997    0.01191870    0.00434584    0.00389515
O   -1.90345586    1.28901967   -0.02027075   -0.00312096    0.00385927   -0.00556255
O   -1.99623672   -1.31809542   -0.05491551    0.01458032   -0.00445816   -0.00646449
C   -0.70931886    0.65777688    0.00843902    0.01414664   -0.00279703   -0.00421722
C   -0.86641027   -0.81891558    0.02320511   -0.02034631   -0.00946221    0.01270999
C    0.37103392    1.51040509    0.07481263    0.03368606   -0.01477261   -0.00420570
C    0.32955361   -1.59475710    0.03688760    0.00380108    0.01616694    0.00451157
C    1.73809419    1.31082031   -0.03619422   -0.00631590    0.00422230   -0.00440519
C    1.62612208   -1.19292054   -0.01831380   -0.03892900   -0.01323576   -0.00905937
H   -0.03796036    2.51744758    0.26698829   -0.01364303    0.00193711    0.00926085
H    0.17072813   -2.67933421   -0.00380936    0.00203639   -0.00565297   -0.00270098
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H    2.34914122   -2.00685982    0.00849577    0.00217845    0.00401255    0.00266895
C    2.33146075    0.07466774   -0.02423753    0.00781967    0.02028022    0.00299001
H    3.41672089   -0.02739143   -0.00225645    0.00213081   -0.00444608    0.00372988
   15
   -420.53669806
H   -2.56192749    0.54571284    0.08992633    0.00112214   -0.00389703    0.00511850
O   -1.90709434    1.28420878   -0.02043577    0.00355845    0.01042608   -0.00636808
O   -1.99500966   -1.31577106   -0.05450339    0.01537069   -0.00474538   -0.00665057
C   -0.70826088    0.65943686    0.00832997    0.01694989   -0.00338746   -0.00501768
C   -0.86625735   -0.81452937    0.02571624   -0.02228470   -0.00631700    0.01342456
C    0.37381266    1.51263870    0.07472824    0.03701374   -0.01276166   -0.00292601
C    0.32922393   -1.59372381    0.03569035    0.00446906    0.01824405    0.00449711
C    1.73835276    1.30721144   -0.03452813   -0.00784593    0.00013199   -0.00448084
C    1.62517957   -1.19278940   -0.01955713   -0.04302952   -0.01109139   -0.00941822
H   -0.03506138    2.52065815    0.25222208   -0.01350627    0.00124641    0.00834762
H    0.17403927   -2.68234448   -0.00719607    0.00244833   -0.00804731   -0.00296240
H    2.30563721    2.22756645   -0.08963267   -0.00967800    0.00115735   -0.00289588
H    2.35859151   -2.00485861    0.01399458    0.00556906    0.00218115    0.00315754
C    2.33176507    0.07343387   -0.02575803    0.00520168    0.02182546    0.00214913
H    3.42055963   -0.03091421    0.00312308    0.00471237   -0.00493342    0.00400426
   15
   -420.53669451
H   -2.58023257    0.53230280    0.08190706   -0.00859009   -0.01080370    0.00587946
O   -1.91077233    1.27928102   -0.02052894    0.00933348    0.01551710   -0.00676432
O   -1.99395647   -1.31339274   -0.05401585    0.01564206   -0.00519799   -0.00682052
C   -0.70745906    0.66114810    0.00829672    0.01965156   -0.00400658   -0.00576060
C   -0.86576833   -0.81004797    0.02802450   -0.02354670   -0.00292027    0.01405554
C    0.37603359    1.51506450    0.07468781    0.03885140   -0.01014172   -0.00141362
C    0.32882757   -1.59296463    0.03442519    0.00441272    0.01889916    0.00441863
C    1.73872961    1.30360066   -0.03279419   -0.00908276   -0.00401892   -0.00464300
C    1.62488605   -1.19249093   -0.02065813   -0.04580199   -0.00862811   -0.00970994
H   -0.02973975    2.52365488    0.23595553   -0.01276808   -0.00016566    0.00725338
H    0.17690949   -2.68392192   -0.01005113    0.00288985   -0.00937125   -0.00313564
H    2.30745064    2.22641047   -0.07918331   -0.00905688    0.00263955   -0.00255089
H    2.36704621   -2.00325436    0.01892554    0.00848777    0.00063499    0.00360926
C    2.33199030    0.07187065   -0.02731104    0.00292149    0.02282360    0.00132114
H    3.42355890   -0.03355125    0.00778132    0.00668169   -0.00527105    0.00425369
   15
   -420.53661879
H   -2.59702003    0.52080723    0.07283598   -0.01635035   -0.01560527    0.00612228
O   -1.91455469    1.27417923   -0.02054583    0.01347752    0.01847798   -0.00669047
O   -1.99308019   -1.31095536   -0.05345097    0.01535204   -0.00579588   -0.00696019
C   -0.70695398    0.66291994    0.00835047    0.02205848   -0.00466280   -0.00642774
C   -0.86492418   -0.80552264    0.03012034   -0.02406619    0.00066857    0.01460145
C    0.37766878    1.51764302    0.07466856    0.03927665   -0.00706642    0.00025327
C    0.32836549   -1.59248939    0.03309328    0.00357230    0.01804452    0.00427611
C    1.73924327    1.30005038   -0.03098993   -0.00990824   -0.00793869   -0.00490297
C    1.62528304   -1.19206218   -0.02161243   -0.04692345   -0.00604563   -0.00991292
H   -0.02212878    2.52668895    0.21838484   -0.01147556   -0.00211808    0.00604155
H    0.17925944   -2.68382824   -0.01234232    0.00338692   -0.00956234   -0.00324536
H    2.31088948    2.22477743   -0.06827463   -0.00812582    0.00425469   -0.00217020
H    2.37398299   -2.00177199    0.02320744    0.01068872   -0.00039483    0.00400253
C    2.33217065    0.06996313   -0.02888409    0.00122521    0.02315840    0.00052781
H    3.42536727   -0.03524218    0.01167333    0.00781796   -0.00540891    0.00446139
   15
   -420.53674232
H   -2.61090074    0.51209143    0.06266949   -0.02172746   -0.01816292    0.00590343
O   -1.91848821    1.26887007   -0.02048720    0.01572379    0.01912269   -0.00619629
O   -1.99237751   -1.30845225   -0.05280716    0.01448096   -0.00650487   -0.00706596
C   -0.70678189    0.66476233    0.00850129    0.02403175   -0.00535955   -0.00700306
C   -0.86371710   -0.80100758    0.03199554   -0.02381093    0.00438976    0.01505808
C    0.37871170    1.52032817    0.07464536    0.03842688   -0.00382383    0.00199956
C    0.32785032   -1.59228512    0.03169681    0.00197924    0.01566247    0.00406035
C    1.73990607    1.29661943   -0.02911140   -0.01023764   -0.01132313   -0.00526324
C    1.62638731   -1.19154198   -0.02241700   -0.04623851   -0.00350198   -0.01000154
H   -0.01245704    2.53010839    0.19972694   -0.00979844   -0.00434436    0.00480830
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H    2.37900898   -2.00022796    0.02676996    0.01196694   -0.00077245    0.00431255
C    2.33233157    0.06770639   -0.03046518    0.00026522    0.02274190   -0.00021915
H    3.42578224   -0.03596241    0.01476261    0.00799266   -0.00533640    0.00461352
   15
   -420.53726010
H   -2.62090645    0.50661391    0.05144612   -0.02457796   -0.01852924    0.00529142
O   -1.92259831    1.26334604   -0.02035858    0.01602027    0.01752208   -0.00538768
O   -1.99183858   -1.30587528   -0.05208324    0.01304952   -0.00728997   -0.00713751
C   -0.70697251    0.66668578    0.00875788    0.02546691   -0.00608650   -0.00747868
C   -0.86215091   -0.79655895    0.03364316   -0.02280664    0.00816606    0.01542630
C    0.37917487    1.52307135    0.07459196    0.03654282   -0.00075288    0.00372844
C    0.32730607   -1.59231598    0.03023904   -0.00031141    0.01190358    0.00377549
C    1.74072296    1.29335875   -0.02715316   -0.01001363   -0.01393506   -0.00570633
C    1.62818846   -1.19096870   -0.02307050   -0.04371505   -0.00106159   -0.00995930
H   -0.00102514    2.53430863    0.18020329   -0.00788856   -0.00648918    0.00360811
H    0.18202557   -2.67870368   -0.01517085    0.00454753   -0.00651769   -0.00321560
H    2.32195108    2.21894805   -0.04536564   -0.00586825    0.00701422   -0.00123996
H    2.38189489   -1.99855526    0.02955758    0.01226170   -0.00043048    0.00452099
C    2.33248753    0.06510677   -0.03204302    0.00008991    0.02153357   -0.00090828
H    3.42477258   -0.03572496    0.01702241    0.00718463   -0.00505335    0.00468562
   15
   -420.53819941
H   -2.62652395    0.50444002    0.03927380   -0.02483293   -0.01676363    0.00441426
O   -1.92688834    1.25762523   -0.02016902    0.01435032    0.01376049   -0.00436825
O   -1.99144722   -1.30321555   -0.05127838    0.01111166   -0.00811541   -0.00717450
C   -0.70754746    0.66870128    0.00912739    0.02630488   -0.00682191   -0.00784131
C   -0.86024078   -0.79223373    0.03505767   -0.02111249    0.01190039    0.01569980
C    0.37908639    1.52582664    0.07448230    0.03389395    0.00173583    0.00536987
C    0.32676720   -1.59252545    0.02872426   -0.00317759    0.00704134    0.00343009
C    1.74169053    1.29030761   -0.02510857   -0.00920486   -0.01558948   -0.00621329
C    1.63064849   -1.19037914   -0.02357359   -0.03946712    0.00123102   -0.00977529
H    0.01182409    2.53966894    0.16002921   -0.00589792   -0.00813350    0.00249263
H    0.18223375   -2.67421645   -0.01571343    0.00512336   -0.00360289   -0.00308318
H    2.32917073    2.21425949   -0.03353286   -0.00475779    0.00779777   -0.00070628
H    2.38258826   -1.99681469    0.03153282    0.01156014    0.00061350    0.00461772
C    2.33264121    0.06218254   -0.03360721    0.00065096    0.01953048   -0.00153462
H    3.42248316   -0.03458071    0.01843982    0.00545889   -0.00457640    0.00467928
   15
   -420.53942668
H   -2.62770805    0.50525175    0.02630877   -0.02243622   -0.01285170    0.00337974
O   -1.93133933    1.25175024   -0.01993000    0.01066288    0.00785667   -0.00325029
O   -1.99118152   -1.30046376   -0.05039217    0.00875291   -0.00894096   -0.00717582
C   -0.70851939    0.67081991    0.00961532    0.02653813   -0.00753999   -0.00808606
C   -0.85801216   -0.78808826    0.03623493   -0.01883330    0.01548236    0.01587265
C    0.37848606    1.52855686    0.07429160    0.03072234    0.00325890    0.00688290
C    0.32627685   -1.59284049    0.02715767   -0.00643821    0.00148309    0.00303483
C    1.74279661    1.28749090   -0.02296998   -0.00782079   -0.01619403   -0.00675229
C    1.63370341   -1.18980798   -0.02392908   -0.03370410    0.00337959   -0.00944001
H    0.02573666    2.54648086    0.13940482   -0.00402720   -0.00891802    0.00148648
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H    2.33724905    2.20817491   -0.02157329   -0.00377132    0.00802517   -0.00014746
H    2.38121437   -1.99519360    0.03267834    0.00993782    0.00229544    0.00460009
C    2.33278434    0.05896388   -0.03514829    0.00179056    0.01678912   -0.00209806
H    3.41922181   -0.03261545    0.01901587    0.00299426   -0.00393484    0.00459827
   15
   -420.54069266
H   -2.62489042    0.50834629    0.01273554   -0.01742214   -0.00680553    0.00232478
O   -1.93590943    1.24578799   -0.01965408    0.00494821   -0.00014417   -0.00215995
O   -1.99101483   -1.29761060   -0.04942459    0.00609145   -0.00972376   -0.00713888
C   -0.70989186    0.67305250    0.01022536    0.02619351   -0.00821231   -0.00820419
C   -0.85549936   -0.78417652    0.03717233   -0.01608152    0.01878600    0.01593883
C    0.37742160    1.53123932    0.07399700    0.02723277    0.00353414    0.00825983
C    0.32588402   -1.59317775    0.02554525   -0.00986404   -0.00423350    0.00260644
C    1.74402027    1.28491775   -0.02072931   -0.00589235   -0.01574352   -0.00729008
C    1.63726649   -1.18928782   -0.02414202   -0.02675961    0.00544273   -0.00896097
H    0.04037705    2.55488139    0.11851163   -0.00236590   -0.00855705    0.00056307
H    0.17979314   -2.66393114   -0.01516762    0.00604565    0.00334496   -0.00267401
H    2.34600927    2.20065431   -0.00958720   -0.00296266    0.00765437    0.00041501
H    2.37806229   -1.99399272    0.03299719    0.00756134    0.00445612    0.00448144
C    2.33290000    0.05549215   -0.03665771    0.00325139    0.01340399   -0.00261054
H    3.41542813   -0.02994358    0.01876501    0.00006434   -0.00318465    0.00445389
   15
   -420.54167991
H   -2.61897053    0.51263671   -0.00125814   -0.01006287    0.00124152    0.00140200
O   -1.94053398    1.23982910   -0.01935352   -0.00259332   -0.01003224   -0.00122879
O   -1.99091708   -1.29464722   -0.04837607    0.00326303   -0.01043448   -0.00706223
C   -0.71165973    0.67540915    0.01095929    0.02533725   -0.00880092   -0.00819679
C   -0.85274378   -0.78054832    0.03786887   -0.01299950    0.02167916    0.01589218
C    0.37594565    1.53386999    0.07357766    0.02354286    0.00247537    0.00952306
C    0.32564029   -1.59345157    0.02389344   -0.01323389   -0.00948627    0.00215971
C    1.74533244    1.28258146   -0.01837845   -0.00348373   -0.01432224   -0.00779283
C    1.64123327   -1.18885001   -0.02421962   -0.01907200    0.00753959   -0.00835415
H    0.05544724    2.56480459    0.09751622   -0.00097148   -0.00696948   -0.00030862
H    0.17698085   -2.65936924   -0.01415237    0.00626919    0.00640207   -0.00244969
H    2.35530565    2.19176413    0.00232444   -0.00234927    0.00671369    0.00096086
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C    2.33296653    0.05181835   -0.03812771    0.00468308    0.00951939   -0.00308508
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   15
   -420.54216400
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   15
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   15
   -420.54185506
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   15
   -420.54169659
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   15
   -420.54189688
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   15
   -420.54230302
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   15
   -420.54254864
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   15
   -420.54243439
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   15
   -420.54193703
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   15
   -420.54121743
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   15
   -420.54058161
H   -2.60029363    0.37167780   -0.15438476   -0.02077211   -0.01524725   -0.00919362
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   15
   -420.54019064
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C   -0.81610924   -0.76542168    0.02948273    0.00676460    0.00635841    0.00686586
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H    2.33854891   -2.10080737   -0.02060702    0.00132676   -0.01007360    0.00088110
C    2.33332825    0.01303713   -0.05023218   -0.01826949   -0.01789989   -0.00731357
H    3.43301893    0.00934185   -0.04539659    0.00757274    0.00369916    0.00146959
   15
   -420.54009728
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   15
   -420.54031696
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   15
   -420.54064982
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C   -0.80864040   -0.76691808    0.02401987    0.00530986   -0.00678227    0.00318064
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   15
   -420.54093804
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O   -1.98049435   -1.23180897   -0.02345886   -0.00775809    0.00292788    0.00174737
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   15
   -420.54099897
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O   -1.97897295   -1.22741570   -0.02173363   -0.00754609    0.00501053    0.00227774
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   15
   -420.54074166
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C    2.34262992    0.00573137   -0.05078317    0.00637702    0.00054024   -0.00817072
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   15
   -420.54019123
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H    2.33447697   -2.12919217   -0.06820744   -0.00837818    0.00300921   -0.00138239
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   15
   -420.53951863
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O   -1.97390271   -1.21467067   -0.01673255   -0.00695028    0.01101846    0.00347287
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C   -0.79768409   -0.76662687    0.01420186    0.00229825   -0.02392254   -0.00285661
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H    2.33739389   -2.13129359   -0.07434565   -0.00938721    0.00530392   -0.00152701
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   15
   -420.53890308
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C   -0.79563710   -0.76566285    0.01229657    0.00138550   -0.02601887   -0.00396473
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   15
   -420.53850762
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C    2.34810305    0.00143140   -0.04871940    0.01616636    0.01166378   -0.00836394
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   15
   -420.53837129
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C   -0.78180928    0.75637525    0.04483802   -0.03220352    0.00579856    0.00968387
C   -0.79158857   -0.76253296    0.00868152   -0.00099158   -0.02859518   -0.00600447
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C    2.34890737    0.00000829   -0.04788621    0.01543656    0.01341139   -0.00815920
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   15
   -420.53839445
H   -2.45386044    0.26727087   -0.14590114    0.02243124    0.00606954   -0.00483135
O   -2.03732519    1.16986300   -0.02169197   -0.01639004   -0.02137803    0.00137525
O   -1.96607701   -1.19948888   -0.01062776   -0.00458800    0.01640236    0.00453246
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C   -0.78955123   -0.76032819    0.00700258   -0.00235600   -0.02904963   -0.00691374
C    0.34300368    1.60712533    0.00938956    0.01396600    0.00501067   -0.00327688
C    0.37906667   -1.57043744   -0.00765609    0.01795213    0.02083306   -0.00730357
C    1.72676257    1.23356524    0.06932481    0.00750689    0.00024450    0.01070686
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H    2.42382414    2.06249296    0.10921258    0.00083669   -0.00581457    0.00202444
H    2.36521783   -2.15022618   -0.09581852   -0.00441863    0.00322860   -0.00247016
C    2.34947940   -0.00161695   -0.04692978    0.01384633    0.01463956   -0.00785309
H    3.43129889   -0.01795788   -0.14095412   -0.00097538   -0.00234872   -0.00362453
   15
   -420.53840796
H   -2.46240827    0.25489470   -0.13728350    0.01749913    0.00048050   -0.00543836
O   -2.04130578    1.16940555   -0.02243724   -0.01656269   -0.01573021    0.00132675
O   -1.96397007   -1.19612706   -0.00922348   -0.00374516    0.01710355    0.00468679
C   -0.78057915    0.76350349    0.04669372   -0.02174786    0.00928067    0.01248303
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   15
   -420.53825088
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O   -1.96182063   -1.19295903   -0.00787229   -0.00293210    0.01756926    0.00476727
C   -0.77942857    0.76687084    0.04734915   -0.01511458    0.01131570    0.01385886
C   -0.78534963   -0.75460476    0.00397042   -0.00487918   -0.02825278   -0.00846279
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   15
   -420.53794389
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O   -1.95963780   -1.18999015   -0.00657512   -0.00225355    0.01781663    0.00476421
C   -0.77804995    0.77006699    0.04779514   -0.00808411    0.01344344    0.01514587
C   -0.78314757   -0.75109819    0.00264061   -0.00576642   -0.02697157   -0.00908981
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   15
   -420.53737216
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O   -1.95742920   -1.18722332   -0.00533188   -0.00181370    0.01793446    0.00465513
C   -0.77654916    0.77305985    0.04801230   -0.00102952    0.01558385    0.01629834
C   -0.78085879   -0.74718458    0.00144810   -0.00624837   -0.02507218   -0.00961454
C    0.33930197    1.61317264   -0.00537529    0.01634653    0.00902338   -0.01110771
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C    1.71333871    1.22426295    0.08279448    0.00109566   -0.00612340    0.01699421
C    1.72327611   -1.31412373   -0.02232913   -0.02045101   -0.02948033    0.01026398
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C    2.34997658   -0.01038093   -0.04197539    0.00694274    0.01372636   -0.00630832
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   15
   -420.53676864
H   -2.51757193    0.21417561   -0.09253681   -0.00517768   -0.01769324   -0.00530795
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O   -1.95519972   -1.18465980   -0.00414136   -0.00170413    0.01788979    0.00444940
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C   -0.77847611   -0.74289265    0.00040084   -0.00626225   -0.02253927   -0.01003725
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C    1.70987706    1.22210396    0.08557742   -0.00054631   -0.00758586    0.01843586
C    1.72673792   -1.31844349   -0.02378529   -0.01930744   -0.02917220    0.00980655
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C    2.34978409   -0.01312044   -0.04048394    0.00655189    0.01199186   -0.00601403
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   15
   -420.53614097
H   -2.53149564    0.21028416   -0.07880951   -0.00954124   -0.01976357   -0.00446107
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O   -1.95295054   -1.18229913   -0.00300122   -0.00199548    0.01773685    0.00415265
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C   -0.77599936   -0.73826070   -0.00049478   -0.00578318   -0.01935806   -0.01035863
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C    0.38639273   -1.57520146   -0.00764473    0.01390962    0.02745639   -0.00429980
C    1.70642341    1.22005909    0.08808171   -0.00200731   -0.00859618    0.01979612
C    1.73048979   -1.32232198   -0.02538948   -0.01663562   -0.02904031    0.00915111
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H    2.35719237    2.10070143    0.08142161   -0.00249241    0.00568076   -0.00093672
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C    2.34949152   -0.01604059   -0.03890146    0.00698391    0.00970120   -0.00580146
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   15
   -420.53563019
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O   -2.06122280    1.16850987   -0.02704734   -0.01810817    0.00332369   -0.00301777
O   -1.95067834   -1.18013956   -0.00190812   -0.00272079    0.01747645    0.00377973
C   -0.77234692    0.78050477    0.04713008    0.01710454    0.02105565    0.01864464
C   -0.77343576   -0.73333686   -0.00123390   -0.00482346   -0.01553542   -0.01057476
C    0.33399789    1.61630206   -0.01479993    0.01132885    0.01884139   -0.01648737
C    0.38669953   -1.57754665   -0.00735587    0.01015393    0.02313422   -0.00344556
C    1.70299980    1.21814347    0.09028683   -0.00322591   -0.00901279    0.02104946
C    1.73449144   -1.32576114   -0.02713180   -0.01252974   -0.02912722    0.00830256
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H    2.34725000    2.10571375    0.07683155   -0.00300418    0.00732752   -0.00147161
H    2.42354864   -2.18534534   -0.11441382    0.00862948   -0.00793158   -0.00327360
C    2.34909243   -0.01910681   -0.03723115    0.00820061    0.00690231   -0.00567285
H    3.44058612   -0.02061899   -0.16193648    0.00699831   -0.00390942   -0.00594948
   15
   -420.53523732
H   -2.55363599    0.21332567   -0.04914535   -0.01503673   -0.02093130   -0.00217120
O   -2.06385442    1.16833061   -0.02776075   -0.01892181    0.00252535   -0.00412534
O   -1.94837489   -1.17817815   -0.00085784   -0.00386436    0.01712269    0.00334960
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C   -0.77079976   -0.72817884   -0.00181326   -0.00343166   -0.01111534   -0.01068732
C    0.33184867    1.61684225   -0.01747699    0.00923747    0.02124178   -0.01789764
C    0.38685346   -1.58024016   -0.00701497    0.00585545    0.01760385   -0.00254623
C    1.69962460    1.21636326    0.09217385   -0.00415401   -0.00872113    0.02216764
C    1.73868101   -1.32875967   -0.02899946   -0.00716055   -0.02940214    0.00728839
H    0.06066142    2.65838750   -0.03815344   -0.00717010   -0.01019071    0.00012295
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C    2.34856857   -0.02227686   -0.03547499    0.01005965    0.00367017   -0.00561310
H    3.43653894   -0.01824977   -0.16086215    0.00476552   -0.00374606   -0.00579552
   15
   -420.53500297
H   -2.56086723    0.22046802   -0.03361896   -0.01589525   -0.01996960   -0.00088025
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O   -1.94602728   -1.17641090    0.00015448   -0.00537756    0.01669004    0.00288383
C   -0.77067683    0.78392651    0.04515361    0.02473772    0.02298463    0.01914998
C   -0.76811230   -0.72285340   -0.00223116   -0.00168206   -0.00616293   -0.01069228
C    0.32955959    1.61706295   -0.01988374    0.00729147    0.02227378   -0.01908339
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C    1.69631185    1.21471400    0.09372588   -0.00478252   -0.00769379    0.02312744
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H    2.32911913    2.11159645    0.06853754   -0.00456184    0.00905541   -0.00246083
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C    2.34789213   -0.02550198   -0.03363387    0.01232774    0.00008487   -0.00560891
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   15
   -420.53492895
H   -2.56525702    0.23118798   -0.01793387   -0.01534327   -0.01778406    0.00038510
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O   -1.94361840   -1.17483292    0.00113410   -0.00716671    0.01619524    0.00240428
C   -0.77037598    0.78512258    0.04373254    0.02695205    0.02322018    0.01908423
C   -0.76539975   -0.71743531   -0.00248752    0.00033319   -0.00077717   -0.01059047
C    0.32715992    1.61694899   -0.02200219    0.00563154    0.02156233   -0.02007836
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C    1.74728579   -1.33341730   -0.03304728    0.00616344   -0.03005696    0.00486969
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C    2.34702924   -0.02872806   -0.03170795    0.01465765   -0.00376870   -0.00560853
H    3.42639126   -0.01153487   -0.15563182   -0.00100175   -0.00321751   -0.00523273
   15
   -420.53495489
H   -2.56690792    0.24508978   -0.00231623   -0.01326674   -0.01414849    0.00151688
O   -2.07040681    1.16772939   -0.02957414   -0.02344497   -0.00721169   -0.00686384
O   -1.94112808   -1.17343864    0.00208644   -0.00909639    0.01565514    0.00192888
C   -0.77048138    0.78596822    0.04202317    0.02811715    0.02291040    0.01882075
C   -0.76269246   -0.71200584   -0.00258389    0.00250349    0.00491297   -0.01038239
C    0.32467470    1.61651125   -0.02381724    0.00429852    0.01902710   -0.02092830
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C    1.68990722    1.21173595    0.09576990   -0.00517493   -0.00364644    0.02447297
C    1.75150048   -1.33506708   -0.03519103    0.01333795   -0.03000227    0.00357053
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C    2.34594498   -0.03189699   -0.02969728    0.01669033   -0.00777760   -0.00557273
H    3.42132026   -0.00728417   -0.15157688   -0.00384782   -0.00287085   -0.00489996
   15
   -420.53500127
H   -2.56619294    0.26151475    0.01303186   -0.00971962   -0.00881578    0.00239718
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O   -1.93853460   -1.17222193    0.00301688   -0.01100504    0.01507308    0.00146778
C   -0.77101073    0.78646814    0.04002945    0.02829919    0.02204166    0.01837688
C   -0.76002307   -0.70665084   -0.00252341    0.00470120    0.01076005   -0.01006841
C    0.32212416    1.61578780   -0.02531601    0.00323821    0.01490093   -0.02165873
C    0.38727420   -1.59270399   -0.00540436   -0.01134661   -0.00692844    0.00105156
C    1.68682137    1.21034630    0.09624158   -0.00502190   -0.00089538    0.02483214
C    1.75551390   -1.33626401   -0.03738877    0.02021706   -0.02931173    0.00227466
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H    2.30861704    2.10852132    0.05957725   -0.00786582    0.00742375   -0.00352810
H    2.43019153   -2.17838390   -0.11108014   -0.00108968    0.00384262   -0.00089163
C    2.34460917   -0.03494819   -0.02760244    0.01800980   -0.01186081   -0.00546172
H    3.41693365   -0.00251760   -0.14663927   -0.00610625   -0.00245095   -0.00460690
   15
   -420.53491681
H   -2.56374933    0.27950263    0.02795402   -0.00478796   -0.00178999    0.00290527
O   -2.07346823    1.16768551   -0.03041380   -0.02960518   -0.02107687   -0.00739651
O   -1.93581645   -1.17117623    0.00393066   -0.01272170    0.01449064    0.00102422
C   -0.77196689    0.78663545    0.03775807    0.02760476    0.02063157    0.01776895
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C    0.38765623   -1.59577762   -0.00500798   -0.01422879   -0.01090281    0.00191712
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C    1.75922260   -1.33701892   -0.03962097    0.02631573   -0.02766801    0.00104494
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   15
   -420.53462637
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C   -0.77333958    0.78649147    0.03521820    0.02619930    0.01870732    0.01702195
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C    1.68087240    1.20756254    0.09605725   -0.00434128    0.00495648    0.02489942
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   15
   -420.53417775
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O   -1.92993297   -1.16957162    0.00572816   -0.01491688    0.01341541    0.00018262
C   -0.77510769    0.78606518    0.03242112    0.02422058    0.01634496    0.01614884
C   -0.75256258   -0.69191168   -0.00145586    0.01006511    0.02760483   -0.00854698
C    0.31423419    1.61259015   -0.02781174    0.00030928   -0.00127997   -0.02319161
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C    1.67799922    1.20608065    0.09540019   -0.00400660    0.00750692    0.02462376
C    1.76537685   -1.33732112   -0.04411628    0.03466662   -0.02073115   -0.00106263
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H    3.41104115    0.01405424   -0.12698379   -0.00670657   -0.00071151   -0.00421082
   15
   -420.53368555
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O   -1.92674299   -1.16900057    0.00662144   -0.01513478    0.01300125   -0.00024011
C   -0.77724153    0.78539220    0.02937999    0.02183260    0.01362162    0.01516778
C   -0.75034809   -0.68772323   -0.00083016    0.01098563    0.03247625   -0.00787638
C    0.31157427    1.61145229   -0.02795113   -0.00101583   -0.00588560   -0.02338161
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C    1.67518681    1.20448599    0.09437105   -0.00381627    0.00946005    0.02415636
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H    2.43508647   -2.18018474   -0.10476317   -0.00415106    0.00568995    0.00043924
C    2.33660671   -0.04476107   -0.01844145    0.01193693   -0.02670646   -0.00389131
H    3.41161885    0.01998704   -0.11889731   -0.00477391    0.00006209   -0.00420495
   15
   -420.53341277
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O   -2.07520468    1.17126569   -0.03115114   -0.04094072   -0.04918691   -0.00465436
O   -1.92338196   -1.16857716    0.00751745   -0.01465955    0.01273095   -0.00067948
C   -0.77970511    0.78451358    0.02610967    0.01914950    0.01064522    0.01408338
C   -0.74829897   -0.68402508   -0.00008546    0.01130706    0.03675083   -0.00713648
C    0.30893002    1.61040196   -0.02773731   -0.00260615   -0.00931032   -0.02333102
C    0.39152994   -1.60617995   -0.00384417   -0.01557422   -0.01322826    0.00542253
C    1.67243236    1.20274926    0.09297690   -0.00384366    0.01062900    0.02350548
C    1.76946548   -1.33639151   -0.04854991    0.03695607   -0.00953739   -0.00265868
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C    2.33405632   -0.04633545   -0.01598558    0.00802582   -0.02938749   -0.00330766
H    3.41304607    0.02590867   -0.11005353   -0.00216498    0.00088629   -0.00420495
   15
   -420.53350562
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O   -2.07452831    1.17340256   -0.03118058   -0.03863635   -0.04818125   -0.00443810
O   -1.91985527   -1.16829833    0.00842118   -0.01347474    0.01266069   -0.00114736
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C   -0.74642005   -0.68088175    0.00076708    0.01100277    0.04031753   -0.00634131
C    0.30632542    1.60949045   -0.02717109   -0.00443157   -0.01123586   -0.02300230
C    0.39311019   -1.60826429   -0.00372490   -0.01361559   -0.01213713    0.00626609
C    1.66973637    1.20085291    0.09122758   -0.00416398    0.01090045    0.02267413
C    1.77067714   -1.33566597   -0.05071219    0.03613170   -0.00328035   -0.00330827
H    0.12205803    2.69894005    0.05728902   -0.00129502    0.01257003    0.00611514
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H    2.30909266    2.07384563    0.05934575   -0.00890283    0.00050487   -0.00403525
H    2.44179523   -2.18733187   -0.10188005   -0.00098166    0.00063043    0.00065819
C    2.33138489   -0.04746637   -0.01347970    0.00386097   -0.03135253   -0.00272432
H    3.41485891    0.03167051   -0.10045324    0.00072300    0.00173431   -0.00416671
   15
   -420.53395699
H   -2.56442224    0.34681754    0.10747060    0.01144853    0.02103896    0.00326698
O   -2.07341634    1.17608190   -0.03115906   -0.03343150   -0.04279939   -0.00492206
O   -1.91617638   -1.16816324    0.00933793   -0.01159783    0.01278260   -0.00164039
C   -0.78545620    0.78232125    0.01894838    0.01312979    0.00433183    0.01163532
C   -0.74470676   -0.67834703    0.00171544    0.01010159    0.04307384   -0.00550094
C    0.30378804    1.60874700   -0.02625744   -0.00642269   -0.01160114   -0.02237390
C    0.39489557   -1.61016485   -0.00370029   -0.01105401   -0.01123802    0.00704499
C    1.66710372    1.19879285    0.08913564   -0.00479073    0.01026523    0.02166316
C    1.77134362   -1.33489049   -0.05282452    0.03437729    0.00269277   -0.00389566
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H    2.31527759    2.06686803    0.06183356   -0.00729869    0.00050147   -0.00396079
H    2.44557393   -2.19132404   -0.10060776    0.00107097   -0.00241731    0.00073189
C    2.32865486   -0.04812430   -0.01093259   -0.00011480   -0.03245922   -0.00217286
H    3.41654336    0.03712049   -0.09010388    0.00348837    0.00255621   -0.00405585
   15
   -420.53456074
H   -2.57202598    0.34431128    0.11909405    0.00602109    0.01355544    0.00498590
O   -2.07192706    1.17924387   -0.03108112   -0.02613468   -0.03438856   -0.00603109
O   -1.91236649   -1.16817334    0.01027333   -0.00910163    0.01311532   -0.00216528
C   -0.78865266    0.78110275    0.01509441    0.00976710    0.00119055    0.01028197
C   -0.74314556   -0.67646245    0.00274693    0.00868281    0.04492100   -0.00462424
C    0.30134784    1.60817697   -0.02500588   -0.00846704   -0.01032876   -0.02143470
C    0.39684755   -1.61189486   -0.00378209   -0.00807822   -0.01084361    0.00773118
C    1.66454383    1.19657855    0.08671639   -0.00569228    0.00881867    0.02046519
C    1.77149105   -1.33415479   -0.05487800    0.03202055    0.00787990   -0.00444344
H    0.14172257    2.69829394    0.06637803    0.00174874    0.01153486    0.00629040
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H    2.44916084   -2.19488450   -0.09946767    0.00303179   -0.00525169    0.00081762
C    2.32592588   -0.04829263   -0.00835256   -0.00353295   -0.03260148   -0.00166903
H    3.41760665    0.04211155   -0.07902574    0.00578603    0.00329931   -0.00385047
   15
   -420.53507025
H   -2.58070012    0.33937858    0.12981498   -0.00032471    0.00508563    0.00706402
O   -2.07014216    1.18279489   -0.03093446   -0.01790012   -0.02485078   -0.00747400
O   -1.90845384   -1.16833237    0.01123331   -0.00608597    0.01366381   -0.00270438
C   -0.79199646    0.77986610    0.01108507    0.00610716   -0.00182082    0.00885714
C   -0.74171514   -0.67525588    0.00384830    0.00687752    0.04580023   -0.00372209
C    0.29903559    1.60776126   -0.02343062   -0.01044061   -0.00753588   -0.02018243
C    0.39892144   -1.61346009   -0.00398065   -0.00490953   -0.01111887    0.00829660
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C    1.77115473   -1.33353677   -0.05686432    0.02934274    0.01187290   -0.00497306
H    0.15122551    2.69477540    0.06922707    0.00341251    0.00894598    0.00608987
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H    2.33119695    2.05256841    0.06892219   -0.00281300    0.00136092   -0.00363243
H    2.45220702   -2.19750744   -0.09847505    0.00464924   -0.00753820    0.00091686
C    2.32324928   -0.04796929   -0.00574724   -0.00610098   -0.03171322   -0.00121753
H    3.41763892    0.04651044   -0.06725570    0.00735203    0.00392181   -0.00355223
   15
   -420.53536511
H   -2.58931936    0.33352232    0.13926444   -0.00643757   -0.00284700    0.00915300
O   -2.06815410    1.18662819   -0.03070303   -0.00977177   -0.01571947   -0.00891743
O   -1.90447251   -1.16864657    0.01222398   -0.00268622    0.01441600   -0.00324151
C   -0.79543214    0.77865672    0.00694188    0.00207114   -0.00461283    0.00737234
C   -0.74038838   -0.67474056    0.00500592    0.00482707    0.04567965   -0.00280173
C    0.29688094    1.60745792   -0.02155057   -0.01218629   -0.00346752   -0.01864417
C    0.40106959   -1.61485630   -0.00430450   -0.00173324   -0.01213846    0.00872240
C    1.65969941    1.19178372    0.08097130   -0.00797450    0.00419586    0.01749670
C    1.77037490   -1.33309650   -0.05877547    0.02656729    0.01440308   -0.00549151
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H    2.45442409   -2.19878459   -0.09764784    0.00573584   -0.00903733    0.00103797
C    2.32066369   -0.04716774   -0.00312347   -0.00763722   -0.02978196   -0.00080734
H    3.41636054    0.05020550   -0.05484736    0.00801932    0.00438951   -0.00317055
   15
   -420.53543929
H   -2.59679512    0.32815804    0.14706968   -0.01152750   -0.00935021    0.01098546
O   -2.06605446    1.19064106   -0.03037071   -0.00244017   -0.00791164   -0.01009312
O   -1.90046092   -1.16912446    0.01325140    0.00094553    0.01534654   -0.00375423
C   -0.79889866    0.77751672    0.00268727   -0.00237529   -0.00710037    0.00584676
C   -0.73913449   -0.67491468    0.00620590    0.00269729    0.04455119   -0.00187152
C    0.29491011    1.60720597   -0.01938891   -0.01358678    0.00146188   -0.01686615
C    0.40324410   -1.61606809   -0.00476003    0.00129974   -0.01388558    0.00899431
C    1.65744901    1.18927260    0.07769032   -0.00909942    0.00143247    0.01573457
C    1.76919328   -1.33287206   -0.06060359    0.02387151    0.01533575   -0.00600259
H    0.16809180    2.68361857    0.07171128    0.00661629    0.00077691    0.00519477
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H    2.34910765    2.03728611    0.07860877    0.00225226    0.00226592   -0.00301230
H    2.45561789   -2.19844840   -0.09700780    0.00618039   -0.00960112    0.00117944
C    2.31819224   -0.04591711   -0.00048747   -0.00807123   -0.02684882   -0.00041600
H    3.41365230    0.05311293   -0.04186913    0.00772762    0.00466922   -0.00272734
   15
   -420.53541601
H   -2.60221938    0.32445237    0.15290406   -0.01511212   -0.01410113    0.01234472
O   -2.06392609    1.19474543   -0.02992426    0.00374475   -0.00184214   -0.01087566
O   -1.89646011   -1.16977662    0.01432135    0.00464299    0.01644825   -0.00422159
C   -0.80232876    0.77648359   -0.00165570   -0.00725538   -0.00919772    0.00429067
C   -0.73792143   -0.67576122    0.00743416    0.00062453    0.04245413   -0.00093556
C    0.29314413    1.60693155   -0.01697250   -0.01452539    0.00668017   -0.01490350
C    0.40539927   -1.61706917   -0.00535139    0.00405693   -0.01625577    0.00911382
C    1.65533603    1.18673987    0.07417165   -0.01007484   -0.00138090    0.01380683
C    1.76765052   -1.33287753   -0.06234094    0.02136264    0.01465186   -0.00651073
H    0.17488054    2.67743771    0.07150583    0.00797373   -0.00389580    0.00460167
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H    2.35768450    2.02907203    0.08429508    0.00455138    0.00230699   -0.00259253
H    2.45570932   -2.19639821   -0.09658020    0.00593457   -0.00917781    0.00133294
C    2.31584155   -0.04426167    0.00215484   -0.00745382   -0.02299686   -0.00002634
H    3.40956654    0.05518182   -0.02840038    0.00649819    0.00477750   -0.00223992
   15
   -420.53544931
H   -2.60494683    0.32325963    0.15652341   -0.01707296   -0.01706666    0.01315212
O   -2.06183904    1.19887229   -0.02935490    0.00866060    0.00252446   -0.01119065
O   -1.89251190   -1.17061545    0.01543913    0.00826606    0.01766887   -0.00462562
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C   -0.73671805   -0.67724854    0.00867658   -0.00125049    0.03944137    0.00000285
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   15
   -420.53554252
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   15
   -420.53579991
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O   -1.88493487   -1.17290929    0.01783557    0.01479361    0.02029431   -0.00519964
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   15
   -420.53616466
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   15
   -420.53656348
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C    1.64718534    1.17515365    0.05409417   -0.01001252   -0.01253827    0.00279936
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   15
   -420.53680073
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C    1.64603679    1.17328820    0.04981534   -0.00898091   -0.01406289    0.00057667
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   15
   -420.53681218
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   15
   -420.53651852
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   15
   -420.53604841
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O   -1.86703925   -1.18573666    0.02647368    0.02522846    0.02562526   -0.00548309
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C    2.29625343   -0.02323023    0.02509042   -0.00017538    0.02297235    0.00414370
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   15
   -420.53566244
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O   -1.86497991   -1.18885335    0.02813142    0.02576991    0.02557882   -0.00545034
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C    0.28608433    1.59468995    0.01438573   -0.00235556   -0.00926070    0.00617234
C    0.41843329   -1.60917589   -0.01840628    0.02489761   -0.00474525    0.00697197
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   15
   -420.53552491
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O   -1.86321266   -1.19225986    0.02985098    0.02606873    0.02517882   -0.00540701
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C   -0.72238135   -0.71288610    0.01881347    0.00640605   -0.01265449    0.00887628
C    0.28598339    1.59317516    0.01754395   -0.00160354   -0.01247584    0.00835903
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C    1.64197224    1.16758719    0.02893203   -0.00411620   -0.02188667   -0.00975107
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   15
   -420.53577613
H   -2.55139512    0.42205047    0.07324804    0.02104496    0.01905884    0.00101497
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O   -1.86174091   -1.19595166    0.03163184    0.02614038    0.02442270   -0.00534195
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C   -0.72098278   -0.71673800    0.01930205    0.00932091   -0.01696183    0.00961787
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C    0.41758587   -1.60468853   -0.02239182    0.02740727    0.00916714    0.00642724
C    1.64139004    1.16733699    0.02507598   -0.00415452   -0.02385191   -0.01172018
C    1.73387231   -1.33434758   -0.07392631   -0.01856381   -0.01578249   -0.00774073
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C    2.28957690   -0.01976829    0.03185604   -0.01113999    0.02941298    0.00404341
H    3.37532559    0.02835950    0.14300858    0.00273777    0.00040117    0.00324398
   15
   -420.53624606
H   -2.55979539    0.42059510    0.06091598    0.01533538    0.01217083    0.00134403
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C   -0.71972529   -0.72033419    0.01964531    0.01235506   -0.02065729    0.01028919
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C    0.41654877   -1.60260027   -0.02453255    0.02722678    0.01511341    0.00606997
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   15
   -420.53662126
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O   -1.85968459   -1.20415316    0.03537422    0.02562162    0.02192081   -0.00511396
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C   -0.71865467   -0.72361885    0.01983309    0.01545565   -0.02368785    0.01088007
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   15
   -420.53674927
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O   -1.85909413   -1.20863455    0.03733313    0.02501267    0.02024233   -0.00493463
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C    0.41326467   -1.59917666   -0.02908279    0.02325452    0.02317273    0.00518779
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C    1.72712632   -1.33033490   -0.07402251   -0.02703599   -0.01017175   -0.00615962
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C    2.28436755   -0.02020642    0.03807747   -0.01811982    0.02688505    0.00341646
H    3.37511540    0.01522732    0.17909910    0.00750220   -0.00084429    0.00501938
   15
   -420.53657361
H   -2.59609781    0.40932764    0.02236722   -0.00681173   -0.01235068    0.00110046
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O   -1.85878716   -1.21334536    0.03934798    0.02416486    0.01832611   -0.00470728
C   -0.79824199    0.77777677   -0.06429410   -0.01094335    0.01538912   -0.01884453
C   -0.71726201   -0.72908139    0.01970798    0.02170846   -0.02754439    0.01177406
C    0.28592185    1.58869651    0.03083215   -0.00580268   -0.00956619    0.01737827
C    0.41107769   -1.59796264   -0.03147902    0.01948267    0.02490026    0.00469304
C    1.63980602    1.17022513    0.01171668   -0.00845411   -0.03002633   -0.01922099
C    1.72565555   -1.32865250   -0.07385744   -0.02678762   -0.00866134   -0.00562292
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H    2.44830022   -2.16005439   -0.12927593    0.00840403   -0.00548114   -0.00087460
C    2.28314374   -0.02119589    0.04004386   -0.01833491    0.02392608    0.00329505
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   15
   -420.53625529
H   -2.60749329    0.40813922    0.00905105   -0.01253972   -0.01775895    0.00037717
O   -2.03881282    1.26959550   -0.01207330    0.00415074    0.02829953    0.00560971
O   -1.85875406   -1.21826381    0.04141619    0.02306338    0.01618983   -0.00443491
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C   -0.71703439   -0.73120105    0.01938159    0.02474025   -0.02828881    0.01206027
C    0.28608811    1.58835682    0.03279788   -0.00761792   -0.00617426    0.01857466
C    0.40859739   -1.59712307   -0.03394619    0.01467272    0.02501180    0.00417529
C    1.63967764    1.17203648    0.00903490   -0.01002002   -0.03019742   -0.02081123
C    1.72458779   -1.32683869   -0.07360734   -0.02488079   -0.00750955   -0.00510800
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H    2.44527181   -2.15952895   -0.13250966    0.00820000   -0.00553357   -0.00123091
C    2.28219583   -0.02254594    0.04196028   -0.01743097    0.01998694    0.00328080
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   15
   -420.53587416
H   -2.61665754    0.41012033   -0.00433034   -0.01643916   -0.02122525   -0.00053647
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O   -1.85898234   -1.22336582    0.04353466    0.02172212    0.01394050   -0.00412626
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C   -0.71718064   -0.73289401    0.01887300    0.02759336   -0.02819821    0.01223069
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C    0.40589621   -1.59665978   -0.03647649    0.00908994    0.02359006    0.00365761
C    1.63970072    1.17430337    0.00666746   -0.01153001   -0.02952476   -0.02217986
C    1.72389437   -1.32491087   -0.07327997   -0.02144575   -0.00673127   -0.00462068
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H    0.07509219   -2.64080794   -0.06469048   -0.00303066   -0.00387431    0.00006122
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H    2.44077916   -2.15801906   -0.13552266    0.00716679   -0.00476979   -0.00152793
C    2.28151026   -0.02419718    0.04382698   -0.01554345    0.01517835    0.00337612
H    3.36395105    0.00345573    0.20721804    0.00379244   -0.00200307    0.00564335
   15
   -420.53558450
H   -2.62288772    0.41589243   -0.01761420   -0.01844429   -0.02263700   -0.00152511
O   -2.03596828    1.27804020   -0.01032830    0.00321266    0.03569187    0.00783117
O   -1.85945685   -1.22862586    0.04569992    0.02018107    0.01159761   -0.00379174
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C   -0.71774378   -0.73416167    0.01817962    0.03017051   -0.02726099    0.01228269
C    0.28679190    1.58790685    0.03587287   -0.01076690   -0.00000178    0.02031431
C    0.40305815   -1.59655164   -0.03906209    0.00305368    0.02087766    0.00315162
C    1.63989791    1.17701553    0.00463506   -0.01286507   -0.02794115   -0.02329125
C    1.72352361   -1.32288089   -0.07288269   -0.01671726   -0.00627895   -0.00416505
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C    2.28105861   -0.02607705    0.04564254   -0.01287419    0.00964048    0.00356980
H    3.35842598    0.00016171    0.21458505    0.00094935   -0.00231269    0.00552663
   15
   -420.53549387
H   -2.62582595    0.42570976   -0.03062419   -0.01844316   -0.02198233   -0.00246936
O   -2.03460519    1.28167296   -0.00958262    0.00081298    0.03604068    0.00884614
O   -1.86016014   -1.23401741    0.04790818    0.01849361    0.00921409   -0.00344019
C   -0.78070932    0.77554162   -0.07188155    0.01635414    0.02411423   -0.02115602
C   -0.71876263   -0.73501818    0.01730067    0.03236313   -0.02548791    0.01221302
C    0.28737654    1.58770472    0.03695578   -0.01165579    0.00158342    0.02089938
C    0.40017399   -1.59675797   -0.04169537   -0.00305920    0.01722433    0.00266129
C    1.64028935    1.18014910    0.00295446   -0.01397523   -0.02547205   -0.02411022
C    1.72340446   -1.32075569   -0.07242242   -0.01104487   -0.00604975   -0.00373580
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H    2.30447541    2.03496103    0.18521248   -0.00026112    0.00378008    0.00622764
H    2.42827115   -2.15272524   -0.14068395    0.00306670   -0.00116708   -0.00192881
C    2.28080102   -0.02810206    0.04740404   -0.00976259    0.00356395    0.00384199
H    3.35273683   -0.00271758    0.22095943   -0.00228178   -0.00253923    0.00528839
   15
   -420.53561396
H   -2.62547431    0.43945274   -0.04319219   -0.01633485   -0.01913514   -0.00324399
O   -2.03325005    1.28489902   -0.00893710   -0.00297289    0.03403042    0.00965387
O   -1.86107314   -1.23951347    0.05015544    0.01674545    0.00682275   -0.00307856
C   -0.77671104    0.77413754   -0.07299422    0.02101448    0.02489151   -0.02128664
C   -0.72027019   -0.73549027    0.01623721    0.03405954   -0.02293399    0.01202070
C    0.28813660    1.58748055    0.03772290   -0.01184626    0.00161324    0.02131459
C    0.39733566   -1.59722405   -0.04436894   -0.00883836    0.01308430    0.00220950
C    1.64089171    1.18366682    0.00163801   -0.01477913   -0.02218907   -0.02461087
C    1.72345171   -1.31853899   -0.07190564   -0.00487760   -0.00585818   -0.00332970
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H    0.11117573   -2.63833748   -0.05604121    0.00387518    0.00483517    0.00116132
H    2.29641303    2.04468731    0.18337363   -0.00170652    0.00462417    0.00615443
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C    2.28069107   -0.03018051    0.04910745   -0.00666201   -0.00287497    0.00413382
H    3.34745814   -0.00514013    0.22638251   -0.00546814   -0.00272429    0.00501082
   15
   -420.53587822
H   -2.62221274    0.45660717   -0.05517985   -0.01206463   -0.01397595   -0.00375037
O   -2.03185982    1.28774131   -0.00840080   -0.00827405    0.02953368    0.01014112
O   -1.86217613   -1.24508694    0.05243763    0.01503039    0.00446177   -0.00271549
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C   -0.72229201   -0.73561649    0.01499216    0.03516607   -0.01966046    0.01171051
C    0.28907487    1.58723393    0.03816794   -0.01128160    0.00005037    0.02157092
C    0.39463011   -1.59788809   -0.04707597   -0.01390196    0.00902764    0.00178862
C    1.64171714    1.18751920    0.00069329   -0.01526821   -0.01822198   -0.02479780
C    1.72357271   -1.31623394   -0.07133850    0.00128722   -0.00547340   -0.00293212
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C    2.28068239   -0.03221532    0.05074841   -0.00401250   -0.00946629    0.00437818
H    3.34315751   -0.00707408    0.23090354   -0.00819691   -0.00281412    0.00474896
   15
   -420.53607897
H   -2.61680793    0.47624282   -0.06649830   -0.00574817   -0.00645757   -0.00385501
O   -2.03037437    1.29025082   -0.00797915   -0.01510390    0.02258151    0.01020554
O   -1.86344971   -1.25071110    0.05475063    0.01344116    0.00218499   -0.00234824
C   -0.76971920    0.77020237   -0.07425508    0.02733485    0.02421387   -0.02107124
C   -0.72484472   -0.73544620    0.01357019    0.03559926   -0.01576865    0.01128853
C    0.29018284    1.58698812    0.03828704   -0.01000072   -0.00281003    0.02165934
C    0.39213358   -1.59868937   -0.04981006   -0.01797884    0.00554544    0.00138638
C    1.64277299    1.19164649    0.00012315   -0.01542867   -0.01376576   -0.02468609
C    1.72367488   -1.31384670   -0.07072703    0.00693910   -0.00462499   -0.00252068
H    0.04169885    2.63210096    0.00739504   -0.00427473   -0.01111731   -0.00413365
H    0.13248611   -2.64000861   -0.05120658    0.00746905    0.00857343    0.00170895
H    2.28152937    2.06161856    0.17642525   -0.00532912    0.00465675    0.00549974
H    2.40669465   -2.14438974   -0.14579242   -0.00470432    0.00563127   -0.00221393
C    2.28073544   -0.03410709    0.05232330   -0.00223970   -0.01598989    0.00450871
H    3.34032070   -0.00850290    0.23456866   -0.01006929   -0.00281821    0.00457161
   15
   -420.53610148
H   -2.61039247    0.49701196   -0.07712955    0.00224425    0.00300347   -0.00350894
O   -2.02871639    1.29250612   -0.00767281   -0.02320280    0.01354777    0.00977426
O   -1.86487598   -1.25636010    0.05709026    0.01208595   -0.00001455   -0.00197502
C   -0.76682140    0.76768161   -0.07440650    0.02914097    0.02270116   -0.02075074
C   -0.72793475   -0.73503811    0.01197767    0.03526605   -0.01137456    0.01076209
C    0.29144140    1.58678568    0.03807890   -0.00818434   -0.00638084    0.02155195
C    0.38990741   -1.59957567   -0.05256513   -0.02082676    0.00301468    0.00099470
C    1.64406172    1.19598158   -0.00007407   -0.01528635   -0.00905014   -0.02430379
C    1.72367332   -1.31139040   -0.07007749    0.01161210   -0.00307268   -0.00208231
H    0.03599890    2.63655921    0.00953453   -0.00533310   -0.00690190   -0.00408330
H    0.14127623   -2.64300986   -0.04922725    0.00857014    0.00862654    0.00193828
H    2.27535660    2.06881559    0.17143283   -0.00727749    0.00401406    0.00498618
H    2.40059217   -2.14311879   -0.14671772   -0.00650010    0.00688388   -0.00232213
C    2.28082377   -0.03575746    0.05383022   -0.00162699   -0.02223343    0.00447858
H    3.33927976   -0.00942590    0.23740855   -0.01076498   -0.00273767    0.00454934
   15
   -420.53586219
H   -2.60439054    0.51722902   -0.08713575    0.01088664    0.01321445   -0.00275400
O   -2.02679483    1.29460854   -0.00747692   -0.03168944    0.00364357    0.00889316
O   -1.86643961   -1.26200907    0.05945228    0.01104298   -0.00208334   -0.00159221
C   -0.76436329    0.76481851   -0.07424433    0.03017624    0.02044881   -0.02030503
C   -0.73155699   -0.73445849    0.01022253    0.03411440   -0.00661100    0.01014382
C    0.29282333    1.58667982    0.03754515   -0.00605543   -0.01000833    0.02123087
C    0.38799453   -1.60050889   -0.05533524   -0.02235156    0.00158637    0.00060199
C    1.64558128    1.20045355    0.00009590   -0.01492057   -0.00435786   -0.02369533
C    1.72349783   -1.30888862   -0.06939648    0.01494849   -0.00070506   -0.00161743
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   15
   -420.53553350
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C   -0.73569400   -0.73377922    0.00831413    0.03211195   -0.00159387    0.00944550
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C    0.38641802   -1.60146733   -0.05811443   -0.02257567    0.00116034    0.00019680
C    1.64732623    1.20499172    0.00062390   -0.01440606    0.00005240   -0.02290145
C    1.72309816   -1.30637716   -0.06869104    0.01678448    0.00245231   -0.00113903
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   15
   -420.53540657
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O   -1.86993609   -1.27321474    0.06422598    0.01009961   -0.00576393   -0.00077402
C   -0.76082020    0.75821135   -0.07300810    0.03045871    0.01404122   -0.01904182
C   -0.74031551   -0.73307597    0.00626299    0.02926447    0.00353442    0.00867962
C    0.29582806    1.58696489    0.03552395   -0.00176511   -0.01500026    0.01988280
C    0.38518131   -1.60244422   -0.06089660   -0.02157979    0.00147098   -0.00021439
C    1.64928894    1.20952978    0.00149801   -0.01385772    0.00390077   -0.02197409
C    1.72244652   -1.30390347   -0.06796836    0.01713142    0.00616738   -0.00067508
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C    2.28130068   -0.03835808    0.05796015   -0.00660486   -0.03726763    0.00351169
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   15
   -420.53579726
H   -2.60287184    0.55806000   -0.11480692    0.02307744    0.02733291   -0.00107278
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O   -1.87185826   -1.27872973    0.06662836    0.01023025   -0.00734562   -0.00032885
C   -0.75973955    0.75456385   -0.07195314    0.02982570    0.01012090   -0.01823240
C   -0.74537852   -0.73242612    0.00408070    0.02562781    0.00863550    0.00785534
C    0.29738657    1.58743038    0.03405686   -0.00001395   -0.01557731    0.01886996
C    0.38426964   -1.60344379   -0.06367552   -0.01955590    0.00211967   -0.00063342
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C    1.72153743   -1.30152324   -0.06723540    0.01617742    0.01005543   -0.00027050
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C    2.28161324   -0.03818931    0.05922262   -0.00952842   -0.04043832    0.00309816
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   15
   -420.53668626
H   -2.61026746    0.56227443   -0.12357671    0.01839810    0.02195819   -0.00187071
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O   -1.87389679   -1.28416158    0.06903444    0.01071554   -0.00872404    0.00013573
C   -0.75910923    0.75076369   -0.07062266    0.02869444    0.00589258   -0.01730543
C   -0.75082819   -0.73190665    0.00177970    0.02131652    0.01357560    0.00698417
C    0.29894580    1.58812951    0.03230470    0.00131527   -0.01461058    0.01765825
C    0.38365265   -1.60447538   -0.06644490   -0.01670684    0.00271553   -0.00103242
C    1.65383606    1.21838559    0.00422708   -0.01305927    0.00912889   -0.01984321
C    1.72038499   -1.29929468   -0.06649820    0.01419599    0.01365360    0.00002485
H    0.02511638    2.66133747    0.03043635   -0.00802127    0.01096249   -0.00230345
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H    2.26987667    2.09704542    0.13514631   -0.01245929    0.00102803    0.00217266
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C    2.28206973   -0.03741050    0.06043816   -0.01234050   -0.04246380    0.00277245
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   15
   -420.53776689
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O   -1.87605712   -1.28949462    0.07143898    0.01148773   -0.00991423    0.00061862
C   -0.75891219    0.74687467   -0.06903067    0.02706759    0.00147862   -0.01626393
C   -0.75659957   -0.73159208   -0.00062686    0.01649940    0.01822266    0.00607873
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C    0.38328753   -1.60554752   -0.06919869   -0.01326515    0.00291340   -0.00140215
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C    1.71901872   -1.29727166   -0.06576119    0.01153452    0.01652332    0.00016831
H    0.02715220    2.66223264    0.03620749   -0.00743864    0.01119888   -0.00169045
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H    2.38910017   -2.15651465   -0.14216376   -0.00169446   -0.00394756   -0.00372512
C    2.28271215   -0.03599114    0.06161160   -0.01460129   -0.04326606    0.00261348
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   15
   -420.53871146
H   -2.63342557    0.56055524   -0.13980517    0.00090566    0.00317707   -0.00529137
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O   -1.87834795   -1.29471539    0.07383650    0.01246691   -0.01090397    0.00110534
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C   -0.76262003   -0.73155252   -0.00312528    0.01135593    0.02244222    0.00514139
C    0.30199354    1.59014612    0.02802082    0.00251982   -0.00799812    0.01477167
C    0.38312254   -1.60666292   -0.07193136   -0.00946071    0.00247254   -0.00171719
C    1.65917697    1.22670797    0.00815470   -0.01301309    0.01069596   -0.01739087
C    1.71747848   -1.29549715   -0.06502652    0.00851818    0.01830354    0.00013718
H    0.03052119    2.66113178    0.04228265   -0.00644722    0.01005213   -0.00105568
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C    2.28357436   -0.03391909    0.06274532   -0.01602769   -0.04284750    0.00264718
H    3.36879107   -0.00464145    0.23166850    0.00557296   -0.00069387    0.00642145
   15
   -420.53933425
H   -2.64609531    0.55793828   -0.14665900   -0.00804681   -0.00583501   -0.00715435
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O   -1.88078029   -1.29981263    0.07622150    0.01354596   -0.01170561    0.00158641
C   -0.75971124    0.73909713   -0.06512672    0.02218397   -0.00736953   -0.01387274
C   -0.76881204   -0.73185162   -0.00570140    0.00608693    0.02612249    0.00418062
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C    0.38310043   -1.60781473   -0.07463815   -0.00551991    0.00126385   -0.00196356
C    1.66214231    1.23063064    0.01052234   -0.01322611    0.01034722   -0.01600653
C    1.71580951   -1.29399781   -0.06429370    0.00543548    0.01876494   -0.00008294
H    0.03504519    2.65823972    0.04854803   -0.00508056    0.00762700   -0.00043497
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H    2.39076649   -2.16050878   -0.13577612    0.00127453   -0.00831980   -0.00385314
C    2.28467747   -0.03120067    0.06383870   -0.01632303   -0.04123211    0.00291267
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   15
   -420.53973860
H   -2.65734084    0.55634113   -0.15222928   -0.01531150   -0.01278868   -0.00868783
O   -1.99709274    1.31227759   -0.00910095    0.00239471    0.02742046    0.01166074
O   -1.88336631   -1.30477722    0.07858852    0.01463080   -0.01233133    0.00205129
C   -0.76063343    0.73534202   -0.06285090    0.01888838   -0.01151507   -0.01254229
C   -0.77509611   -0.73254489   -0.00834067    0.00086180    0.02914947    0.00319641
C    0.30489784    1.59262047    0.02284532    0.00195423    0.00371270    0.01152172
C    0.38316187   -1.60898459   -0.07731532   -0.00165271   -0.00075919   -0.00214096
C    1.66530760    1.23439742    0.01313185   -0.01345792    0.00951930   -0.01449096
C    1.71405813   -1.29278048   -0.06355940    0.00252820    0.01781117   -0.00048970
H    0.04047940    2.65398925    0.05489240   -0.00342091    0.00417504    0.00013932
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H    2.39138211   -2.16044375   -0.13154568    0.00206016   -0.00934571   -0.00373203
C    2.28602613   -0.02786011    0.06488772   -0.01548220   -0.03853335    0.00339731
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   15
   -420.54005034
H   -2.66586348    0.55701150   -0.15624271   -0.02026653   -0.01730955   -0.00972684
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O   -1.88611820   -1.30960211    0.08093229    0.01562238   -0.01277505    0.00249653
C   -0.76184057    0.73176055   -0.06038555    0.01504744   -0.01527351   -0.01113546
C   -0.78139350   -0.73367798   -0.01102823   -0.00413134    0.03144590    0.00219320
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C    0.38324855   -1.61014207   -0.07996024    0.00197285   -0.00353245   -0.00223834
C    1.66867626    1.23802054    0.01596029   -0.01361366    0.00845798   -0.01283384
C    1.71226801   -1.29183071   -0.06281750    0.00000846    0.01544108   -0.00105853
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H    2.39163477   -2.15870960   -0.12664378    0.00227886   -0.00945945   -0.00352073
C    2.28760748   -0.02393812    0.06588517   -0.01348912   -0.03486468    0.00405785
H    3.37726730    0.00048228    0.21298292    0.00668943   -0.00018331    0.00545509
   15
   -420.54044895
H   -2.67077369    0.56076220   -0.15851296   -0.02269656   -0.01933403   -0.01020997
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O   -1.88904714   -1.31428220    0.08324779    0.01643866   -0.01308073    0.00290472
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C   -0.78762885   -0.73528556   -0.01374893   -0.00876664    0.03294936    0.00117506
C    0.30768943    1.59486000    0.01697363    0.00032291    0.01735691    0.00813299
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C    1.67225042    1.24151580    0.01898263   -0.01353216    0.00737989   -0.01104240
C    1.71047717   -1.29111290   -0.06205944   -0.00201600    0.01181026   -0.00175760
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H    0.13978434   -2.67983116   -0.05905472    0.00392781   -0.00760311    0.00367271
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H    2.39148580   -2.15528565   -0.12110970    0.00190378   -0.00866190   -0.00319493
C    2.28939154   -0.01948997    0.06682110   -0.01048783   -0.03038977    0.00484521
H    3.37762560    0.00228643    0.20468487    0.00515870   -0.00012939    0.00480512
   15
   -420.54102692
H   -2.67163578    0.56795834   -0.15895355   -0.02250252   -0.01892280   -0.01010609
O   -1.98348278    1.31620637   -0.01153812    0.01837343    0.03054816    0.01139696
O   -1.89216234   -1.31881404    0.08553036    0.01701858   -0.01324993    0.00328396
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C   -0.79373223   -0.73739025   -0.01648736   -0.01292572    0.03361134    0.00013371
C    0.30907121    1.59563842    0.01384053   -0.00052556    0.02332461    0.00638908
C    0.38328439   -1.61224403   -0.08514857    0.00805113   -0.01062707   -0.00220842
C    1.67602885    1.24489932    0.02217178   -0.01312935    0.00645704   -0.00912880
C    1.70871613   -1.29057235   -0.06127470   -0.00347048    0.00711832   -0.00254984
H    0.05914822    2.63972651    0.07342603    0.00195313   -0.00781479    0.00147098
H    0.13312790   -2.67478279   -0.06361845    0.00348402   -0.00450068    0.00360519
H    2.34037554    2.11826716    0.06953156    0.00044393    0.00753360   -0.00110734
H    2.39100191   -2.15031428   -0.11500166    0.00099298   -0.00704171   -0.00278965
C    2.29133322   -0.01458313    0.06768368   -0.00672462   -0.02526737    0.00570743
H    3.37706553    0.00411468    0.19552257    0.00290330   -0.00011385    0.00407107
   15
   -420.54174365
H   -2.66848565    0.57852566   -0.15758316   -0.01961247   -0.01606409   -0.00942087
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O   -1.89547033   -1.32319568    0.08777571    0.01731956   -0.01332334    0.00364160
C   -0.76655522    0.72258245   -0.05206919    0.00094013   -0.02286928   -0.00659725
C   -0.79964085   -0.74000210   -0.01922780   -0.01651818    0.03342729   -0.00092170
C    0.31046076    1.59606614    0.01061098   -0.00117880    0.02775730    0.00456310
C    0.38314183   -1.61308190   -0.08769237    0.01037789   -0.01439303   -0.00210239
C    1.68000525    1.24818486    0.02549882   -0.01228368    0.00581359   -0.00712140
C    1.70700687   -1.29013852   -0.06045133   -0.00434811    0.00166813   -0.00339073
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   15
   -420.54245758
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   15
   -420.54288860
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   15
   -420.54279361
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   15
   -420.54218863
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   15
   -420.54130662
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   15
   -420.54054549
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   15
   -420.54015098
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   15
   -420.54003721
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   15
   -420.53985727
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   15
   -420.53934781
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   15
   -420.53851293
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O   -1.94328994   -1.36128590    0.10879119    0.00390588   -0.01616438    0.00878677
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   15
   -420.53758318
H   -2.67396126    0.62843779   -0.07502130   -0.02067537   -0.01213867   -0.00398301
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C   -0.84496883   -0.79956351   -0.04614687   -0.01421151   -0.00890869   -0.01499733
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C    0.36439708   -1.60414431   -0.11667891    0.00940736    0.00785834    0.00109988
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H    3.41413394    0.02957476    0.05173382    0.00829978    0.00033403   -0.00309441
   15
   -420.53687038
H   -2.67882317    0.62348271   -0.06477440   -0.02516683   -0.01572278   -0.00357287
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O   -1.95334654   -1.36604098    0.11156097   -0.00091135   -0.01768353    0.00993199
C   -0.76790645    0.71223676   -0.01354595   -0.02157060    0.00983690    0.01053617
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C    0.36139176   -1.60288471   -0.11909472    0.00539880    0.00945041    0.00122884
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H    2.42572542   -2.08884706   -0.01359394    0.00902236   -0.00491033    0.00304423
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   15
   -420.53656066
H   -2.67919739    0.62132457   -0.05388771   -0.02666407   -0.01698030   -0.00291943
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O   -1.95837322   -1.36812200    0.11278008   -0.00348171   -0.01844020    0.01044735
C   -0.76547602    0.71192785   -0.01123105   -0.01883898    0.01281154    0.01126341
C   -0.84831481   -0.81058926   -0.04831340   -0.00755236   -0.01623406   -0.01724415
C    0.33327905    1.56983992   -0.02781504   -0.01105235    0.00454633   -0.01709580
C    0.35830564   -1.60176670   -0.12152897    0.00072883    0.00993825    0.00123297
C    1.73786038    1.28479490    0.07035242    0.02000835   -0.00167878    0.01453965
C    1.69289981   -1.26004549   -0.03955960   -0.00757849   -0.01553593   -0.00587186
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H    0.04974709   -2.65754806   -0.19050909   -0.01154584   -0.00495893   -0.00104348
H    2.45439946    2.10124586    0.00054538    0.00757318   -0.00637997   -0.00561721
H    2.42596990   -2.08517954   -0.00820268    0.00946612   -0.00512290    0.00332574
C    2.31658402    0.05662597    0.06622313   -0.01000878    0.03950840    0.00791286
H    3.41654706    0.03327205    0.03303036    0.00775878    0.00072975   -0.00409086
   15
   -420.53669737
H   -2.67481427    0.62219066   -0.04247664   -0.02518812   -0.01595272   -0.00216075
O   -1.93257849    1.32721633   -0.03328051    0.04488304    0.01624671   -0.00157159
O   -1.96336035   -1.36999389    0.11388075   -0.00610390   -0.01915331    0.01090449
C   -0.76276100    0.71142577   -0.00908631   -0.01588994    0.01533086    0.01187693
C   -0.84979074   -0.81576110   -0.04901396   -0.00396651   -0.01936048   -0.01824960
C    0.33555401    1.56717036   -0.02907231   -0.01209090    0.00706109   -0.01706050
C    0.35520906   -1.60079766   -0.12398169   -0.00439525    0.00937191    0.00110032
C    1.74053366    1.28699633    0.07249004    0.01954539   -0.00282693    0.01523711
C    1.69290419   -1.25558688   -0.03728194   -0.00442117   -0.01439291   -0.00502979
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H    0.05525510   -2.65553853   -0.20023469   -0.01083915   -0.00327505   -0.00130690
H    2.45473159    2.10964845    0.00323446    0.00858570   -0.00435500   -0.00558827
H    2.42452139   -2.08060050   -0.00340919    0.00913546   -0.00459069    0.00354088
C    2.31855722    0.05802476    0.06509156   -0.00869745    0.03803562    0.00748589
H    3.41560943    0.03494220    0.02473919    0.00602529    0.00099340   -0.00449308
   15
   -420.53716310
H   -2.66593922    0.62589581   -0.03067650   -0.02076473   -0.01263339   -0.00140142
O   -1.93205974    1.32786303   -0.03465978    0.03833613    0.01417136   -0.00232935
O   -1.96827825   -1.37164857    0.11485777   -0.00871912   -0.01980016    0.01130868
C   -0.75980590    0.71069248   -0.00712101   -0.01280505    0.01736217    0.01237421
C   -0.85120671   -0.82064074   -0.04943875   -0.00037547   -0.02206264   -0.01914200
C    0.33801114    1.56439438   -0.03007179   -0.01263665    0.00928063   -0.01690167
C    0.35217922   -1.59996921   -0.12645088   -0.00975326    0.00790980    0.00082294
C    1.74291176    1.28923978    0.07439749    0.01878969   -0.00336335    0.01576532
C    1.69297455   -1.25091026   -0.03492841   -0.00055717   -0.01356349   -0.00403611
H    0.07295045    2.60525389    0.05972657    0.00371353   -0.00737742    0.00464850
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H    2.45352230    2.11883546    0.00692854    0.00930759   -0.00234928   -0.00548520
H    2.42143894   -2.07520509    0.00074790    0.00807188   -0.00335851    0.00368396
C    2.32066077    0.05884977    0.06384696   -0.00644496    0.03549275    0.00693691
H    3.41359894    0.03643349    0.01725579    0.00348897    0.00128077   -0.00481386
   15
   -420.53765899
H   -2.65336678    0.63184248   -0.01862183   -0.01353228   -0.00704695   -0.00079631
O   -1.93197315    1.32835091   -0.03601279    0.02884321    0.00999359   -0.00290543
O   -1.97309732   -1.37307872    0.11570659   -0.01124945   -0.02036936    0.01163821
C   -0.75665732    0.70969728   -0.00534267   -0.00962481    0.01888562    0.01275455
C   -0.85261682   -0.82518737   -0.04957427    0.00307203   -0.02429555   -0.01990002
C    0.34065853    1.56147920   -0.03081584   -0.01253725    0.01059059   -0.01666671
C    0.34929674   -1.59925960   -0.12893241   -0.01504207    0.00581677    0.00042899
C    1.74500597    1.29153319    0.07606681    0.01786462   -0.00316799    0.01610852
C    1.69305274   -1.24602830   -0.03251402    0.00379717   -0.01296502   -0.00290554
H    0.06912617    2.59695325    0.04935083    0.00384453   -0.01063570    0.00410890
H    0.07192099   -2.65019201   -0.21895159   -0.00847119    0.00170289   -0.00157619
H    2.45064351    2.12844817    0.01160888    0.00961507   -0.00053686   -0.00529552
H    2.41691233   -2.06921334    0.00424280    0.00638933   -0.00154150    0.00375707
C    2.32286093    0.05913932    0.06249762   -0.00351801    0.03197561    0.00626430
H    3.41096821    0.03769411    0.01063777    0.00041587    0.00158493   -0.00505076
   15
   -420.53796183
H   -2.63839263    0.63902703   -0.00641925   -0.00395111    0.00061062   -0.00049436
O   -1.93221144    1.32872714   -0.03733312    0.01687893    0.00394433   -0.00317291
O   -1.97778895   -1.37427789    0.11642347   -0.01361526   -0.02085804    0.01188706
C   -0.75336330    0.70841715   -0.00375703   -0.00637461    0.01989954    0.01302174
C   -0.85407302   -0.82936727   -0.04940912    0.00622625   -0.02602227   -0.02049604
C    0.34349446    1.55840566   -0.03130795   -0.01164528    0.01048237   -0.01637231
C    0.34664127   -1.59863758   -0.13142029   -0.01998000    0.00342053   -0.00006907
C    1.74683013    1.29387358    0.07749281    0.01687503   -0.00219801    0.01626072
C    1.69307327   -1.24095022   -0.03005582    0.00835780   -0.01244275   -0.00166586
H    0.06461426    2.59054307    0.03823459    0.00359705   -0.01231355    0.00364542
H    0.08265654   -2.64774280   -0.22789400   -0.00701923    0.00436658   -0.00161620
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H    2.41124178   -2.06294960    0.00706223    0.00426884    0.00067143    0.00376715
C    2.32511394    0.05894644    0.06105370   -0.00030235    0.02761797    0.00548130
H    3.40826527    0.03866877    0.00492784   -0.00283804    0.00190238   -0.00521081
   15
   -420.53788223
H   -2.62272573    0.64608318    0.00587802    0.00688310    0.00950569   -0.00057851
O   -1.93263993    1.32905968   -0.03861782    0.00356163   -0.00321795   -0.00304957
O   -1.98232635   -1.37524052    0.11700561   -0.01573099   -0.02127372    0.01204703
C   -0.74997297    0.70683676   -0.00236814   -0.00306096    0.02041126    0.01317687
C   -0.85562273   -0.83315433   -0.04893431    0.00889989   -0.02723117   -0.02090678
C    0.34650551    1.55517563   -0.03155261   -0.00993301    0.00870947   -0.01598688
C    0.34428706   -1.59806738   -0.13390705   -0.02425665    0.00111260   -0.00064651
C    1.74839912    1.29624629    0.07867320    0.01589471   -0.00047841    0.01621978
C    1.69296760   -1.23568414   -0.02757254    0.01278377   -0.01179658   -0.00034495
H    0.05946359    2.58632357    0.02646098    0.00283825   -0.01216488    0.00324921
H    0.09465691   -2.64607379   -0.23654763   -0.00556304    0.00664180   -0.00160168
H    2.43974633    2.14771369    0.02377489    0.00873783    0.00200465   -0.00464208
H    2.40480561   -2.05680851    0.00920418    0.00194852    0.00300977    0.00372636
C    2.32737172    0.05833681    0.05952701    0.00275604    0.02258408    0.00460897
H    3.40606972    0.03930111    0.00015520   -0.00584838    0.00219600   -0.00531574
   15
   -420.53747457
H   -2.60828892    0.65143242    0.01828441    0.01706942    0.01804784   -0.00099904
O   -1.93310929    1.32942831   -0.03986825   -0.00920428   -0.00990453   -0.00259188
O   -1.98668560   -1.37596195    0.11745118   -0.01752022   -0.02160276    0.01211444
C   -0.74653644    0.70494832   -0.00117834    0.00032531    0.02045308    0.01322497
C   -0.85730621   -0.83653029   -0.04814364    0.01095294   -0.02790640   -0.02111151
C    0.34966579    1.55181587   -0.03155577   -0.00742575    0.00534523   -0.01544456
C    0.34229857   -1.59751456   -0.13638407   -0.02765371   -0.00072096   -0.00123482
C    1.74972775    1.29862545    0.07960856    0.01496074    0.00189957    0.01600487
C    1.69266923   -1.23024014   -0.02508410    0.01671784   -0.01076573    0.00101907
H    0.05380874    2.58426843    0.01410227    0.00159974   -0.01024902    0.00286185
H    0.10765985   -2.64558805   -0.24491270   -0.00417847    0.00812171   -0.00161446
H    2.43188640    2.15691026    0.03114336    0.00753871    0.00261202   -0.00419112
H    2.39801748   -2.05120636    0.01067572   -0.00028749    0.00515202    0.00365162
C    2.32958860    0.05738630    0.05793070    0.00518811    0.01706150    0.00368128
H    3.40491675    0.03953835   -0.00366077   -0.00816941    0.00246265   -0.00539350
   15
   -420.53700801
H   -2.59688149    0.65357148    0.03087248    0.02423218    0.02396018   -0.00151822
O   -1.93347695    1.32990693   -0.04108935   -0.01901279   -0.01395888   -0.00206154
O   -1.99084647   -1.37643843    0.11775942   -0.01890685   -0.02185810    0.01208809
C   -0.74310493    0.70275115   -0.00018837    0.00377932    0.02006186    0.01317345
C   -0.85915437   -0.83948497   -0.04703405    0.01223510   -0.02805100   -0.02109337
C    0.35293754    1.54837671   -0.03132566   -0.00425508    0.00081085   -0.01469629
C    0.34072690   -1.59695177   -0.13884245   -0.02997145   -0.00178341   -0.00180711
C    1.75083011    1.30097527    0.08030212    0.01409446    0.00479188    0.01562756
C    1.69211912   -1.22463417   -0.02261107    0.01981208   -0.00907487    0.00239945
H    0.04787129    2.58403813    0.00122925   -0.00002925   -0.00693583    0.00241555
H    0.12141691   -2.64654888   -0.25298598   -0.00292453    0.00854071   -0.00168960
H    2.42267528    2.16564326    0.03926538    0.00591113    0.00276832   -0.00367637
H    2.39127574   -2.04652422    0.01149018   -0.00215128    0.00677974    0.00355574
C    2.33172832    0.05617820    0.05627876    0.00659178    0.01124314    0.00273084
H    3.40521934    0.03933293   -0.00650577   -0.00944712    0.00268374   -0.00546622
   15
   -420.53682303
H   -2.58976356    0.65146458    0.04372855    0.02641139    0.02527177   -0.00168792
O   -1.93363349    1.33053965   -0.04228677   -0.02388041   -0.01343132   -0.00187094
O   -1.99479330   -1.37666702    0.11793064   -0.01983953   -0.02204610    0.01195813
C   -0.73973063    0.70025114    0.00060253    0.00728162    0.01927655    0.01302565
C   -0.86118648   -0.84201614   -0.04560582    0.01263972   -0.02769144   -0.02083968
C    0.35627304    1.54492601   -0.03087365   -0.00061698   -0.00429786   -0.01369601
C    0.33960702   -1.59636306   -0.14127352   -0.03113146   -0.00192690   -0.00233334
C    1.75171936    1.30325225    0.08075957    0.01325992    0.00800891    0.01511005
C    1.69127078   -1.21889201   -0.02017431    0.02179099   -0.00651501    0.00376711
H    0.04194258    2.58504406   -0.01207700   -0.00188818   -0.00279349    0.00185609
H    0.13570285   -2.64903004   -0.26075287   -0.00183132    0.00777265   -0.00186661
H    2.41240521    2.17388261    0.04804859    0.00394762    0.00256038   -0.00312222
H    2.38491250   -2.04305087    0.01166471   -0.00341012    0.00760314    0.00344818
C    2.33376991    0.05480024    0.05458553    0.00673368    0.00531599    0.00178118
H    3.40720450    0.03864529   -0.00836650   -0.00946643    0.00284902   -0.00555110
   15
   -420.53703839
H   -2.58732044    0.64488449    0.05687807    0.02314526    0.02138230   -0.00115472
O   -1.93352417    1.33131996   -0.04346230   -0.02332189   -0.00775220   -0.00239413
O   -1.99851551   -1.37664560    0.11796630   -0.02030892   -0.02215058    0.01172910
C   -0.73646643    0.69746013    0.00119661    0.01078220    0.01811960    0.01278497
C   -0.86340859   -0.84412919   -0.04386279    0.01211973   -0.02687178   -0.02034654
C    0.35961757    1.54154017   -0.03021488    0.00326878   -0.00931202   -0.01243255
C    0.33895645   -1.59574628   -0.14366941   -0.03112921   -0.00118654   -0.00279078
C    1.75240817    1.30540800    0.08098870    0.01239794    0.01133336    0.01447381
C    1.69009454   -1.21305254   -0.01779446    0.02248927   -0.00297481    0.00510427
H    0.03635401    2.58655043   -0.02571534   -0.00376667    0.00151558    0.00115556
H    0.15032148   -2.65289498   -0.26818266   -0.00085589    0.00590166   -0.00212699
H    2.40142726    2.18166522    0.05739355    0.00179143    0.00207830   -0.00254427
H    2.37915212   -2.04093199    0.01121850   -0.00392620    0.00745769    0.00333285
C    2.33571126    0.05334184    0.05286534    0.00559756   -0.00054593    0.00084453
H    3.41087539    0.03744562   -0.00922774   -0.00821324    0.00295469   -0.00564730
   15
   -420.53731676
H   -2.58898386    0.63451421    0.07022339    0.01575693    0.01344368    0.00020870
O   -1.93315413    1.33218457   -0.04460991   -0.01860703    0.00188100   -0.00372847
O   -2.00200777   -1.37637300    0.11786902   -0.02032201   -0.02216732    0.01138918
C   -0.73336514    0.69439559    0.00159750    0.01419097    0.01660757    0.01245313
C   -0.86581285   -0.84583645   -0.04181243    0.01070556   -0.02564751   -0.01961207
C    0.36291263    1.53829425   -0.02936842    0.00719680   -0.01363698   -0.01093088
C    0.33877536   -1.59511237   -0.14602315   -0.03008343    0.00021281   -0.00320560
C    1.75290966    1.30739255    0.08099911    0.01140967    0.01452793    0.01373754
C    1.68857986   -1.20716921   -0.01549174    0.02190611    0.00147885    0.00640436
H    0.03144136    2.58778995   -0.03955971   -0.00548905    0.00541902    0.00031989
H    0.16509758   -2.65781039   -0.27522792   -0.00001461    0.00318516   -0.00247986
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H    2.37408728   -2.04014144    0.01017240   -0.00370545    0.00632791    0.00320150
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   15
   -420.53731676
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O   -1.93257476    1.33302627   -0.04571467   -0.01194512    0.01325860   -0.00566709
O   -2.00526990   -1.37584899    0.11764264   -0.01992095   -0.02209661    0.01094745
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C    0.33904801   -1.59448208   -0.14832851   -0.02812076    0.00194457   -0.00358749
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   15
   -420.53683572
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O   -2.00830637   -1.37507441    0.11729217   -0.01918095   -0.02191525    0.01041277
C   -0.72785364    0.68754256    0.00184106    0.02022321    0.01255381    0.01153064
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C    0.36911910    1.53246470   -0.02720585    0.01460474   -0.01860685   -0.00743240
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C    1.75341472    1.31066153    0.08040959    0.00862493    0.01960049    0.01201137
C    1.68458679   -1.19554956   -0.01119573    0.01756523    0.01210278    0.00888778
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H    2.36578408   -2.04159291    0.00638101   -0.00163751    0.00186206    0.00284154
C    2.34117765    0.04934883    0.04768440   -0.00263646   -0.01619033   -0.00197366
H    3.42888524    0.03064936   -0.00565280    0.00047093    0.00283806   -0.00580000
   15
   -420.53587702
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O   -1.93108272    1.33413658   -0.04770643   -0.00011974    0.03336925   -0.00987835
O   -2.01112549   -1.37405137    0.11682364   -0.01818823   -0.02159279    0.00979570
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C    0.37191883    1.52995573   -0.02594248    0.01785623   -0.01881349   -0.00557628
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C    1.75346056    1.31186973    0.07983574    0.00668311    0.02110798    0.01102788
C    1.68217338   -1.18997290   -0.00923998    0.01433352    0.01749127    0.01007831
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H    0.20880942   -2.67368448   -0.29340486    0.00263022   -0.00610854   -0.00357985
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H    2.36218046   -2.04304035    0.00370071   -0.00027285   -0.00084652    0.00259324
C    2.34301784    0.04840773    0.04599800   -0.00551744   -0.02031563   -0.00296651
H    3.43549510    0.02734203   -0.00237837    0.00364482    0.00263947   -0.00571558
   15
   -420.53478303
H   -2.60785063    0.58588894    0.11944180   -0.01482039   -0.01913711    0.00839826
O   -1.93030259    1.33417892   -0.04854626    0.00328158    0.04005756   -0.01153708
O   -2.01373843   -1.37278354    0.11624406   -0.01703869   -0.02111980    0.00911695
C   -0.72355491    0.67993641    0.00138885    0.02421035    0.00727870    0.01028843
C   -0.87665671   -0.84904658   -0.03080973   -0.00149080   -0.01805066   -0.01456029
C    0.37444908    1.52772928   -0.02459475    0.02069351   -0.01741907   -0.00376250
C    0.34223787   -1.59286245   -0.15489350   -0.01832942    0.00562945   -0.00501635
C    1.75340584    1.31275979    0.07909526    0.00435446    0.02179543    0.00996501
C    1.67954365   -1.18466006   -0.00743656    0.01077000    0.02236752    0.01122173
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H    2.35862792   -2.04433755    0.00055424    0.00096134   -0.00341974    0.00229403
C    2.34494065    0.04777292    0.04435650   -0.00773751   -0.02371462   -0.00399876
H    3.44145655    0.02356072    0.00192361    0.00629736    0.00236158   -0.00553377
   15
   -420.53383045
H   -2.60872749    0.57929363    0.12885752   -0.01741480   -0.02232188    0.00968822
O   -1.92955788    1.33376934   -0.04925568    0.00475064    0.04410334   -0.01266489
O   -2.01615816   -1.37127624    0.11556109   -0.01582263   -0.02050823    0.00839386
C   -0.72194073    0.67594770    0.00092456    0.02513972    0.00429164    0.00955734
C   -0.87944356   -0.84908797   -0.02745426   -0.00531658   -0.01577778   -0.01287361
C    0.37666709    1.52576433   -0.02319001    0.02304844   -0.01449294   -0.00205251
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C    1.75328567    1.31332129    0.07820420    0.00171211    0.02167197    0.00882179
C    1.67675119   -1.17968434   -0.00580273    0.00710535    0.02637309    0.01231000
H    0.02537815    2.57182157   -0.10622119   -0.00749016    0.00820775   -0.00420610
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H    2.35490700   -2.04502570   -0.00300462    0.00187513   -0.00555635    0.00195210
C    2.34697927    0.04749567    0.04277550   -0.00899216   -0.02629942   -0.00506336
H    3.44629570    0.01935530    0.00722055    0.00815571    0.00201080   -0.00525621
   15
   -420.53320590
H   -2.60650428    0.57668325    0.13653762   -0.01758272   -0.02318855    0.01038044
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O   -2.01839838   -1.36953646    0.11478295   -0.01462594   -0.01973315    0.00763670
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C    0.37853730    1.52401691   -0.02175404    0.02485681   -0.01022586   -0.00050405
C    0.34583383   -1.59216780   -0.15890171   -0.01009928    0.00441383   -0.00651708
C    1.75313986    1.31355599    0.07717988   -0.00111771    0.02083517    0.00759896
C    1.67385118   -1.17510598   -0.00435495    0.00351564    0.02923770    0.01332816
H    0.02837771    2.56348396   -0.11789210   -0.00630833    0.00497475   -0.00478549
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H    2.35085502   -2.04472291   -0.00691447    0.00232390   -0.00703888    0.00158132
C    2.34915243    0.04761501    0.04127109   -0.00908180   -0.02801803   -0.00614574
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   15
   -420.53296254
H   -2.60115021    0.57821421    0.14235884   -0.01534668   -0.02174928    0.01040313
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O   -2.02047261   -1.36757297    0.11391819   -0.01351047   -0.01881480    0.00686907
C   -0.71985228    0.66782377   -0.00042518    0.02470346   -0.00210493    0.00789298
C   -0.88471922   -0.84849056   -0.02018705   -0.01270289   -0.01109897   -0.00917784
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C    0.34789245   -1.59192696   -0.16076396   -0.00582664    0.00246295   -0.00746121
C    1.75301097    1.31347633    0.07604072   -0.00396075    0.01944498    0.00631587
C    1.67089780   -1.17096809   -0.00310859    0.00012202    0.03078887    0.01426423
H    0.03250698    2.55426384   -0.12870435   -0.00470491    0.00084217   -0.00517221
H    0.25951320   -2.67935407   -0.30865413    0.00669652   -0.00896998   -0.00368576
H    2.32936222    2.23428202    0.13978140   -0.00693673    0.00529915    0.00234442
H    2.34639252   -2.04316413   -0.01110884    0.00222320   -0.00772331    0.00120173
C    2.35146138    0.04815688    0.03985957   -0.00792813   -0.02883898   -0.00722031
H    3.45145392    0.00993498    0.02058314    0.00888323    0.00114171   -0.00445128
   15
   -420.53298931
H   -2.59306612    0.58362567    0.14631959   -0.01077273   -0.01792416    0.00966079
O   -1.92759924    1.32951982   -0.05050986   -0.00182400    0.04035672   -0.01205861
O   -2.02239349   -1.36539617    0.11297552   -0.01251330   -0.01777676    0.00610244
C   -0.71937153    0.66378510   -0.00128548    0.02344787   -0.00538722    0.00696767
C   -0.88709664   -0.84792238   -0.01633111   -0.01600864   -0.00878552   -0.00722286
C    0.38113331    1.52090269   -0.01887893    0.02682220    0.00090761    0.00199667
C    0.35003918   -1.59172240   -0.16251328   -0.00156624   -0.00027622   -0.00850966
C    1.75294174    1.31310310    0.07480610   -0.00662419    0.01769104    0.00499873
C    1.66794223   -1.16729405   -0.00207777   -0.00298649    0.03097067    0.01510047
H    0.03747877    2.54489880   -0.13858858   -0.00281992   -0.00375979   -0.00536568
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H    2.34153802   -2.04022747   -0.01551973    0.00156124   -0.00753323    0.00083380
C    2.35388875    0.04913369    0.03855719   -0.00557017   -0.02875580   -0.00826007
H    3.45164234    0.00487597    0.02850463    0.00771383    0.00065638   -0.00397395
   15
   -420.53305187
H   -2.58307561    0.59222936    0.14855196   -0.00391740   -0.01171698    0.00815264
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O   -2.02417229   -1.36301783    0.11196363   -0.01165096   -0.01665278    0.00534217
C   -0.71924467    0.65982784   -0.00225107    0.02167338   -0.00863419    0.00599315
C   -0.88923248   -0.84722128   -0.01236601   -0.01893366   -0.00654727   -0.00523039
C    0.38182927    1.51936888   -0.01747762    0.02707148    0.00667137    0.00297749
C    0.35220969   -1.59151294   -0.16413382    0.00261925   -0.00360785   -0.00964621
C    1.75297223    1.31246258    0.07349590   -0.00891406    0.01576563    0.00367861
C    1.66503150   -1.16408665   -0.00127514   -0.00580345    0.02982451    0.01582390
H    0.04295697    2.53620949   -0.14750876   -0.00085556   -0.00826776   -0.00542009
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H    2.33641061   -2.03594612   -0.02008117    0.00036464   -0.00651904    0.00049487
C    2.35639905    0.05054422    0.03737961   -0.00216636   -0.02779607   -0.00923104
H    3.45045504   -0.00030079    0.03714132    0.00565249    0.00015275   -0.00348196
   15
   -420.53287742
H   -2.57240727    0.60291097    0.14932726    0.00482563   -0.00336718    0.00590671
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O   -2.02581881   -1.36045064    0.11089113   -0.01091644   -0.01548367    0.00459854
C   -0.71944509    0.65600098   -0.00330722    0.01955766   -0.01176630    0.00497472
C   -0.89108254   -0.84642104   -0.00832182   -0.02144409   -0.00443774   -0.00323093
C    0.38211636    1.51773515   -0.01612125    0.02696686    0.01164375    0.00387171
C    0.35434073   -1.59124858   -0.16560847    0.00669377   -0.00721773   -0.01082096
C    1.75313683    1.31158369    0.07213001   -0.01066048    0.01382373    0.00239741
C    1.66220814   -1.16132873   -0.00071159   -0.00831720    0.02749892    0.01642388
H    0.04859127    2.52899815   -0.15545414    0.00095753   -0.01203558   -0.00541391
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H    2.32066207    2.24334971    0.16686717   -0.00550808    0.00899530    0.00435342
H    2.33122394   -2.03050201   -0.02473235   -0.00127309   -0.00476279    0.00020242
C    2.35894119    0.05237398    0.03634149    0.00199900   -0.02598746   -0.01010588
H    3.44825943   -0.00550521    0.04640504    0.00294097   -0.00034429   -0.00300245
   15
   -420.53237417
H   -2.56262209    0.61417986    0.14904600    0.01453291    0.00624088    0.00320817
O   -1.92531975    1.32134921   -0.05059221   -0.02321134    0.01436626   -0.00486381
O   -2.02734141   -1.35770778    0.10976648   -0.01029614   -0.01432185    0.00386513
C   -0.71994103    0.65235179   -0.00443852    0.01729426   -0.01469031    0.00391157
C   -0.89260889   -0.84555351   -0.00422875   -0.02353144   -0.00249031   -0.00124904
C    0.38199607    1.51592723   -0.01482342    0.02659608    0.01512673    0.00476568
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C    1.75346177    1.31049567    0.07072781   -0.01172129    0.01198140    0.00118150
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H    0.05405934    2.52393415   -0.16242430    0.00238327   -0.01444401   -0.00545676
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H    2.31986685    2.24338593    0.17448598   -0.00508133    0.00939215    0.00491132
H    2.32627063   -2.02420823   -0.02942073   -0.00319895   -0.00245294   -0.00003480
C    2.36145264    0.05459569    0.03545601    0.00652687   -0.02337292   -0.01086175
H    3.44553908   -0.01064758    0.05620970   -0.00009448   -0.00082618   -0.00255264
   15
   -420.53164546
H   -2.55544343    0.62433066    0.14818677    0.02351940    0.01541570    0.00055975
O   -1.92415364    1.31814883   -0.05046677   -0.03058396    0.00420413   -0.00191755
O   -2.02874711   -1.35480246    0.10859796   -0.00977755   -0.01317150    0.00318892
C   -0.72069849    0.64892432   -0.00562891    0.01507238   -0.01730343    0.00281093
C   -0.89377998   -0.84464807   -0.00011678   -0.02519764   -0.00074841    0.00070488
C    0.38147385    1.51389300   -0.01359774    0.02604616    0.01663266    0.00575012
C    0.35824110   -1.59034030   -0.16804974    0.01427664   -0.01370166   -0.01302901
C    1.75396296    1.30922633    0.06930761   -0.01199174    0.01028508    0.00007519
C    1.65697242   -1.15700786   -0.00033618   -0.01272854    0.02038043    0.01724729
H    0.05910513    2.52144325   -0.16840997    0.00330656   -0.01502574   -0.00564374
H    0.29493887   -2.65809925   -0.31406301    0.01018806    0.00500504   -0.00127457
H    2.31998817    2.24173966    0.18122203   -0.00478471    0.00921371    0.00536862
H    2.32189489   -2.01747708   -0.03410371   -0.00522185    0.00015736   -0.00021233
C    2.36386558    0.05716991    0.03473460    0.01092986   -0.02000402   -0.01149216
H    3.44283433   -0.01564057    0.06647447   -0.00303801   -0.00130621   -0.00214092
   15
   -420.53105153
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C   -0.89457054   -0.84373099    0.00398458   -0.02647591    0.00075495    0.00260536
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   15
   -420.53097747
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O   -2.03123048   -1.34855530    0.10616116   -0.00898712   -0.01110453    0.00179156
C   -0.72286728    0.64288601   -0.00811989    0.01129771   -0.02122639    0.00051076
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C    0.37926073    1.50908785   -0.01142450    0.02417186    0.01330684    0.00808935
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C    1.75549728    1.30624339    0.06647791   -0.00995966    0.00737801   -0.00170675
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   15
   -420.53152449
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O   -2.03231713   -1.34523700    0.10490843   -0.00873205   -0.01018852    0.00114271
C   -0.72422166    0.64033433   -0.00938572    0.00983044   -0.02239593   -0.00067006
C   -0.89493886   -0.84194895    0.01204178   -0.02782091    0.00296935    0.00617081
C    0.37759843    1.50636642   -0.01051218    0.02262789    0.00913425    0.00934035
C    0.36235505   -1.58740319   -0.17020867    0.02364303   -0.01538525   -0.01508232
C    1.75649974    1.30457392    0.06509532   -0.00769717    0.00604144   -0.00236014
C    1.65064503   -1.15268483   -0.00173276   -0.01961847    0.00944672    0.01768246
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H    2.31564605   -1.99923645   -0.04784453   -0.00933518    0.00652673   -0.00049772
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   15
   -420.53237952
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O   -2.03330461   -1.34180306    0.10364270   -0.00860234   -0.00935148    0.00052704
C   -0.72572492    0.63812056   -0.01064142    0.00857114   -0.02298518   -0.00185067
C   -0.89449635   -0.84111742    0.01594375   -0.02781998    0.00364195    0.00780013
C    0.37559469    1.50350792   -0.00974099    0.02049834    0.00409123    0.01051805
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C    1.75761773    1.30281317    0.06374823   -0.00473674    0.00465640   -0.00285937
C    1.64908055   -1.15159759   -0.00273120   -0.02240917    0.00729342    0.01769165
H    0.07319814    2.53441415   -0.18130968    0.00238798   -0.00147630   -0.00801640
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H    2.32895178    2.22051992    0.19804105   -0.00484228    0.00320802    0.00592205
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C    2.37139751    0.06982415    0.03365726    0.01836144   -0.00030756   -0.01314853
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   15
   -420.53307116
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O   -2.03419436   -1.33826298    0.10237095   -0.00863369   -0.00857596   -0.00005600
C   -0.72735789    0.63625361   -0.01186915    0.00741297   -0.02300638   -0.00300495
C   -0.89363387   -0.84034058    0.01972793   -0.02727187    0.00401126    0.00930677
C    0.37328179    1.50058784   -0.00912859    0.01772344   -0.00117598    0.01150225
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C    1.75880670    1.30098220    0.06244421   -0.00125890    0.00311464   -0.00322450
C    1.64785516   -1.15062195   -0.00399708   -0.02540782    0.00624090    0.01765858
H    0.07541087    2.54032686   -0.18123706    0.00176137    0.00327522   -0.00862144
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H    2.31936641   -1.99219206   -0.05658124   -0.00847292    0.00693770   -0.00065887
C    2.37260964    0.07320452    0.03387120    0.01678950    0.00571609   -0.01348972
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   15
   -420.53331582
H   -2.60698150    0.61649559    0.14344426   -0.00461382   -0.00362450    0.00686620
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O   -2.03498601   -1.33462558    0.10109981   -0.00885256   -0.00785298   -0.00059791
C   -0.72910292    0.63473386   -0.01305153    0.00622339   -0.02248130   -0.00410836
C   -0.89235980   -0.83962403    0.02337155   -0.02612303    0.00406801    0.01068354
C    0.37070171    1.49768508   -0.00868976    0.01430929   -0.00609725    0.01220455
C    0.36330187   -1.58251402   -0.17033869    0.02854235   -0.00537543   -0.01521595
C    1.76001432    1.29910446    0.06118881    0.00252159    0.00130784   -0.00348256
C    1.64701404   -1.14974193   -0.00552990   -0.02844898    0.00626874    0.01759204
H    0.07730368    2.54565929   -0.17961531    0.00130790    0.00738668   -0.00902429
H    0.27974238   -2.65535340   -0.31216290    0.00756190    0.00127203   -0.00123665
H    2.33858377    2.20512360    0.20009793   -0.00484669   -0.00116538    0.00557716
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C    2.37356915    0.07649847    0.03428908    0.01420758    0.01183552   -0.01382373
H    3.44670000   -0.03727055    0.13350145   -0.00204494   -0.00486779    0.00091518
   15
   -420.53315523
H   -2.62283462    0.60973564    0.14074779   -0.01410078   -0.00994674    0.00870766
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O   -2.03567707   -1.33089906    0.09983542   -0.00928325   -0.00716497   -0.00109121
C   -0.73094182    0.63355339   -0.01417187    0.00485214   -0.02143715   -0.00514391
C   -0.89069152   -0.83896860    0.02685381   -0.02435011    0.00380905    0.01191772
C    0.36790595    1.49487360   -0.00843506    0.01033773   -0.01026098    0.01256825
C    0.36277901   -1.58064207   -0.16992059    0.02864446   -0.00098553   -0.01501762
C    1.76118372    1.29720739    0.05998597    0.00635599   -0.00084734   -0.00366493
C    1.64660276   -1.14895783   -0.00732866   -0.03123848    0.00722815    0.01748243
H    0.07895761    2.54967710   -0.17637286    0.00109394    0.01045634   -0.00916568
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H    2.34471011    2.19754230    0.19960228   -0.00452583   -0.00301143    0.00534795
H    2.32900949   -1.98994199   -0.06483970   -0.00466085    0.00408969   -0.00088162
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H    3.45039332   -0.03848410    0.14473388    0.00082284   -0.00551690    0.00165675
   15
   -420.53280467
H   -2.63618445    0.60473266    0.13649490   -0.02115772   -0.01400050    0.00976803
O   -1.90474594    1.29228071   -0.04900241    0.02780454    0.01962050   -0.00766024
O   -2.03626264   -1.32709124    0.09858335   -0.00992384   -0.00649569   -0.00154211
C   -0.73285372    0.63269647   -0.01521456    0.00319891   -0.01992269   -0.00609180
C   -0.88865583   -0.83837039    0.03015606   -0.02195027    0.00324101    0.01300755
C    0.36495441    1.49221599   -0.00836995    0.00593463   -0.01337954    0.01257116
C    0.36182419   -1.57875489   -0.16927544    0.02780332    0.00312752   -0.01479472
C    1.76225725    1.29532358    0.05883851    0.01000205   -0.00337575   -0.00380257
C    1.64666311   -1.14828378   -0.00939167   -0.03346750    0.00882733    0.01731445
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H    0.26236258   -2.66035847   -0.31013000    0.00519607   -0.00504043   -0.00189916
H    2.35164603    2.19049650    0.19814383   -0.00386411   -0.00439064    0.00512396
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C    2.37489268    0.08245956    0.03575679    0.00783264    0.02352420   -0.01440308
H    3.45393968   -0.03870610    0.15566753    0.00358085   -0.00602628    0.00242629
   15
   -420.53256838
H   -2.64576583    0.60221711    0.13049457   -0.02541827   -0.01577637    0.01003488
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O   -2.03673549   -1.32320974    0.09734873   -0.01075823   -0.00582306   -0.00194215
C   -0.73481354    0.63214026   -0.01616527    0.00119080   -0.01798809   -0.00694335
C   -0.88628894   -0.83782080    0.03326181   -0.01897275    0.00236863    0.01395550
C    0.36191347    1.48975921   -0.00849449    0.00125045   -0.01529457    0.01221701
C    0.36045019   -1.57691417   -0.16840659    0.02596053    0.00657022   -0.01458149
C    1.76318003    1.29349120    0.05774850    0.01325378   -0.00622049   -0.00391085
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H    2.35927192    2.18423290    0.19576274   -0.00282054   -0.00519744    0.00492048
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   15
   -420.53270224
H   -2.65081171    0.60250910    0.12269818   -0.02679509   -0.01533134    0.00957506
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O   -2.03708617   -1.31926219    0.09613611   -0.01174604   -0.00513713   -0.00230304
C   -0.73679088    0.63185560   -0.01701112   -0.00120298   -0.01570323   -0.00768716
C   -0.88363582   -0.83730667    0.03615673   -0.01548718    0.00120694    0.01476646
C    0.35885377    1.48753212   -0.00880334   -0.00355059   -0.01594149    0.01153520
C    0.35868491   -1.57517164   -0.16731719    0.02311343    0.00907205   -0.01441391
C    1.76390309    1.29175310    0.05671760    0.01596365   -0.00925155   -0.00399212
C    1.64831938   -1.14736651   -0.01429897   -0.03515954    0.01278116    0.01669932
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H    2.36740010    2.17889632    0.19249544   -0.00140139   -0.00540441    0.00474319
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C    2.37573591    0.08700938    0.03809351    0.00271017    0.03295146   -0.01456884
H    3.45871669   -0.03584220    0.17609536    0.00734657   -0.00649320    0.00380224
   15
   -420.53323669
H   -2.65107698    0.60553027    0.11318632   -0.02516378   -0.01275390    0.00850975
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O   -2.03730350   -1.31525641    0.09494956   -0.01283813   -0.00441415   -0.00262057
C   -0.73874962    0.63180806   -0.01774090   -0.00393506   -0.01315954   -0.00831231
C   -0.88074904   -0.83681045    0.03882855   -0.01159519   -0.00023290    0.01543908
C    0.35584770    1.48554455   -0.00928626   -0.00831386   -0.01536542    0.01057707
C    0.35657144   -1.57356498   -0.16600984    0.01929324    0.01049508   -0.01428006
C    1.76438555    1.29015486    0.05574703    0.01804847   -0.01226264   -0.00404508
C    1.64994039   -1.14718248   -0.01713398   -0.03425285    0.01462201    0.01621611
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H    0.22985947   -2.66038748   -0.30446792    0.00148560   -0.00940046   -0.00221662
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C    2.37607773    0.08857124    0.03959189    0.00140266    0.03629967   -0.01439854
H    3.45927545   -0.03267432    0.18534326    0.00792105   -0.00636416    0.00431729
   15
   -420.53402054
H   -2.64685559    0.61081534    0.10215054   -0.02048798   -0.00800419    0.00690150
O   -1.89812575    1.27611435   -0.04686994    0.03880839    0.00445330   -0.00411429
O   -2.03737519   -1.31120060    0.09379269   -0.01395285   -0.00365427   -0.00290088
C   -0.74064854    0.63195930   -0.01834514   -0.00692639   -0.01045984   -0.00881472
C   -0.87768729   -0.83631041    0.04126710   -0.00742510   -0.00192408    0.01597796
C    0.35296709    1.48378801   -0.00992880   -0.01288360   -0.01373538    0.00940403
C    0.35416737   -1.57211563   -0.16448654    0.01460765    0.01079029   -0.01417618
C    1.76459589    1.28874170    0.05483755    0.01949968   -0.01500125   -0.00404514
C    1.65207780   -1.14721904   -0.02021397   -0.03212298    0.01607790    0.01556690
H    0.08324918    2.53926303   -0.13675878    0.00393368    0.00547833   -0.00586324
H    0.21820002   -2.65721663   -0.30178894    0.00039877   -0.00877194   -0.00205618
H    2.38409138    2.17106191    0.18342885    0.00224631   -0.00435324    0.00441051
H    2.36003353   -1.99102103   -0.08247361    0.00562441   -0.00341222   -0.00098547
C    2.37639706    0.08958563    0.04130773    0.00115307    0.03852610   -0.01402117
H    3.45842258   -0.02836409    0.19381641    0.00749245   -0.00599583    0.00467086
   15
   -420.53478695
H   -2.63898959    0.61751142    0.08987769   -0.01282085   -0.00116537    0.00490080
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O   -2.03728867   -1.30710336    0.09266870   -0.01500388   -0.00285600   -0.00314698
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   15
   -420.53523531
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O   -2.03703210   -1.30297375    0.09158037   -0.01589832   -0.00202136   -0.00335230
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C   -0.87129237   -0.83519352    0.04541370    0.00116519   -0.00589217    0.01667597
C    0.34785261    1.48086022   -0.01162030   -0.02082072   -0.00877644    0.00673702
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C    1.76412101    1.28662689    0.05320076    0.02073087   -0.01864452   -0.00381820
C    1.65775536   -1.14803466   -0.02706705   -0.02444574    0.01751868    0.01375737
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   15
   -420.53518028
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O   -1.89752743    1.26339532   -0.04475386    0.01880748   -0.02595462    0.00188059
O   -2.03659541   -1.29882126    0.09053009   -0.01654909   -0.00115065   -0.00354142
C   -0.74553040    0.63319710   -0.01933894   -0.01582237   -0.00253133   -0.00951635
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C    0.34596777   -1.56867997   -0.15863540   -0.00285249    0.00608758   -0.01387071
C    1.76341693    1.28597988    0.05246998    0.02070407   -0.01916103   -0.00356814
C    1.66117991   -1.14883541   -0.03081276   -0.01926576    0.01741878    0.01258568
H    0.07840521    2.51874558   -0.09912520    0.00671356   -0.00773533   -0.00251842
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H    3.44900367   -0.00945094    0.21410518    0.00103644   -0.00360427    0.00472470
   15
   -420.53479367
H   -2.60913997    0.63244475    0.04930658    0.01843267    0.02510658   -0.00083521
O   -1.89787666    1.25957994   -0.04406101    0.01104255   -0.03558593    0.00322138
O   -2.03597129   -1.29465575    0.08951995   -0.01687213   -0.00024351   -0.00369173
C   -0.74673708    0.63373811   -0.01938544   -0.01810164   -0.00027749   -0.00948221
C   -0.86496380   -0.83371836    0.04855410    0.00896048   -0.01021117    0.01690495
C    0.34398415    1.47847092   -0.01371953   -0.02612490   -0.00536230    0.00412513
C    0.34319827   -1.56776049   -0.15626330   -0.00903313    0.00354003   -0.01362798
C    1.76240016    1.28562133    0.05179307    0.02039474   -0.01866477   -0.00323550
C    1.66489507   -1.14989894   -0.03474856   -0.01353256    0.01683861    0.01124758
H    0.07457596    2.51363496   -0.08541198    0.00708033   -0.01092082   -0.00159763
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H    2.40987903    2.16330574    0.15613015    0.00901176   -0.00087308    0.00319156
H    2.37103234   -1.98481938   -0.09363678    0.00394586    0.00129097    0.00005672
C    2.37729319    0.08776543    0.05018100    0.00933829    0.03577354   -0.01039946
H    3.44486198   -0.00162930    0.21914641   -0.00204035   -0.00254008    0.00448580
   15
   -420.53453061
H   -2.60329877    0.63049511    0.03567089    0.02435272    0.03015130   -0.00157918
O   -1.89835427    1.25616497   -0.04340398    0.00665916   -0.04163523    0.00376436
O   -2.03515614   -1.29048751    0.08855166   -0.01680258    0.00068886   -0.00380162
C   -0.74767087    0.63428374   -0.01928873   -0.01971871    0.00164589   -0.00932148
C   -0.86197381   -0.83276565    0.04974155    0.01214136   -0.01227316    0.01686047
C    0.34262385    1.47740946   -0.01487236   -0.02743592   -0.00571337    0.00293988
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C    1.76107524    1.28554372    0.05116498    0.01990624   -0.01715160   -0.00282542
C    1.66881453   -1.15121665   -0.03885424   -0.00756439    0.01591724    0.00975851
H    0.06948058    2.51046789   -0.07140877    0.00693059   -0.01249561   -0.00080811
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H    2.37155893   -1.98306069   -0.09631261    0.00227810    0.00364678    0.00041722
C    2.37726678    0.08589313    0.05283331    0.01229533    0.03259961   -0.00913290
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   15
   -420.53475426
H   -2.60175410    0.62318958    0.02230871    0.02429884    0.03027743   -0.00160552
O   -1.89891226    1.25321742   -0.04278894    0.00749532   -0.04242880    0.00353982
O   -2.03415078   -1.28632711    0.08762646   -0.01630107    0.00164756   -0.00387261
C   -0.74830745    0.63480496   -0.01905124   -0.02055789    0.00316620   -0.00903815
C   -0.85916655   -0.83162762    0.05067418    0.01464515   -0.01413821    0.01672081
C    0.34167717    1.47643654   -0.01606966   -0.02774516   -0.00785054    0.00179685
C    0.33815688   -1.56604730   -0.15090715   -0.02030950   -0.00062047   -0.01270767
C    1.75944947    1.28572428    0.05057955    0.01930632   -0.01469701   -0.00236725
C    1.67284852   -1.15277486   -0.04310731   -0.00172182    0.01487122    0.00814866
H    0.06314654    2.50952331   -0.05725845    0.00618358   -0.01219014   -0.00011156
H    0.15177940   -2.62028273   -0.28029277   -0.00342734    0.00818250    0.00043177
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H    2.37167740   -1.98195912   -0.09906361    0.00048876    0.00601435    0.00077437
C    2.37705508    0.08352874    0.05562368    0.01475845    0.02876738   -0.00784450
H    3.43819085    0.01518660    0.22685566   -0.00726103   -0.00033865    0.00398568
   15
   -420.53551612
H   -2.60449729    0.61050597    0.00922994    0.01833886    0.02542411   -0.00124985
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O   -2.03296091   -1.28218543    0.08674515   -0.01535467    0.00261889   -0.00389518
C   -0.74863424    0.63527891   -0.01867723   -0.02055524    0.00419214   -0.00864011
C   -0.85657977   -0.83027617    0.05135411    0.01637465   -0.01571218    0.01649449
C    0.34114875    1.47558429   -0.01729413   -0.02703445   -0.01162295    0.00064505
C    0.33605483   -1.56519170   -0.14793713   -0.02491256   -0.00142437   -0.01194451
C    1.75753187    1.28612606    0.05002989    0.01863854   -0.01142702   -0.00188722
C    1.67690915   -1.15455806   -0.04748349    0.00363942    0.01396083    0.00645341
H    0.05570799    2.51074691   -0.04308764    0.00485076   -0.01008214    0.00056136
H    0.14235433   -2.61605495   -0.27652602   -0.00394066    0.00987180    0.00069070
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H    2.37170528   -1.98193620   -0.10195371   -0.00116496    0.00807178    0.00110327
C    2.37662144    0.08073005    0.05853272    0.01626375    0.02442460   -0.00660195
H    3.43658932    0.02378674    0.22961228   -0.00855989    0.00068580    0.00385920
   15
   -420.53652481
H   -2.61048408    0.59329528   -0.00362299    0.00846159    0.01713641   -0.00094113
O   -1.90036293    1.24870134   -0.04167119    0.02244950   -0.02953462    0.00225751
O   -2.03159724   -1.27807349    0.08590797   -0.01398866    0.00360604   -0.00386126
C   -0.74865125    0.63569019   -0.01817272   -0.01972237    0.00462484   -0.00813394
C   -0.85423960   -0.82868759    0.05178473    0.01729763   -0.01692626    0.01619301
C    0.34102789    1.47490921   -0.01852826   -0.02535234   -0.01656329   -0.00056831
C    0.33432834   -1.56431599   -0.14478677   -0.02858878   -0.00104798   -0.01096586
C    1.75533258    1.28669987    0.04950878    0.01787790   -0.00752994   -0.00141790
C    1.68091571   -1.15655285   -0.05195719    0.00821292    0.01347216    0.00470990
H    0.04740305    2.51376557   -0.02901856    0.00304324   -0.00660095    0.00128051
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H    3.43651285    0.03226458    0.23167307   -0.00865688    0.00165518    0.00386936
   15
   -420.53731194
H   -2.61797894    0.57301694   -0.01630133   -0.00252338    0.00765062   -0.00097503
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O   -2.03007524   -1.27400245    0.08511453   -0.01224636    0.00458400   -0.00376812
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C   -0.85215995   -0.82684362    0.05197060    0.01740099   -0.01771657    0.01582672
C    0.34128932    1.47448514   -0.01975370   -0.02279894   -0.02197889   -0.00186971
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C    1.75286317    1.28738701    0.04900915    0.01697560   -0.00322149   -0.00098380
C    1.68479934   -1.15875212   -0.05650209    0.01176645    0.01362701    0.00295712
H    0.03855470    2.51796215   -0.01518135    0.00094830   -0.00237059    0.00208621
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C    2.37501623    0.07409706    0.06463354    0.01560122    0.01480644   -0.00442319
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   15
   -420.53768588
H   -2.62503637    0.55135161   -0.02879817   -0.01237644   -0.00119290   -0.00141820
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O   -2.02841459   -1.26998341    0.08436379   -0.01021126    0.00555486   -0.00361872
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C   -0.85034246   -0.82473235    0.05191725    0.01672463   -0.01803714    0.01540415
C    0.34189456    1.47439308   -0.02095076   -0.01950248   -0.02714454   -0.00325540
C    0.33220854   -1.56254518   -0.13800718   -0.03288147    0.00312308   -0.00844297
C    1.75013740    1.28812267    0.04852448    0.01582833    0.00125154   -0.00061643
C    1.68850643   -1.16115831   -0.06109171    0.01419397    0.01451261    0.00121723
H    0.02953750    2.52258466   -0.00172106   -0.00125380    0.00192831    0.00298239
H    0.11878387   -2.61401318   -0.26598937   -0.00600070    0.00746480    0.00046829
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C    2.37385467    0.07040783    0.06779230    0.01348826    0.00978851   -0.00345842
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   15
   -420.53768162
H   -2.62990149    0.52987619   -0.04103497   -0.01979880   -0.00834258   -0.00218660
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O   -2.02663829   -1.26602736    0.08365404   -0.00798871    0.00650103   -0.00341553
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C   -0.84877697   -0.82234897    0.05163105    0.01533398   -0.01785458    0.01493133
C    0.34279393    1.47471034   -0.02209854   -0.01559465   -0.03143004   -0.00468509
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C    1.74717271    1.28883952    0.04804923    0.01432604    0.00562889   -0.00033228
C    1.69200025   -1.16378476   -0.06569979    0.01552811    0.01609366   -0.00048378
H    0.02074495    2.52686767    0.01120142   -0.00337470    0.00570595    0.00393944
H    0.11290763   -2.61640231   -0.26268761   -0.00681574    0.00466966    0.00012588
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C    2.37249002    0.06657064    0.07100333    0.01061178    0.00476561   -0.00250807
H    3.44451062    0.05529323    0.23353489   -0.00226846    0.00415994    0.00460915
   15
   -420.53753085
H   -2.63124407    0.50987340   -0.05287562   -0.02434572   -0.01346994   -0.00313286
O   -1.90705688    1.24277223   -0.03974314    0.04567868    0.00486265    0.00282602
O   -2.02477143   -1.26214506    0.08298300   -0.00569568    0.00743244   -0.00316904
C   -0.74601857    0.63673329   -0.01502316   -0.01102900   -0.00048888   -0.00528123
C   -0.84744256   -0.81969625    0.05111917    0.01331617   -0.01715541    0.01441081
C    0.34392848    1.47550118   -0.02317549   -0.01120342   -0.03437787   -0.00610580
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C    1.74399200    1.28947170    0.04757911    0.01234492    0.00965461   -0.00014226
C    1.69526044   -1.16665512   -0.07030059    0.01593134    0.01816589   -0.00213980
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H    2.38771596    2.16117721    0.08118955    0.00376436   -0.00526909   -0.00161997
H    2.37763753   -2.00616587   -0.12019368   -0.00100648    0.00607839    0.00181582
C    2.37096537    0.06266127    0.07425221    0.00736381   -0.00012925   -0.00151298
H    3.44864791    0.06166518    0.23256810    0.00102166    0.00489492    0.00489884
   15
   -420.53746421
H   -2.62824458    0.49226680   -0.06415195   -0.02604640   -0.01659725   -0.00410301
O   -1.90993059    1.24136436   -0.03932993    0.04442853    0.00952544    0.00338179
O   -2.02283993   -1.25834704    0.08234787   -0.00345408    0.00833642   -0.00288558
C   -0.74484992    0.63694027   -0.01400683   -0.00857338   -0.00333036   -0.00443939
C   -0.84630884   -0.81678476    0.05038945    0.01077884   -0.01593481    0.01384157
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C    1.69828057   -1.16980034   -0.07486910    0.01564685    0.02041346   -0.00375016
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   15
   -420.53764018
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O   -2.02086908   -1.25464355    0.08174546   -0.00138827    0.00920982   -0.00257796
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C   -0.84533763   -0.81363297    0.04945052    0.00784918   -0.01420679    0.01322382
C    0.34663313    1.47865622   -0.02503247   -0.00157246   -0.03529321   -0.00866007
C    0.33391636   -1.55999089   -0.12309674   -0.03121818    0.01543159   -0.00268211
C    1.73711135    1.29024826    0.04664419    0.00663145    0.01581437   -0.00003666
C    1.70106463   -1.17325396   -0.07938096    0.01494267    0.02247120   -0.00531971
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H    2.38214275   -2.02519187   -0.12968408    0.00214936    0.00054396    0.00171518
C    2.36762888    0.05491739    0.08080145    0.00154954   -0.00901344    0.00085416
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   15
   -420.53808971
H   -2.60846815    0.46616187   -0.08433208   -0.02160512   -0.01726885   -0.00569264
O   -1.91714119    1.23819751   -0.03862382    0.03484245    0.01330641    0.00421778
O   -2.01888224   -1.25104449    0.08117226    0.00040748    0.01004192   -0.00225033
C   -0.74215574    0.63755636   -0.01178585   -0.00455221   -0.01020340   -0.00271839
C   -0.84448476   -0.81026693    0.04831173    0.00465382   -0.01200812    0.01254575
C    0.34805799    1.48103407   -0.02577400    0.00334929   -0.03312366   -0.00968719
C    0.33556283   -1.55982784   -0.11921418   -0.02943117    0.01706842   -0.00142179
C    1.73349776    1.29029981    0.04617777    0.00290421    0.01769655   -0.00010364
C    1.70362297   -1.17704668   -0.08381243    0.01406208    0.02399128   -0.00685568
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H    2.36176268    2.17155146    0.05478436    0.00022529   -0.00412451   -0.00308699
H    2.38396127   -2.03510954   -0.13489785    0.00355190   -0.00215031    0.00163820
C    2.36590411    0.05121687    0.08406593   -0.00031426   -0.01273765    0.00230114
H    3.45780978    0.07504262    0.22426867    0.00863893    0.00654894    0.00503007
   15
   -420.53869560
H   -2.59248443    0.45778456   -0.09295268   -0.01586170   -0.01486919   -0.00611671
O   -1.92136993    1.23639569   -0.03834027    0.02714764    0.01230827    0.00435593
O   -2.01689972   -1.24755929    0.08062458    0.00185877    0.01082375   -0.00191383
C   -0.74069086    0.63806907   -0.01060720   -0.00310068   -0.01397190   -0.00186480
C   -0.84370209   -0.80671984    0.04698333    0.00132587   -0.00939522    0.01180563
C    0.34943243    1.48391076   -0.02636933    0.00808253   -0.02932951   -0.01049114
C    0.33765393   -1.55992158   -0.11530996   -0.02734314    0.01765553   -0.00029983
C    1.72984080    1.29008480    0.04571299   -0.00126412    0.01875148   -0.00023083
C    1.70596867   -1.18120112   -0.08814027    0.01320269    0.02466458   -0.00837331
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H    2.35278474    2.17667197    0.04698271   -0.00043310   -0.00264287   -0.00351131
H    2.38514608   -2.04464648   -0.14040650    0.00455725   -0.00440391    0.00155900
C    2.36418288    0.04770818    0.08729538   -0.00119235   -0.01582925    0.00394082
H    3.45826420    0.07725898    0.21967667    0.00949116    0.00681634    0.00474195
   15
   -420.53929632
H   -2.57367241    0.45205638   -0.10047723   -0.00817118   -0.01059653   -0.00619018
O   -1.92590525    1.23445602   -0.03810587    0.01793377    0.00932603    0.00422526
O   -2.01493792   -1.24419681    0.08009860    0.00291891    0.01154208   -0.00157076
C   -0.73917869    0.63879308   -0.00940031   -0.00197476   -0.01778731   -0.00103568
C   -0.84293945   -0.80303110    0.04547651   -0.00201357   -0.00644440    0.01099607
C    0.35068509    1.48722918   -0.02680636    0.01242733   -0.02413422   -0.01104335
C    0.34015818   -1.56028092   -0.11140102   -0.02503056    0.01713975    0.00067358
C    1.72620323    1.28958718    0.04525176   -0.00567532    0.01906727   -0.00040181
C    1.70811456   -1.18572721   -0.09234153    0.01249837    0.02428302   -0.00988011
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H    0.10683992   -2.63032133   -0.24109135   -0.00780243   -0.00703374   -0.00141115
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H    2.38551827   -2.05340005   -0.14619600    0.00503200   -0.00601673    0.00148990
C    2.36247842    0.04443793    0.09046505   -0.00100927   -0.01818606    0.00575439
H    3.45702555    0.07825076    0.21423382    0.00927471    0.00691029    0.00427941
   15
   -420.53960516
H   -2.55340959    0.44821102   -0.10689196    0.00093076   -0.00461687   -0.00592406
O   -1.93064306    1.23241228   -0.03791912    0.00767458    0.00447302    0.00381006
O   -2.01300889   -1.24096517    0.07959044    0.00358751    0.01217344   -0.00122289
C   -0.73763642    0.63978591   -0.00817773   -0.00103830   -0.02150602   -0.00024134
C   -0.84214646   -0.79924522    0.04380353   -0.00526700   -0.00324893    0.01011672
C    0.35175050    1.49091123   -0.02707671    0.01623077   -0.01791239   -0.01135002
C    0.34304067   -1.56089807   -0.10750208   -0.02254053    0.01555899    0.00150393
C    1.72265148    1.28880200    0.04479664   -0.01009614    0.01878304   -0.00061205
C    1.71007120   -1.19061901   -0.09639341    0.01201851    0.02271654   -0.01137823
H   -0.01078699    2.51666579    0.07324072   -0.00655995   -0.00197371    0.00803730
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H    2.33513528    2.18798731    0.03334657   -0.00122031    0.00134965   -0.00428254
H    2.38499307   -2.06108140   -0.15225396    0.00491356   -0.00687261    0.00143851
C    2.36078796    0.04144171    0.09354754    0.00022999   -0.01975846    0.00771195
H    3.45413242    0.07800254    0.20802256    0.00800812    0.00679581    0.00368458
   15
   -420.53946592
H   -2.53332180    0.44517986   -0.11224452    0.01054212    0.00250235   -0.00536112
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O   -2.01112022   -1.23787152    0.07909614    0.00388109    0.01269376   -0.00086119
C   -0.73607843    0.64110361   -0.00695143   -0.00010992   -0.02497972    0.00050662
C   -0.84127399   -0.79541037    0.04197768   -0.00837020    0.00008742    0.00916579
C    0.35257133    1.49486348   -0.02717572    0.01936911   -0.01118956   -0.01143253
C    0.34626374   -1.56174937   -0.10362569   -0.01987669    0.01308035    0.00219987
C    1.71925208    1.28773332    0.04435081   -0.01426058    0.01807476   -0.00085355
C    1.71184582   -1.19585282   -0.10027329    0.01178042    0.01993545   -0.01286595
H   -0.01000507    2.51190161    0.07674827   -0.00524945   -0.00707084    0.00790172
H    0.11637988   -2.62700139   -0.23217442   -0.00572770   -0.00400172   -0.00112202
H    2.32660855    2.19346831    0.02765079   -0.00154364    0.00349593   -0.00462041
H    2.38359210   -2.06753708   -0.15857133    0.00418319   -0.00692705    0.00141017
C    2.35909291    0.03874323    0.09651331    0.00238791   -0.02050579    0.00976871
H    3.44981113    0.07653390    0.20114942    0.00581009    0.00649387    0.00299305
   15
   -420.53890413
H   -2.51512088    0.44169832   -0.11663409    0.01939140    0.00958723   -0.00464141
O   -1.94026044    1.22824504   -0.03766704   -0.01258902   -0.00799602    0.00234814
O   -2.00927528   -1.23492174    0.07861158    0.00384461    0.01307301   -0.00047507
C   -0.73451904    0.64279850   -0.00573275    0.00104161   -0.02805248    0.00121389
C   -0.84027522   -0.79157687    0.04001333   -0.01128718    0.00345034    0.00814920
C    0.35310017    1.49898515   -0.02710207    0.02180945   -0.00466492   -0.01134871
C    0.34978711   -1.56279764   -0.09978242   -0.01702761    0.00993552    0.00278392
C    1.71606767    1.28639165    0.04391791   -0.01791412    0.01710631   -0.00112456
C    1.71344207   -1.20138663   -0.10395865    0.01175469    0.01598897   -0.01434821
H   -0.00827999    2.50840763    0.07883530   -0.00383344   -0.01197161    0.00764556
H    0.12279769   -2.62410009   -0.22739695   -0.00431980   -0.00131540   -0.00083844
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H    2.38144610   -2.07275720   -0.16514298    0.00289168   -0.00620033    0.00140761
C    2.35736099    0.03635381    0.09933131    0.00520147   -0.02043664    0.01186781
H    3.44445382    0.07389890    0.19373752    0.00291514    0.00601275    0.00225879
   15
   -420.53814393
H   -2.50037848    0.43651526   -0.12018607    0.02601811    0.01498851   -0.00402248
O   -1.94491238    1.22626041   -0.03758543   -0.02020726   -0.01281636    0.00164917
O   -2.00747368   -1.23212008    0.07813238    0.00352237    0.01328235   -0.00005393
C   -0.73297594    0.64491685   -0.00453236    0.00264586   -0.03056182    0.00188150
C   -0.83910604   -0.78779542    0.03792585   -0.01400067    0.00672639    0.00706845
C    0.35330004    1.50317849   -0.02685695    0.02360295    0.00090226   -0.01117440
C    0.35356765   -1.56399576   -0.09598114   -0.01394132    0.00648751    0.00329468
C    1.71315322    1.28479143    0.04350205   -0.02083160    0.01603862   -0.00142961
C    1.71486041   -1.20716101   -0.10742710    0.01185652    0.01104679   -0.01580588
H   -0.00586274    2.50705576    0.07954628   -0.00255800   -0.01596310    0.00735941
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H    2.37878576   -2.07687121   -0.17196816    0.00114374   -0.00480294    0.00142413
C    2.35555006    0.03427244    0.10196991    0.00831329   -0.01958487    0.01394938
H    3.43857702    0.07018383    0.18591897   -0.00034522    0.00538198    0.00152507
   15
   -420.53754997
H   -2.49027092    0.42868267   -0.12300770    0.02926015    0.01709730   -0.00376782
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O   -2.00571181   -1.22946893    0.07765375    0.00295760    0.01330808    0.00040984
C   -0.73147366    0.64749644   -0.00336038    0.00489734   -0.03236770    0.00252046
C   -0.83772547   -0.78411541    0.03573158   -0.01648700    0.00980421    0.00592621
C    0.35314374    1.50736025   -0.02644290    0.02482051    0.00477485   -0.01098459
C    0.35755866   -1.56529205   -0.09222962   -0.01057672    0.00314191    0.00376903
C    1.71055264    1.28294869    0.04310785   -0.02285310    0.01498098   -0.00176839
C    1.71609952   -1.21310154   -0.11065663    0.01194791    0.00536301   -0.01722028
H   -0.00297928    2.50855463    0.07893168   -0.00166055   -0.01836859    0.00711602
H    0.13768014   -2.61815389   -0.21744995   -0.00114628    0.00485373   -0.00017855
H    2.30302468    2.20479866    0.01574918   -0.00325958    0.00826192   -0.00531022
H    2.37592389   -2.08012796   -0.17905011   -0.00091195   -0.00292908    0.00146307
C    2.35361362    0.03248632    0.10439781    0.01125803   -0.01801728    0.01591709
H    3.43276241    0.06550165    0.17782512   -0.00356631    0.00462963    0.00083947
   15
   -420.53738107
H   -2.48537556    0.41783112   -0.12514358    0.02871159    0.01519313   -0.00400596
O   -1.95348647    1.22273783   -0.03747476   -0.02579253   -0.01249475    0.00130686
O   -2.00398330   -1.22696855    0.07717044    0.00217938    0.01313712    0.00092306
C   -0.73004631    0.65056440   -0.00222648    0.00788444   -0.03334275    0.00314248
C   -0.83609594   -0.78058328    0.03344777   -0.01870821    0.01258084    0.00472480
C    0.35261282    1.51147250   -0.02586274    0.02551974    0.00644253   -0.01082615
C    0.36170916   -1.56663658   -0.08853511   -0.00687109    0.00039659    0.00426111
C    1.70829638    1.28087935    0.04274043   -0.02387599    0.01400688   -0.00213949
C    1.71715820   -1.21912269   -0.11362588    0.01186725   -0.00071574   -0.01855525
H    0.00021154    2.51333073    0.07703454   -0.00131199   -0.01873168    0.00696843
H    0.14557646   -2.61620763   -0.21239797    0.00041497    0.00749759    0.00010439
H    2.29617299    2.20592108    0.01364824   -0.00422107    0.00887956   -0.00539464
H    2.37322752   -2.08286063   -0.18639549   -0.00305700   -0.00085096    0.00149456
C    2.35150777    0.03097183    0.10658523    0.01352448   -0.01582173    0.01774691
H    3.42758246    0.05998719    0.16957904   -0.00626930    0.00379457    0.00023300
   15
   -420.53765467
H   -2.48560017    0.40429523   -0.12655224    0.02487110    0.00977170   -0.00469200
O   -1.95734503    1.22119598   -0.03744196   -0.02398926   -0.00714191    0.00175656
O   -2.00227932   -1.22461703    0.07667661    0.00119409    0.01278728    0.00148068
C   -0.72873903    0.65413540   -0.00114008    0.01157557   -0.03341172    0.00374902
C   -0.83418399   -0.77724086    0.03109259   -0.02057694    0.01495445    0.00347111
C    0.35169668    1.51549023   -0.02511884    0.02570066    0.00574883   -0.01070539
C    0.36596311   -1.56798839   -0.08490511   -0.00281658   -0.00130981    0.00481535
C    1.70639986    1.27859806    0.04240539   -0.02386199    0.01315297   -0.00254132
C    1.71803791   -1.22513306   -0.11631474    0.01141496   -0.00675978   -0.01976171
H    0.00364693    2.52144750    0.07388136   -0.00153591   -0.01692985    0.00692185
H    0.15340103   -2.61559866   -0.20736375    0.00179704    0.00927862    0.00030090
H    2.29008412    2.20545338    0.01251726   -0.00537316    0.00891339   -0.00539631
H    2.37107925   -2.08543844   -0.19400986   -0.00503665    0.00111758    0.00150687
C    2.34919881    0.02969595    0.10850454    0.01466380   -0.01312003    0.01939012
H    3.42351739    0.05379039    0.16128960   -0.00802847    0.00290043   -0.00027884
   15
   -420.53814108
H   -2.49027079    0.38902933   -0.12711214    0.01886532    0.00231416   -0.00565349
O   -1.96093315    1.21973341   -0.03742928   -0.02035490    0.00005389    0.00242904
O   -2.00058871   -1.22241041    0.07616597   -0.00000192    0.01227689    0.00206466
C   -0.72760747    0.65821043   -0.00011034    0.01582148   -0.03254113    0.00434223
C   -0.83196150   -0.77412396    0.02868498   -0.02197527    0.01684968    0.00217088
C    0.35039267    1.51942360   -0.02421308    0.02528408    0.00294361   -0.01057419
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   15
   -420.53862617
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   15
   -420.53895376
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   15
   -420.53907783
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   15
   -420.53908896
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O   -1.99364539   -1.21490110    0.07382338   -0.00743345    0.00957406    0.00423742
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   15
   -420.53909983
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   15
   -420.53928904
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O   -1.98975886   -1.21183039    0.07238795   -0.01281919    0.00850969    0.00494296
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   15
   -420.53971055
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O   -1.98761319   -1.21044266    0.07158801   -0.01575412    0.00814858    0.00517204
C   -0.72989050    0.69815879    0.00483286    0.03599372   -0.00629881    0.00706178
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   15
   -420.54039727
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C   -0.73221692    0.70480626    0.00514419    0.03458672   -0.00133227    0.00712389
C   -0.80270505   -0.75911274    0.00997606   -0.00728255    0.01489255   -0.00874766
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   15
   -420.54120388
H   -2.56001958    0.34936618   -0.07496408   -0.00942876   -0.01304814   -0.00464272
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   15
   -420.54193606
H   -2.55992879    0.36159381   -0.06323656   -0.00520618   -0.00599307   -0.00354294
O   -1.99063737    1.19764981   -0.03927390   -0.00319212   -0.00745566    0.00043199
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C   -0.73839260    0.71808974    0.00544460    0.02793044    0.00797268    0.00696581
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C    2.31782688    0.01754544    0.10685645   -0.01514255    0.01936609    0.02528405
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   15
   -420.54234843
H   -2.55892027    0.37487796   -0.05086794    0.00032747    0.00261968   -0.00259141
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O   -1.97692039   -1.20579732    0.06778810   -0.02603865    0.00789773    0.00543830
C   -0.74214161    0.72458531    0.00543603    0.02299409    0.01207208    0.00675611
C   -0.78863480   -0.75758383    0.00457126    0.00568889    0.00913793   -0.01219727
C    0.32005702    1.57298099   -0.00584615   -0.01597330   -0.00830490    0.00058203
C    0.40281804   -1.59080387   -0.05010437    0.02552254    0.01681888    0.01104903
C    1.70139767    1.24036809    0.04327924    0.00578946   -0.00989460   -0.00773997
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H    2.33928710    2.12424883    0.06338935   -0.00297124    0.00322391   -0.00139811
H    2.41465386   -2.12080467   -0.28970672    0.00436142   -0.00860254   -0.00454924
C    2.31570355    0.01539349    0.10442498   -0.01388273    0.01996639    0.02465830
H    3.41178646   -0.01477046    0.08352696    0.00487618   -0.00572150   -0.00353717
   15
   -420.54229405
H   -2.55798083    0.38768278   -0.03802838    0.00642406    0.01184041   -0.00189303
O   -1.99617769    1.19231263   -0.03991632   -0.00984814   -0.02942776   -0.00030910
O   -1.97357366   -1.20485889    0.06668431   -0.02745467    0.00810081    0.00538252
C   -0.74623741    0.73089894    0.00532541    0.01731438    0.01569654    0.00647131
C   -0.78403014   -0.75739149    0.00311654    0.00953215    0.00693166   -0.01312007
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   15
   -420.54184746
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   15
   -420.54126956
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   15
   -420.54084947
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   15
   -420.54070736
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C   -0.76749034   -0.75732294   -0.00061534    0.01829075   -0.00220224   -0.01522107
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   15
   -420.54068848
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O   -1.95216371   -1.20163061    0.06028290   -0.02261581    0.01059918    0.00427321
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C    2.30600270   -0.00343575    0.08255457   -0.00028477    0.00956486    0.01699073
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   15
   -420.54054870
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O   -1.94702337   -1.20131748    0.05884367   -0.01928828    0.01135016    0.00384519
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C    1.73559211   -1.28699317   -0.11096450    0.01390016   -0.00989202   -0.00804951
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   15
   -420.54015828
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O   -1.94166476   -1.20113319    0.05736088   -0.01537929    0.01215948    0.00334889
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   15
   -420.53944545
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O   -1.93613208   -1.20108689    0.05584017   -0.01103353    0.01296922    0.00279296
C   -0.78075672    0.76999884    0.00143878   -0.02600108    0.02474176    0.00285275
C   -0.75512546   -0.75675114   -0.00072288    0.01516505   -0.00995551   -0.01450524
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C    0.40034454   -1.62368102   -0.03838538    0.00373449   -0.00818483    0.00807291
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C    2.30172692   -0.01526586    0.06786077   -0.00507785   -0.00325483    0.01130856
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   15
   -420.53845329
H   -2.61568772    0.35635775    0.08201147   -0.02061352   -0.00966807    0.00685672
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O   -1.93047448   -1.20118774    0.05428780   -0.00641036    0.01377118    0.00219929
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C   -0.75265892   -0.75630007   -0.00018880    0.01307652   -0.01146888   -0.01392670
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C    0.39941248   -1.62698316   -0.03776168    0.00299184   -0.00715203    0.00772464
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   15
   -420.53743693
H   -2.61704577    0.34736946    0.09263750   -0.02278312   -0.01280177    0.00816486
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C   -0.78689320    0.77605418   -0.00011117   -0.03237065    0.02133516    0.00197970
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C    0.39843500   -1.63017737   -0.03725472    0.00242285   -0.00597404    0.00733412
C    1.69210996    1.21710937    0.05808666    0.01277307   -0.00538623   -0.00717205
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H    3.39062724    0.01561574    0.07719346    0.00234699    0.00152904   -0.00025440
   15
   -420.53657017
H   -2.61433178    0.34066248    0.10179849   -0.02291184   -0.01432373    0.00914175
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O   -1.91899488   -1.20186658    0.05111527    0.00299027    0.01522301    0.00096065
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C   -0.74828214   -0.75485915    0.00149984    0.00816383   -0.01379126   -0.01238572
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C    1.73865519   -1.29042940   -0.09792421    0.01713823    0.01508957    0.00060532
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H    2.45424562   -2.08522099   -0.29746089    0.00191008    0.00442822   -0.00596256
C    2.29818408   -0.02662724    0.05163568   -0.01339081   -0.01819658    0.00500018
H    3.39406923    0.02009432    0.07840068    0.00554459    0.00257177    0.00028021
   15
   -420.53599653
H   -2.60752069    0.33651233    0.10931951   -0.02112554   -0.01432028    0.00971959
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O   -1.91327922   -1.20246104    0.04950912    0.00744572    0.01584111    0.00035858
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C   -0.74629795   -0.75383426    0.00263113    0.00560282   -0.01455717   -0.01144753
C    0.31142259    1.64533406    0.01368203   -0.00767120    0.00800899    0.01388841
C    0.39637837   -1.63630752   -0.03656656    0.00122693   -0.00470219    0.00638785
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   15
   -420.53577353
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O   -1.90764773   -1.20323505    0.04789887    0.01157285    0.01632504   -0.00021725
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   15
   -420.53583818
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   15
   -420.53604286
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O   -1.89681923   -1.20534192    0.04469176    0.01845677    0.01680252   -0.00124723
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C    1.73653595   -1.29665645   -0.08744437    0.01284182    0.03028563    0.00553781
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H    2.46777625   -2.09992259   -0.26991969    0.00814575   -0.00129262   -0.00680038
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   15
   -420.53619577
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O   -1.89170020   -1.20668014    0.04310656    0.02110763    0.01671906   -0.00169886
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C    1.67875654    1.21112077    0.07194353    0.00107155   -0.00159889   -0.00137701
C    1.73548288   -1.29925490   -0.08499750    0.01216194    0.03064736    0.00597629
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H    2.46801277   -2.10349992   -0.25999337    0.00831594   -0.00145926   -0.00651021
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H    3.39074648    0.03264590    0.08192983    0.00652798    0.00536386    0.00228513
   15
   -420.53614504
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O   -1.88682010   -1.20820778    0.04154061    0.02320438    0.01638258   -0.00211500
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C    0.39120603   -1.65002634   -0.03637373   -0.00529836   -0.01544824    0.00316779
C    1.67622728    1.21019025    0.07441633   -0.00236981   -0.00274283   -0.00029175
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C    2.29635567   -0.04046606    0.01792440   -0.00364784   -0.03398317   -0.00546868
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   15
   -420.53593824
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O   -2.05303528    1.20237158   -0.04118094   -0.01938053   -0.01449485   -0.00363781
O   -1.88220270   -1.20992095    0.03999863    0.02474849    0.01574589   -0.00250270
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C   -0.73500369   -0.74297710    0.01246294   -0.00477261   -0.01287408   -0.00417277
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C    1.67373376    1.20930147    0.07689348   -0.00574440   -0.00411244    0.00083426
C    1.73283164   -1.30581734   -0.08037575    0.01136406    0.02663521    0.00597976
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C    2.29654554   -0.04109085    0.01246106    0.00161087   -0.03315440   -0.00662806
H    3.38007113    0.03136850    0.08088769   -0.00003905    0.00493972    0.00242967
   15
   -420.53567380
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O   -2.05706051    1.20427571   -0.04069488   -0.02657920   -0.01617608   -0.00284532
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C    0.31918182    1.67123330    0.01252697    0.01158014    0.04407565    0.00784842
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C    1.67132678    1.20847495    0.07935796   -0.00885512   -0.00556191    0.00200236
C    1.73124572   -1.30972105   -0.07820107    0.01107120    0.02254124    0.00565677
H    0.14017523    2.71889681   -0.13924484    0.00176045   -0.00952635   -0.00605813
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H    2.46026207   -2.11313187   -0.22358026    0.00510414    0.00144567   -0.00458720
C    2.29671081   -0.04121551    0.00709773    0.00704115   -0.03134811   -0.00764008
H    3.37442810    0.02937153    0.07971409   -0.00379074    0.00445627    0.00236875
   15
   -420.53555817
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O   -1.87382029   -1.21387096    0.03700408    0.02628240    0.01346915   -0.00324391
C   -0.78486487    0.79382919   -0.00891432   -0.02843743   -0.00550230   -0.00054158
C   -0.73087257   -0.73769363    0.01645389   -0.00526429   -0.00995669   -0.00129773
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C    0.38887630   -1.65577838   -0.03691434   -0.00927814   -0.02706166    0.00106968
C    1.66905315    1.20773244    0.08179212   -0.01152964   -0.00694677    0.00321254
C    1.72949255   -1.31396429   -0.07611181    0.01066052    0.01740016    0.00521984
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H    2.45549783   -2.11655332   -0.20961497    0.00317430    0.00312556   -0.00374518
C    2.29677013   -0.04086721    0.00184977    0.01204569   -0.02869388   -0.00854767
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   15
   -420.53572824
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O   -1.87007268   -1.21608207    0.03555992    0.02631254    0.01183596   -0.00360400
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C   -0.72868876   -0.73481450    0.01848975   -0.00494815   -0.00814492    0.00020272
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C    0.38835732   -1.65695271   -0.03714084   -0.00966884   -0.02963017    0.00042604
C    1.66695318    1.20709477    0.08417765   -0.01365164   -0.00815446    0.00446114
C    1.72757858   -1.31846979   -0.07410141    0.00993891    0.01159447    0.00473420
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C    2.29664860   -0.04008590   -0.00326901    0.01601754   -0.02535877   -0.00940321
H    3.36577694    0.02308291    0.07610762   -0.00969331    0.00320129    0.00215811
   15
   -420.53611517
H   -2.49134545    0.33001291    0.10487113    0.01976741    0.01022876    0.00441154
O   -2.06711823    1.21099321   -0.03904715   -0.03675473   -0.00444112   -0.00345891
O   -1.86662313   -1.21842716    0.03415663    0.02588661    0.00989596   -0.00395204
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C    0.38798368   -1.65768068   -0.03737383   -0.00934828   -0.03084685   -0.00017072
C    1.66505887    1.20658004    0.08649569   -0.01515049   -0.00908346    0.00573886
C    1.72551492   -1.32315031   -0.07216261    0.00871783    0.00555158    0.00426042
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C    2.29628684   -0.03892187   -0.00824560    0.01843499   -0.02150428   -0.01025961
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   15
   -420.53661288
H   -2.49396004    0.31963315    0.09935139    0.01572121    0.00348059    0.00526489
O   -2.06966961    1.21342002   -0.03842722   -0.03699281    0.00373647   -0.00423642
O   -1.86346682   -1.22088425    0.03279816    0.02501960    0.00768014   -0.00428384
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C   -0.72410886   -0.72871755    0.02252910   -0.00310551   -0.00402826    0.00327103
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C    1.66339288    1.20620221    0.08872691   -0.01601413   -0.00967890    0.00703090
C    1.72332030   -1.32791500   -0.07028830    0.00681035   -0.00030059    0.00383976
H    0.12760427    2.72912035   -0.09351798   -0.00028209   -0.00616305   -0.00464192
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H    2.43919448   -2.13132587   -0.16427143   -0.00214643    0.00698425   -0.00137132
C    2.29564858   -0.03743310   -0.01306702    0.01903501   -0.01732128   -0.01114787
H    3.36379313    0.01449090    0.07093688   -0.01049317    0.00185360    0.00211587
   15
   -420.53693875
H   -2.49939530    0.30863421    0.09288495    0.01091786   -0.00376662    0.00603430
O   -2.07180198    1.21580436   -0.03775935   -0.03652070    0.01205556   -0.00490152
O   -1.86059392   -1.22342828    0.03148825    0.02372721    0.00526441   -0.00458876
C   -0.77057903    0.80095147   -0.01237062   -0.00056818   -0.00404731   -0.00176610
C   -0.72174073   -0.72556185    0.02448624   -0.00150202   -0.00182324    0.00480689
C    0.32046617    1.67287303    0.00773431    0.01619278    0.03299363    0.00315333
C    0.38764143   -1.65774877   -0.03782401   -0.00650099   -0.02854095   -0.00120794
C    1.66196829    1.20597028    0.09085184   -0.01626559   -0.00992169    0.00831796
C    1.72102366   -1.33267582   -0.06847214    0.00411717   -0.00559930    0.00349395
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   15
   -420.53690635
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O   -2.07352035    1.21805266   -0.03703611   -0.03575692    0.01951820   -0.00529121
O   -1.85798981   -1.22603191    0.03023036    0.02203634    0.00273154   -0.00485320
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C   -0.71935048   -0.72237865    0.02637073    0.00058785    0.00043389    0.00632490
C    0.32001997    1.67141024    0.00657844    0.01585427    0.02583112    0.00203210
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C    1.71866571   -1.33735293   -0.06670885    0.00064332   -0.01009591    0.00319859
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H    2.42962998   -2.14696107   -0.13256302   -0.00315492    0.00620062   -0.00012682
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H    3.36900777    0.00455949    0.06422348   -0.00549098    0.00052965    0.00238132
   15
   -420.53648388
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O   -2.07483311    1.22008096   -0.03625319   -0.03496951    0.02542269   -0.00532879
O   -1.85563534   -1.22866642    0.02902747    0.01998046    0.00014496   -0.00507383
C   -0.76292764    0.80492749   -0.01395841    0.01557438    0.00092600   -0.00241557
C   -0.71696971   -0.71920204    0.02815962    0.00316145    0.00270848    0.00780952
C    0.31933466    1.66955690    0.00539218    0.01494663    0.01857545    0.00067709
C    0.38768172   -1.65611727   -0.03820214   -0.00159176   -0.02106326   -0.00204629
C    1.65985057    1.20595351    0.09470548   -0.01522890   -0.00940465    0.01078156
C    1.71629877   -1.34187850   -0.06499397   -0.00345728   -0.01368363    0.00293145
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H    2.35186647    2.04475764    0.18793113   -0.00270773    0.00227270    0.00030098
H    2.42567041   -2.15650916   -0.11662047   -0.00264993    0.00456074    0.00043181
C    2.29211587   -0.03166286   -0.02646308    0.01127927   -0.00406305   -0.01397822
H    3.37335766   -0.00060869    0.06023769   -0.00166036   -0.00016076    0.00257831
   15
   -420.53572303
H   -2.52399904    0.28423305    0.06670591   -0.00257193   -0.02002929    0.00640453
O   -2.07574911    1.22182259   -0.03541015   -0.03426982    0.02950403   -0.00502423
O   -1.85350724   -1.23130258    0.02788210    0.01761379   -0.00241209   -0.00524436
C   -0.75939411    0.80691460   -0.01469995    0.02308461    0.00416991   -0.00270290
C   -0.71463723   -0.71606637    0.02983050    0.00615683    0.00497404    0.00924518
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C    0.38775739   -1.65479315   -0.03834787    0.00105005   -0.01644620   -0.00240769
C    1.65914210    1.20616107    0.09639697   -0.01419695   -0.00877227    0.01193036
C    1.71398458   -1.34619819   -0.06332340   -0.00793934   -0.01642004    0.00265602
H    0.11625011    2.75316741   -0.03460584   -0.00379476    0.01209128   -0.00262518
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H    2.34033017    2.05046421    0.18843805   -0.00501711    0.00186498   -0.00003309
H    2.42218050   -2.16686852   -0.10075580   -0.00163276    0.00226615    0.00099998
C    2.29052819   -0.02952724   -0.03052494    0.00705173    0.00020516   -0.01486420
H    3.37800408   -0.00574786    0.05578805    0.00233193   -0.00087545    0.00276048
   15
   -420.53477387
H   -2.53228025    0.28220773    0.05564613   -0.00564213   -0.02252631    0.00581667
O   -2.07627626    1.22323134   -0.03451039   -0.03372246    0.03169049   -0.00442804
O   -1.85157872   -1.23391146    0.02679617    0.01500885   -0.00484680   -0.00536752
C   -0.75620871    0.80883827   -0.01540067    0.02984999    0.00774701   -0.00295067
C   -0.71239826   -0.71300584    0.03136166    0.00950498    0.00719906    0.01062061
C    0.31731054    1.66510782    0.00301310    0.01141650    0.00597094   -0.00260273
C    0.38781747   -1.65322027   -0.03845723    0.00346148   -0.01191854   -0.00273983
C    1.65864807    1.20650113    0.09790818   -0.01300232   -0.00803192    0.01299290
C    1.71179050   -1.35027044   -0.06169293   -0.01246965   -0.01847411    0.00234145
H    0.11477596    2.75566379   -0.01839317   -0.00415843    0.01469851   -0.00167707
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H    2.32969348    2.05583608    0.18895042   -0.00712240    0.00141362   -0.00032921
H    2.41898031   -2.17763028   -0.08507162   -0.00033087   -0.00042277    0.00160070
C    2.28883374   -0.02739441   -0.03436221    0.00292373    0.00422966   -0.01565079
H    3.38223570   -0.01072942    0.05084233    0.00597073   -0.00160430    0.00288740
   15
   -420.53383825
H   -2.53956034    0.28421433    0.04354266   -0.00768711   -0.02343281    0.00495875
O   -2.07642068    1.22428235   -0.03356063   -0.03338741    0.03195834   -0.00359898
O   -1.84982033   -1.23646551    0.02577108    0.01226775   -0.00710810   -0.00544767
C   -0.75347346    0.81064458   -0.01605684    0.03565620    0.01151608   -0.00315279
C   -0.71030324   -0.71005409    0.03273232    0.01306561    0.00936762    0.01192747
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C    0.38782582   -1.65146658   -0.03852519    0.00541654   -0.00790258   -0.00305104
C    1.65835063    1.20696262    0.09922307   -0.01180502   -0.00731375    0.01394539
C    1.70978456   -1.35406392   -0.06009780   -0.01666880   -0.02007210    0.00197441
H    0.11404627    2.75553593   -0.00187973   -0.00419916    0.01579940   -0.00063476
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H    2.32033438    2.06095119    0.18952134   -0.00888375    0.00108809   -0.00056169
H    2.41583910   -2.18831478   -0.06967629    0.00100956   -0.00319722    0.00224644
C    2.28709440   -0.02532515   -0.03796302   -0.00067454    0.00793109   -0.01631176
H    3.38540333   -0.01542222    0.04537791    0.00884711   -0.00233733    0.00292530
   15
   -420.53311249
H   -2.54547281    0.29041623    0.03054967   -0.00859725   -0.02269430    0.00389912
O   -2.07618612    1.22497255   -0.03257019   -0.03334430    0.03029358   -0.00261279
O   -1.84820107   -1.23893919    0.02480776    0.00951425   -0.00913028   -0.00549313
C   -0.75127596    0.81227673   -0.01666539    0.04033632    0.01532653   -0.00330796
C   -0.70840585   -0.70724383    0.03392275    0.01669736    0.01143674    0.01315387
C    0.31460542    1.66027207    0.00079371    0.00602980   -0.00162802   -0.00630883
C    0.38775305   -1.64959235   -0.03854704    0.00675188   -0.00473973   -0.00334330
C    1.65823189    1.20753476    0.10032734   -0.01073893   -0.00670048    0.01476837
C    1.70802987   -1.35755421   -0.05853249   -0.02021995   -0.02144578    0.00156165
H    0.11406783    2.75258637    0.01474796   -0.00390318    0.01533702    0.00043130
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H    2.41251885   -2.19842655   -0.05468599    0.00216664   -0.00575652    0.00293027
C    2.28536420   -0.02337534   -0.04131742   -0.00340988    0.01123973   -0.01681527
H    3.38699386   -0.01969533    0.03938805    0.01064778   -0.00303454    0.00285870
   15
   -420.53265482
H   -2.54985550    0.30067829    0.01685635   -0.00825482   -0.02016939    0.00273167
O   -2.07557293    1.22532094   -0.03155017   -0.03372540    0.02659721   -0.00154325
O   -1.84668985   -1.24130957    0.02390673    0.00690181   -0.01089918   -0.00551354
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C   -0.70676083   -0.70460632    0.03491442    0.02024415    0.01337195    0.01428684
C    0.31309492    1.65786515   -0.00018707    0.00292260   -0.00311231   -0.00812985
C    0.38757907   -1.64764517   -0.03851836    0.00736896   -0.00263536   -0.00361807
C    1.65827577    1.20820842    0.10120850   -0.00987792   -0.00626731    0.01545934
C    1.70657973   -1.36072026   -0.05699076   -0.02283489   -0.02280498    0.00112202
H    0.11478857    2.74689925    0.03129938   -0.00331911    0.01329093    0.00144116
H    0.05541576   -2.69714933   -0.05827844   -0.00133280   -0.01024090   -0.00116304
H    2.30663077    2.07059261    0.19099450   -0.01096401    0.00129472   -0.00079215
H    2.40881503   -2.20750785   -0.04022342    0.00292133   -0.00786225    0.00362779
C    2.28368423   -0.02159493   -0.04441778   -0.00507535    0.01409350   -0.01716032
H    3.38668473   -0.02342323    0.03288506    0.01123884   -0.00367067    0.00268284
   15
   -420.53243932
H   -2.55277195    0.31454380    0.00267136   -0.00657091   -0.01571731    0.00154990
O   -2.07457669    1.22536960   -0.03051264   -0.03467390    0.02077390   -0.00048583
O   -1.84525717   -1.24355667    0.02306823    0.00458019   -0.01235671   -0.00551522
C   -0.74875798    0.81479046   -0.01773103    0.04591005    0.02248272   -0.00346742
C   -0.70542160   -0.70217076    0.03569020    0.02353033    0.01512751    0.01531766
C    0.31154027    1.65550335   -0.00104507   -0.00025320   -0.00304683   -0.00982948
C    0.38729460   -1.64565673   -0.03843500    0.00722681   -0.00169872   -0.00387625
C    1.65846929    1.20897709    0.10185609   -0.00926269   -0.00603588    0.01601214
C    1.70547353   -1.36354133   -0.05546600   -0.02435458   -0.02431046    0.00068282
H    0.11610062    2.73884049    0.04759319   -0.00241408    0.00981935    0.00234247
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H    2.30265842    2.07508095    0.19193704   -0.01117185    0.00192585   -0.00076337
H    2.40459288   -2.21518214   -0.02641372    0.00317275   -0.00933174    0.00430763
C    2.28207962   -0.02002702   -0.04725887   -0.00559518    0.01645447   -0.01734563
H    3.38437064   -0.02649163    0.02590058    0.01055364   -0.00421654    0.00240300
   15
   -420.53234742
H   -2.55452536    0.33121018   -0.01179448   -0.00355259   -0.00929541    0.00047882
O   -2.07318649    1.22518446   -0.02946950   -0.03630394    0.01289749    0.00045265
O   -1.84387686   -1.24566386    0.02229227    0.00271406   -0.01351675   -0.00549953
C   -0.74852174    0.81556416   -0.01818572    0.04673487    0.02556562   -0.00347311
C   -0.70443765   -0.69996365    0.03623451    0.02639725    0.01665641    0.01623694
C    0.30998938    1.65318593   -0.00175466   -0.00337903   -0.00163958   -0.01136193
C    0.38690174   -1.64364121   -0.03829304    0.00635963   -0.00191544   -0.00411736
C    1.65880315    1.20983722    0.10226172   -0.00887113   -0.00595584    0.01643326
C    1.70473414   -1.36599452   -0.05395161   -0.02469449   -0.02606503    0.00027822
H    0.11784513    2.72903156    0.06346968   -0.00134671    0.00522143    0.00304006
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H    2.30068998    2.07921755    0.19301551   -0.01085430    0.00287492   -0.00064148
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C    2.28055822   -0.01870728   -0.04983788   -0.00498632    0.01830452   -0.01738407
H    3.38017442   -0.02880264    0.01848474    0.00863705   -0.00464577    0.00203660
   15
   -420.53220518
H   -2.55565578    0.34952553   -0.02634976    0.00060580   -0.00118737   -0.00036281
O   -2.07138389    1.22485453   -0.02843128   -0.03854058    0.00329757    0.00116245
O   -1.84252786   -1.24761804    0.02157868    0.00143272   -0.01434811   -0.00546525
C   -0.74899060    0.81595191   -0.01858794    0.04629798    0.02816860   -0.00343454
C   -0.70385214   -0.69800807    0.03653347    0.02869203    0.01792490    0.01703531
C    0.30848932    1.65089191   -0.00229278   -0.00629816    0.00081341   -0.01267160
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C    1.65927135    1.21078748    0.10241905   -0.00864680   -0.00594244    0.01672683
C    1.70436671   -1.36805328   -0.05244152   -0.02386753   -0.02811079   -0.00006011
H    0.11982858    2.71829502    0.07880158   -0.00010658   -0.00009090    0.00355289
H    0.06007561   -2.68535198   -0.05465980    0.00143899   -0.00607086   -0.00150125
H    2.30066904    2.08283335    0.19420830   -0.01007976    0.00402873   -0.00044260
H    2.39452023   -2.22539473   -0.00123161    0.00193032   -0.00997390    0.00548379
C    2.27911100   -0.01766366   -0.05215420   -0.00339222    0.01963288   -0.01729457
H    3.37443873   -0.03027895    0.01070312    0.00565562   -0.00494921    0.00161097
   15
   -420.53187357
H   -2.55690489    0.36804166   -0.04084438    0.00541440    0.00778455   -0.00088463
O   -2.06914391    1.22448802   -0.02740595   -0.04097005   -0.00718075    0.00154825
O   -1.84119575   -1.24940975    0.02092706    0.00086911   -0.01485134   -0.00540714
C   -0.75015803    0.81591443   -0.01893829    0.04466370    0.03021351   -0.00335004
C   -0.70369957   -0.69632314    0.03657502    0.03026894    0.01889610    0.01769819
C    0.30708399    1.64858501   -0.00263961   -0.00884684    0.00373989   -0.01376596
C    0.38585225   -1.63950089   -0.03781906    0.00290047   -0.00520731   -0.00454076
C    1.65987039    1.21182755    0.10232363   -0.00850263   -0.00588392    0.01690190
C    1.70435885   -1.36968671   -0.05093062   -0.02197537   -0.03042113   -0.00031476
H    0.12183190    2.70757738    0.09349702    0.00114095   -0.00549964    0.00387784
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H    2.30245779    2.08572254    0.19547987   -0.00896547    0.00525476   -0.00018209
H    2.38889208   -2.22781763    0.00992999    0.00049867   -0.00914628    0.00591766
C    2.27771418   -0.01691627   -0.05420915   -0.00108044    0.02044852   -0.01709924
H    3.36769620   -0.03086629    0.00263198    0.00189424   -0.00511220    0.00115493
   15
   -420.53142140
H   -2.55912450    0.38516471   -0.05518458    0.00993082    0.01615054   -0.00108193
O   -2.06643975    1.22420236   -0.02639787   -0.04276683   -0.01700992    0.00160427
O   -1.83987421   -1.25103334    0.02033675    0.00109356   -0.01499825   -0.00531403
C   -0.75199946    0.81542088   -0.01923803    0.04193791    0.03164878   -0.00322708
C   -0.70400369   -0.69492354    0.03634916    0.03103141    0.01955621    0.01821689
C    0.30581183    1.64622183   -0.00277850   -0.01090573    0.00644949   -0.01469808
C    0.38524749   -1.63732704   -0.03748065    0.00067695   -0.00767931   -0.00471409
C    1.66059795    1.21295635    0.10197278   -0.00833101   -0.00564476    0.01697139
C    1.70468218   -1.37085995   -0.04941508   -0.01920509   -0.03290423   -0.00047226
H    0.12363212    2.69784074    0.10749657    0.00225674   -0.01025975    0.00407419
H    0.06217687   -2.67159966   -0.05093021    0.00392145    0.00036522   -0.00158897
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H    2.38318036   -2.22860311    0.02002791   -0.00134956   -0.00767530    0.00623111
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   15
   -420.53104511
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   15
   -420.53104571
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   15
   -420.53156579
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   15
   -420.53241376
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   15
   -420.53338325
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   15
   -420.53412167
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C   -0.71512584   -0.69274459    0.02911287    0.01795000    0.01720122    0.01781636
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   15
   -420.53451993
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O   -1.83229761   -1.25807034    0.01775653    0.02352966   -0.00627831   -0.00315908
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   15
   -420.53461006
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   15
   -420.53453141
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   15
   -420.53448287
H   -2.63436800    0.41846336   -0.17216115   -0.02066725   -0.01504558   -0.01024799
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C   -0.72846174   -0.69658305    0.01889928    0.00032768    0.01197941    0.01440627
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   15
   -420.53461872
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   15
   -420.53496642
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O   -1.83403526   -1.26067426    0.01706364    0.04485052    0.00506396   -0.00088864
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C   -0.73543348   -0.69967181    0.01242951   -0.00718909    0.00960008    0.01201541
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   15
   -420.53545128
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   15
   -420.53593445
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C    2.26050997   -0.03275102   -0.05777658   -0.02890914   -0.01943975   -0.00676220
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   15
   -420.53627164
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C    1.67817570    1.22728692    0.06834398    0.00697258    0.01596038    0.00751731
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   15
   -420.53643772
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O   -1.84412034   -1.26357458    0.01672353    0.04898418    0.00993829    0.00081413
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C    0.38317717   -1.59005386   -0.02166602   -0.00459624    0.00534847   -0.00450958
C    1.67893279    1.22685097    0.06463163    0.00634850    0.01460044    0.00605147
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H    2.42213459   -2.16910785    0.02707717    0.00456034   -0.00562950    0.00370628
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H    3.35241556    0.03756153   -0.11866912    0.00168071    0.00527456   -0.00325229
   15
   -420.53659099
H   -2.57703153    0.48690482   -0.17333431    0.01975113    0.02100061   -0.00243926
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O   -1.84802667   -1.26455791    0.01662786    0.04757787    0.00998810    0.00131303
C   -0.80233162    0.74918651   -0.01900972   -0.06245360   -0.01310954   -0.00202296
C   -0.75041460   -0.70975508   -0.00654984   -0.01374607    0.00751668    0.00460482
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C    0.38352919   -1.58753990   -0.02002948   -0.00553548    0.00289865   -0.00419350
C    1.67959410    1.22619489    0.06082786    0.00554805    0.01272261    0.00452685
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H    2.42611391   -2.15826622    0.01900148    0.00405610   -0.00343215    0.00295136
C    2.26451719   -0.03450239   -0.05421733   -0.02021756   -0.02898389   -0.00425991
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   15
   -420.53697283
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O   -1.85247184   -1.26565407    0.01651723    0.04525154    0.00952748    0.00186762
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C   -0.75280985   -0.71211861   -0.01064963   -0.01276248    0.00789708    0.00290339
C    0.30507339    1.60297125    0.04180251   -0.00092697    0.02150161   -0.00716164
C    0.38396467   -1.58506999   -0.01832959   -0.00626843    0.00062079   -0.00383831
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C    1.72421515   -1.31369850   -0.02152181    0.01044519    0.00852229    0.00333848
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C    2.26653517   -0.03426593   -0.05288636   -0.01615906   -0.03073525   -0.00357721
H    3.34251512    0.03908414   -0.12502498   -0.00693814    0.00502512   -0.00293734
   15
   -420.53776652
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O   -1.85742956   -1.26685786    0.01638537    0.04209234    0.00857946    0.00247999
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C   -0.75501292   -0.71460178   -0.01479324   -0.01114282    0.00847203    0.00113908
C    0.30534917    1.60022910    0.04657026   -0.00212946    0.02336157   -0.00511707
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C    1.68067817    1.22434039    0.05303812    0.00387382    0.00797177    0.00146364
C    1.72482340   -1.30912723   -0.02010221    0.01225570    0.00847277    0.00400906
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H    2.43206362   -2.13521954    0.00139476    0.00199919    0.00206585    0.00142151
C    2.26879785   -0.03356573   -0.05150125   -0.01241343   -0.03168671   -0.00293436
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   15
   -420.53894990
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O   -1.86286408   -1.26815857    0.01622533    0.03819738    0.00720738    0.00314277
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C   -0.75704821   -0.71721321   -0.01895401   -0.00895801    0.00916558   -0.00067866
C    0.30565715    1.59713649    0.05141558   -0.00330892    0.02293552   -0.00323474
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C    1.72524690   -1.30468345   -0.01874318    0.01361745    0.00791155    0.00464307
H    0.07365807    2.63808182    0.15128498    0.00206850   -0.01162879    0.00072142
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H    2.43439840   -2.12399676   -0.00786146    0.00085633    0.00484366    0.00069147
C    2.27124934   -0.03238741   -0.05007178   -0.00959031   -0.03184155   -0.00228827
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   15
   -420.54023581
H   -2.58362934    0.48011111   -0.15568854    0.00957650    0.00738692   -0.00447443
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O   -1.86873135   -1.26954070    0.01602960    0.03367728    0.00547856    0.00384403
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C    0.30601510    1.59369975    0.05630993   -0.00438959    0.02029069   -0.00147329
C    0.38584755   -1.57764137   -0.01290433   -0.00548020   -0.00068413   -0.00275076
C    1.68152559    1.22200705    0.04515898    0.00265570    0.00254587   -0.00143696
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H    2.43657552   -2.11364059   -0.01724274   -0.00004495    0.00724409    0.00000102
C    2.27384755   -0.03072857   -0.04860776   -0.00817102   -0.03123104   -0.00160118
H    3.33835834    0.03481412   -0.13069355   -0.01472325    0.00370835   -0.00240230
   15
   -420.54136037
H   -2.59206139    0.47216722   -0.14975720    0.00201228   -0.00091608   -0.00569927
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O   -1.87498018   -1.27098468    0.01579025    0.02866116    0.00346850    0.00456989
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C   -0.76075454   -0.72286281   -0.02721658   -0.00319808    0.01056000   -0.00441130
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C    0.38665409   -1.57513756   -0.01100562   -0.00401615    0.00167213   -0.00244202
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C    1.72546867   -1.29614236   -0.01624443    0.01408991    0.00638798    0.00577131
H    0.06217524    2.63871531    0.13600594   -0.00003531   -0.00563695   -0.00011191
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H    2.43875514   -2.10457845   -0.02662473   -0.00052008    0.00897474   -0.00065370
C    2.27657132   -0.02859842   -0.04711962   -0.00839604   -0.02989151   -0.00084869
H    3.34184976    0.03193864   -0.13168185   -0.01410144    0.00316373   -0.00237733
   15
   -420.54217818
H   -2.60086384    0.46437488   -0.14280455   -0.00500505   -0.00834304   -0.00656283
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O   -1.88155376   -1.27246789    0.01549906    0.02325086    0.00131228    0.00529183
C   -0.77866245    0.72467765   -0.01700650   -0.02009324   -0.02463398   -0.00162434
C   -0.76251249   -0.72592186   -0.03126197    0.00021784    0.01108507   -0.00629485
C    0.30694444    1.58597874    0.06613992   -0.00623909    0.01026641    0.00192605
C    0.38752074   -1.57266067   -0.00906994   -0.00205059    0.00536257   -0.00217708
C    1.68220890    1.21951966    0.03736496    0.00210798   -0.00287915   -0.00397294
C    1.72526019   -1.29202262   -0.01512178    0.01289975    0.00591546    0.00627740
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H    2.44101963   -2.09711997   -0.03588935   -0.00040185    0.00987335   -0.00128809
C    2.27942394   -0.02601714   -0.04561873   -0.01018276   -0.02786706   -0.00003372
H    3.34785496    0.02849425   -0.13224066   -0.01177138    0.00257037   -0.00245560
   15
   -420.54269176
H   -2.60878261    0.45805784   -0.13467730   -0.01071421   -0.01408456   -0.00694587
O   -1.99452215    1.26448374   -0.01734619    0.01363052    0.02062480    0.00650393
O   -1.88839086   -1.27396587    0.01514787    0.01757459   -0.00092372    0.00599138
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C   -0.76427400   -0.72914826   -0.03521222    0.00385100    0.01140963   -0.00816070
C    0.30754380    1.58184451    0.07102414   -0.00705313    0.00423168    0.00362880
C    0.38841809   -1.57026597   -0.00710136    0.00019280    0.00999963   -0.00192785
C    1.68250098    1.21832082    0.03354867    0.00202015   -0.00546780   -0.00505781
C    1.72485782   -1.28799275   -0.01409402    0.01075131    0.00580536    0.00675950
H    0.05076609    2.64322631    0.12081338   -0.00291744    0.00345157   -0.00102583
H    0.05155889   -2.59635635    0.04943561   -0.00435225    0.00687990    0.00135226
H    2.42009887    2.01847884    0.12600798    0.00770310   -0.00444209    0.00406489
H    2.44334752   -2.09142539   -0.04492212    0.00033949    0.00986276   -0.00191990
C    2.28243196   -0.02301530   -0.04411738   -0.01315514   -0.02520083    0.00081924
H    3.35596005    0.02458840   -0.13235620   -0.00811628    0.00190540   -0.00261347
   15
   -420.54294601
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O   -1.99383424    1.26734774   -0.01769528    0.01220965    0.02633454    0.00636962
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   15
   -420.54299114
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   15
   -420.54300185
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   15
   -420.54306317
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C    2.29698613   -0.00772885   -0.03835765   -0.02528694   -0.00979897    0.00365541
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   15
   -420.54317211
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O   -1.92424931   -1.28082671    0.01223352   -0.01046997   -0.01017310    0.00868423
C   -0.74448988    0.71240818   -0.01415410    0.03393321   -0.01229379   -0.00044357
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C    1.68355760    1.21430165    0.01587399   -0.00022119   -0.01728344   -0.00858086
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   15
   -420.54320734
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C    1.68373427    1.21414249    0.01269497   -0.00163742   -0.01950728   -0.00888591
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C    2.30637488    0.00105323   -0.03576872   -0.02508150   -0.00112776    0.00424469
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   15
   -420.54303876
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C   -0.73588604    0.71025197   -0.01311760    0.04461274   -0.00555712   -0.00014559
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C    0.31539684    1.55488705    0.10224169   -0.01201542   -0.01101094    0.01452555
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C    1.68393614    1.21427818    0.00965012   -0.00343921   -0.02164130   -0.00904628
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C    2.31164176    0.00550261   -0.03456863   -0.02266078    0.00291629    0.00430375
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   15
   -420.54261637
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C    1.68419047    1.21474086    0.00674185   -0.00559653   -0.02358067   -0.00904697
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   15
   -420.54198273
H   -2.58188827    0.51966217   -0.01970869    0.01582094    0.01762272    0.00053195
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O   -1.95129469   -1.28442269    0.00817927   -0.02463739   -0.01280548    0.00957976
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   15
   -420.54132503
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O   -1.95743837   -1.28496940    0.00689841   -0.02613636   -0.01271785    0.00960331
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C    0.32127644    1.54568908    0.11277355   -0.01151945    0.00012242    0.01707369
C    0.39311518   -1.56423451    0.01330754    0.00724547    0.02114294    0.00343345
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H    2.42272151   -2.08917105   -0.09810317    0.00519844   -0.00084826   -0.00625625
C    2.32923140    0.01837483   -0.03135170   -0.00729805    0.01241990    0.00379080
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   15
   -420.54094427
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O   -1.96328639   -1.28537209    0.00550866   -0.02673492   -0.01234699    0.00954186
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C    2.33543370    0.02234744   -0.03039880   -0.00061861    0.01447749    0.00354634
H    3.41511377   -0.00713841   -0.10135988   -0.00343513   -0.00612159    0.00002263
   15
   -420.54085360
H   -2.58268646    0.53035115    0.02285112    0.01576869    0.01785569    0.00131446
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O   -1.96883195   -1.28563497    0.00401076   -0.02645280   -0.01170797    0.00938219
C   -0.72686578    0.70553873   -0.01050038    0.05300504    0.00768833   -0.00019266
C   -0.80319517   -0.77906629   -0.06592069    0.01923744   -0.00084365   -0.02343400
C    0.32606495    1.53966017    0.11852563   -0.00846340    0.00542602    0.01809627
C    0.39264551   -1.56768369    0.01711383    0.00616015    0.01178350    0.00511412
C    1.68642204    1.22036349   -0.00356055   -0.01531964   -0.02702707   -0.00753939
C    1.72019867   -1.24673008   -0.01098291   -0.00693717   -0.00508535    0.00554818
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H    2.40429328   -2.08980204   -0.09657450    0.00049090    0.00116325   -0.00583326
C    2.34164553    0.02610188   -0.02949957    0.00590000    0.01594074    0.00332636
H    3.41540053   -0.00532946   -0.09674547   -0.00760599   -0.00610544    0.00062195
   15
   -420.54093075
H   -2.58921838    0.52684047    0.03664374    0.00923084    0.01066979    0.00215936
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O   -1.97407820   -1.28576528    0.00240652   -0.02534538   -0.01080698    0.00912619
C   -0.72743672    0.70438288   -0.00997298    0.05164934    0.00914505   -0.00039612
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   15
   -420.54102956
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O   -1.97903762   -1.28577319    0.00069886   -0.02350141   -0.00967792    0.00877488
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C   -0.81421530   -0.78823084   -0.06670852    0.01124158   -0.00407838   -0.02375660
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C    2.35371984    0.03287624   -0.02785031    0.01573870    0.01717339    0.00317463
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   15
   -420.54099503
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O   -1.98373104   -1.28567148   -0.00110826   -0.02103903   -0.00834180    0.00834839
C   -0.73088024    0.70164306   -0.00889592    0.04560879    0.01067811   -0.00099410
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C    1.69037340    1.22877085   -0.01007465   -0.02046951   -0.02245887   -0.00538669
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C    2.35943482    0.03587749   -0.02709803    0.01804103    0.01699596    0.00328827
H    3.42644925    0.00653101   -0.08391128   -0.01259719   -0.00518837    0.00178101
   15
   -420.54082059
H   -2.61327658    0.51065157    0.07475063   -0.01188128   -0.01151803    0.00623038
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O   -1.98818622   -1.28547539   -0.00301001   -0.01810296   -0.00680477    0.00785096
C   -0.73366150    0.70003586   -0.00833723    0.04084672    0.01081171   -0.00137673
C   -0.82590582   -0.79714852   -0.06606359    0.00139018   -0.00732819   -0.02329440
C    0.33677182    1.52679930    0.12670633    0.00575341   -0.00305578    0.01923467
C    0.39058684   -1.57631409    0.02371193    0.00657490    0.00139643    0.00774171
C    1.69227978    1.23229282   -0.01206812   -0.02130032   -0.01949543   -0.00465354
C    1.72207181   -1.23303263   -0.01323195   -0.00020473   -0.00923534    0.00134470
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H    2.27480732    2.15528403   -0.09521174   -0.00575708    0.00616317   -0.00289554
H    2.36967072   -2.09481968   -0.08145245   -0.00729094    0.00301072   -0.00440578
C    2.36487939    0.03862239   -0.02639562    0.01841034    0.01631128    0.00352353
H    3.43451841    0.01244614   -0.08020105   -0.01067049   -0.00464258    0.00191472
   15
   -420.54057515
H   -2.61858984    0.50777911    0.08555273   -0.01599499   -0.01572663    0.00749486
O   -1.96461320    1.28696273   -0.02676701    0.00165799    0.02586089   -0.00738637
O   -1.99243633   -1.28520228   -0.00500075   -0.01485251   -0.00511978    0.00730211
C   -0.73705891    0.69826561   -0.00775768    0.03489171    0.01061550   -0.00179781
C   -0.83182056   -0.80145342   -0.06521074   -0.00379804   -0.00892492   -0.02277480
C    0.33938399    1.52356980    0.12803225    0.01004162   -0.00730079    0.01924579
C    0.38983443   -1.57858367    0.02509058    0.00694945    0.00147406    0.00819366
C    1.69450759    1.23610885   -0.01399114   -0.02160635   -0.01594524   -0.00397680
C    1.72260247   -1.22926816   -0.01388551    0.00057323   -0.00776663    0.00028409
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H    2.27002554    2.16052464   -0.10900437   -0.00664547    0.00550821   -0.00350635
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C    2.37004762    0.04112126   -0.02574659    0.01713491    0.01514729    0.00385081
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   15
   -420.54029128
H   -2.62105383    0.50770729    0.09500955   -0.01799067   -0.01784369    0.00847312
O   -1.96075297    1.28718966   -0.02709807    0.00723995    0.02692801   -0.00837092
O   -1.99651811   -1.28487122   -0.00707429   -0.01144534   -0.00332173    0.00672352
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C    0.34184470    1.52045018    0.12906738    0.01405724   -0.01112828    0.01910508
C    0.38897703   -1.58087619    0.02634540    0.00722958    0.00212175    0.00858163
C    1.69706149    1.24016540   -0.01585393   -0.02140853   -0.01194422   -0.00337113
C    1.72312501   -1.22538750   -0.01454335    0.00094536   -0.00527884   -0.00078090
H    0.07278760    2.58286525    0.10926662   -0.00133676    0.00453736   -0.00527635
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H    2.26644038    2.16477823   -0.12216677   -0.00753693    0.00451735   -0.00402506
H    2.35893333   -2.10036948   -0.06886804   -0.00788077    0.00022688   -0.00367612
C    2.37495808    0.04339166   -0.02515584    0.01477407    0.01353051    0.00423198
H    3.45573195    0.02665887   -0.07381753   -0.00269595   -0.00318825    0.00192450
   15
   -420.53999705
H   -2.62031049    0.51081861    0.10294652   -0.01779636   -0.01794468    0.00906377
O   -1.95697356    1.28711318   -0.02733450    0.01137768    0.02577834   -0.00900450
O   -2.00047004   -1.28450257   -0.00922409   -0.00804481   -0.00145566    0.00613234
C   -0.74532473    0.69425082   -0.00651021    0.01962415    0.00962126   -0.00270011
C   -0.84340066   -0.80963508   -0.06248309   -0.01382987   -0.01196286   -0.02123177
C    0.34409350    1.51749771    0.12981382    0.01755718   -0.01405927    0.01881806
C    0.38801064   -1.58320100    0.02747059    0.00729733    0.00292111    0.00890962
C    1.69993849    1.24440220   -0.01766566   -0.02072662   -0.00766856   -0.00285190
C    1.72363358   -1.22142800   -0.01518935    0.00103995   -0.00199767   -0.00185848
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H    2.26421093    2.16822175   -0.13460546   -0.00834934    0.00330535   -0.00448093
H    2.35568155   -2.10334887   -0.06154956   -0.00738753   -0.00194101   -0.00328721
C    2.37964569    0.04545796   -0.02462910    0.01198509    0.01151442    0.00463320
H    3.46745861    0.03469459   -0.07114681    0.00212032   -0.00227611    0.00186590
   15
   -420.53970912
H   -2.61639460    0.51713219    0.10925834   -0.01541503   -0.01609292    0.00919780
O   -1.95332186    1.28674627   -0.02746917    0.01402248    0.02246252   -0.00922113
O   -2.00433057   -1.28411744   -0.01144346   -0.00480187    0.00043293    0.00554482
C   -0.74996266    0.69202109   -0.00582869    0.01060138    0.00900988   -0.00314931
C   -0.84891472   -0.81346598   -0.06063156   -0.01837127   -0.01335330   -0.02023762
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C    0.38693422   -1.58556960    0.02846115    0.00708965    0.00343261    0.00919213
C    1.70312834    1.24875483   -0.01943414   -0.01961238   -0.00331805   -0.00243038
C    1.72412656   -1.21743893   -0.01580722    0.00101846    0.00176508   -0.00296076
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H    0.24918216   -2.67260419    0.05805043    0.00626736   -0.00584281    0.00060717
H    2.26348233    2.17107117   -0.14623801   -0.00899747    0.00202241   -0.00489130
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C    2.38415185    0.04735055   -0.02417240    0.00939479    0.00917607    0.00502414
H    3.47880791    0.04313843   -0.06881213    0.00664084   -0.00125281    0.00180878
   15
   -420.53944721
H   -2.60973393    0.52631380    0.11392141   -0.01090948   -0.01226685    0.00883414
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O   -2.00813636   -1.28373715   -0.01372573   -0.00185085    0.00225883    0.00497103
C   -0.75476011    0.68965511   -0.00509958    0.00095449    0.00842644   -0.00357743
C   -0.85415165   -0.81709514   -0.05847421   -0.02239637   -0.01461731   -0.01911187
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C    1.72460409   -1.21347670   -0.01638030    0.00103389    0.00565599   -0.00408916
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H    0.25055124   -2.67952692    0.05602613    0.00574831   -0.00850258    0.00049147
H    2.26436980    2.17355540   -0.15699051   -0.00938596    0.00082753   -0.00527071
H    2.35300661   -2.10783136   -0.04522001   -0.00557854   -0.00656315   -0.00234972
C    2.38851509    0.04910467   -0.02379163    0.00750962    0.00662084    0.00538544
H    3.48897350    0.05180668   -0.06680328    0.01034894   -0.00014977    0.00176367
   15
   -420.53908238
H   -2.60113761    0.53767693    0.11700175   -0.00445330   -0.00658983    0.00795191
O   -1.94650345    1.28531538   -0.02742881    0.01457125    0.00962430   -0.00824223
O   -2.01192079   -1.28338238   -0.01606440    0.00069120    0.00397266    0.00441155
C   -0.75957160    0.68716161   -0.00431642   -0.00899198    0.00792257   -0.00397126
C   -0.85905070   -0.82050345   -0.05602803   -0.02581163   -0.01573164   -0.01787313
C    0.34909837    1.50999064    0.13037329    0.02315555   -0.01516500    0.01731877
C    0.38446833   -1.59045895    0.03002181    0.00578219    0.00243346    0.00962914
C    1.71037410    1.25754775   -0.02286568   -0.01637168    0.00475468   -0.00182578
C    1.72506579   -1.20959970   -0.01689154    0.00121589    0.00932552   -0.00523514
H    0.08937726    2.58899621    0.15012452   -0.00053072    0.01327862   -0.00253981
H    0.25088594   -2.68493233    0.05391312    0.00521192   -0.01022719    0.00036039
H    2.26694210    2.17588728   -0.16679434   -0.00943729   -0.00012654   -0.00564425
H    2.35326312   -2.10850969   -0.03637739   -0.00460701   -0.00847115   -0.00179855
C    2.39276351    0.05075880   -0.02349224    0.00668036    0.00397164    0.00570545
H    3.49729255    0.06050131   -0.06511215    0.01290230    0.00099643    0.00173689
   15
   -420.53853569
H   -2.59176193    0.55020553    0.11865695    0.00349770    0.00054803    0.00662438
O   -1.94334310    1.28439652   -0.02726484    0.01265275    0.00067710   -0.00708573
O   -2.01571259   -1.28307253   -0.01845313    0.00272880    0.00550607    0.00386650
C   -0.76424724    0.68454820   -0.00347327   -0.01885054    0.00752055   -0.00432166
C   -0.86356032   -0.82367415   -0.05331174   -0.02853833   -0.01665868   -0.01653589
C    0.35009231    1.50795691    0.13002490    0.02302748   -0.01284504    0.01672011
C    0.38309867   -1.59296410    0.03058532    0.00470373    0.00058051    0.00976821
C    1.71438119    1.26186644   -0.02453792   -0.01439179    0.00809969   -0.00160523
C    1.72550877   -1.20586312   -0.01732361    0.00166382    0.01249548   -0.00638340
H    0.09399184    2.58497113    0.16182394    0.00047823    0.01191638   -0.00175161
H    0.25028165   -2.68851275    0.05173610    0.00471191   -0.01084765    0.00019200
H    2.27120755    2.17823677   -0.17558209   -0.00909286   -0.00072418   -0.00602635
H    2.35435068   -2.10767174   -0.02721167   -0.00376432   -0.00979390   -0.00120374
C    2.39690939    0.05235284   -0.02327906    0.00711144    0.00136288    0.00597909
H    3.50330871    0.06901660   -0.06373415    0.01408095    0.00214240    0.00173899
   15
   -420.53779280
H   -2.58302379    0.56262613    0.11912267    0.01199117    0.00831173    0.00506066
O   -1.94032559    1.28347049   -0.02702072    0.00997283   -0.00886380   -0.00568216
O   -2.01953481   -1.28282490   -0.02088575    0.00418477    0.00678385    0.00333522
C   -0.76863850    0.68182098   -0.00256484   -0.02819258    0.00721455   -0.00462471
C   -0.86763935   -0.82659322   -0.05034554   -0.03053427   -0.01737513   -0.01510603
C    0.35073939    1.50611597    0.12942370    0.02183724   -0.00938209    0.01611959
C    0.38165817   -1.59547689    0.03100123    0.00341374   -0.00222204    0.00984102
C    1.71860567    1.26606342   -0.02618587   -0.01225184    0.01080925   -0.00141271
C    1.72592624   -1.20231461   -0.01765921    0.00240366    0.01494477   -0.00750336
H    0.09851712    2.57882065    0.17383925    0.00175074    0.00922678   -0.00101333
H    0.24882815   -2.69015657    0.04952460    0.00424723   -0.01033201    0.00001586
H    2.27710391    2.18071055   -0.18328452   -0.00833265   -0.00089863   -0.00643429
H    2.35611899   -2.10508131   -0.01782967   -0.00314999   -0.01040090   -0.00058187
C    2.40094612    0.05392605   -0.02315622    0.00888327   -0.00107215    0.00620461
H    3.50681101    0.07714685   -0.06266958    0.01380242    0.00324465    0.00176569
   15
   -420.53690331
H   -2.57643156    0.57356111    0.11867625    0.01959490    0.01530442    0.00359019
O   -1.93742150    1.28264423   -0.02671208    0.00766227   -0.01757424   -0.00434103
O   -2.02340392   -1.28265394   -0.02335620    0.00500549    0.00775281    0.00280222
C   -0.77260464    0.67898459   -0.00158654   -0.03659084    0.00698288   -0.00487863
C   -0.87125762   -0.82924989   -0.04715105   -0.03178670   -0.01783871   -0.01359056
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   15
   -420.53603261
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O   -2.02732922   -1.28257058   -0.02585842    0.00516217    0.00836806    0.00225492
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   15
   -420.53545234
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O   -2.03131245   -1.28258181   -0.02838620    0.00463011    0.00860695    0.00168641
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C    1.73225107    1.27756640   -0.03101106   -0.00511561    0.01494062   -0.00100142
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H    2.36466176   -2.08640778    0.01049799   -0.00297710   -0.00761049    0.00121636
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   15
   -420.53514356
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O   -2.03534757   -1.28269033   -0.03093308    0.00341188    0.00847050    0.00109001
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C   -0.87921277   -0.83559637   -0.03643293   -0.03123127   -0.01753151   -0.00857919
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C    1.73700365    1.28096851   -0.03258679   -0.00250349    0.01520800   -0.00096482
C    1.72705624   -1.19054169   -0.01771507    0.00772299    0.01607142   -0.01108919
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H    2.36855332   -2.07710462    0.01964198   -0.00337954   -0.00539467    0.00172290
C    2.41518991    0.06066920   -0.02362619    0.02672939   -0.00702575    0.00668027
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   15
   -420.53496042
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O   -2.03942079   -1.28289461   -0.03349229    0.00152374    0.00797951    0.00046367
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C   -0.88090729   -0.83717586   -0.03256618   -0.02965591   -0.01685380   -0.00677058
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C    0.37413114   -1.60629716    0.03087213   -0.00396419   -0.02366126    0.00887046
C    1.74179389    1.28414114   -0.03414783    0.00024746    0.01510804   -0.00102318
C    1.72710318   -1.18822491   -0.01733958    0.00924324    0.01457770   -0.01163901
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H    2.32412595    2.19376483   -0.20288692   -0.00038200    0.00252838   -0.00836003
H    2.37305447   -2.06683523    0.02847677   -0.00386112   -0.00283559    0.00216297
C    2.41793722    0.06258013   -0.02399300    0.03202224   -0.00731703    0.00673133
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   15
   -420.53474017
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O   -2.04351072   -1.28318914   -0.03605674   -0.00100224    0.00717797   -0.00018966
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C   -0.88215427   -0.83850079   -0.02859713   -0.02740450   -0.01593652   -0.00490463
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C    1.74658024    1.28708554   -0.03569330    0.00312515    0.01479036   -0.00118666
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H    2.37824954   -2.05605685    0.03692282   -0.00427771   -0.00018837    0.00253872
C    2.42020142    0.06460113   -0.02446159    0.03644669   -0.00714485    0.00678153
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   15
   -420.53442636
H   -2.61598274    0.57611320    0.10379965   -0.00268231   -0.00257377    0.00662407
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C   -0.78201432    0.65988201    0.00591319   -0.05218032    0.00417027   -0.00523635
C   -0.88298765   -0.83958502   -0.02455398   -0.02453451   -0.01481428   -0.00299124
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C    0.37138275   -1.60860704    0.02985153   -0.00624424   -0.02841189    0.00777808
C    1.75131918    1.28980646   -0.03722067    0.00612677    0.01433815   -0.00148460
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H    2.38421029   -2.04524301    0.04491270   -0.00447588    0.00226275    0.00286041
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   15
   -420.53402543
H   -2.62904361    0.57153632    0.09830964   -0.01058384   -0.00834939    0.00732789
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O   -2.05161974   -1.28400983   -0.04117146   -0.00771458    0.00489156   -0.00155934
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C    0.37014193   -1.60913311    0.02916052   -0.00709987   -0.02837636    0.00709557
C    1.75596534    1.29231064   -0.03872543    0.00922633    0.01384987   -0.00192401
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C    2.42303891    0.06895673   -0.02570747    0.04025055   -0.00558471    0.00694619
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   15
   -420.28252708
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O   -1.05982650    1.34349390   -0.10434000    0.10008250   -0.00327720   -0.02428440
O    1.43086830    1.02553840   -0.07363660   -0.05607770   -0.07478980    0.00477830
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C    1.50465570   -1.23182880    0.00536980   -0.12075420    0.04536100    0.00726050
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C   -0.14931500   -3.08538970   -0.03173580    0.02392920   -0.01180800    0.01997850
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   15
   -420.33540023
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O    1.46174090    0.99460500    0.08925790   -0.03665160   -0.09712790   -0.00683950
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C    0.80656590    0.00919840    0.12981420    0.01970600    0.10158900    0.02623370
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H   -0.31803710   -3.85780530    0.78302360   -0.03868980    0.01072610    0.04064900
   15
   -420.26351202
H   -0.28234630    2.02711440   -0.18539850    0.01389300    0.04090220   -0.00863830
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O    1.46753810    1.22315950    0.02938730    0.01663150    0.06201420    0.00460130
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C    0.88505180    0.06221570    0.02280670   -0.07757900   -0.00419240   -0.00223640
C   -1.51522880   -0.96002830    0.20007960    0.02848610   -0.05344830    0.06585180
C    1.56069840   -1.28768930   -0.03243410   -0.11175260   -0.04269310   -0.02389490
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H    3.14325960   -1.42838580    0.11363350    0.08461820   -0.02393890    0.01143790
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C   -0.25573430   -3.04579680   -0.07100070   -0.02176790   -0.06772000   -0.01296370
H   -0.80831280   -3.89519990   -0.39405850   -0.07891160    0.06303920    0.01135390
   15
   -420.23913824
H   -0.30245840    2.10996050   -0.35300080    0.02854570    0.06466660   -0.02737170
O   -1.02277600    1.35033540   -0.02514180   -0.00899220    0.00190010    0.02489840
O    1.41329060    1.23049400    0.04417280   -0.02040530    0.00499000    0.00392630
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C    0.86584480    0.11075510    0.03410550   -0.06613230    0.06091860    0.00475140
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C    1.57267560   -1.25249790   -0.02197020   -0.01633390   -0.01833740   -0.01753640
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C    1.05569230   -2.59492610   -0.02571830   -0.10930610    0.04305270    0.00076890
H   -2.61614120   -0.46651120   -0.35155740   -0.05723490    0.02526210   -0.04098690
H    2.68884320   -1.09102970    0.08060020    0.02444070    0.01094360    0.00625480
H   -2.04342270   -3.26367430   -0.21981910    0.03850720   -0.07571920   -0.02359160
H    1.56777450   -3.76326730    0.01742570   -0.02267940   -0.07405050    0.00692290
C   -0.11722840   -3.11892640   -0.03152410    0.11795030   -0.14291290   -0.03687420
H   -0.80172890   -3.78577160   -0.09894060    0.00749660    0.15032650    0.01433640
   15
   -420.13851556
H   -0.51912070    1.67858280    0.67763730   -0.05977880   -0.05795790   -0.05305270
O   -1.00907080    1.31451050    0.01583960    0.08225850   -0.01065350    0.04829010
O    1.37851050    1.06053560    0.14414450   -0.05172250   -0.01841400   -0.01108690
C   -0.68718680    0.07625400    0.02455210   -0.14934700   -0.05147650   -0.00098650
C    0.93674170   -0.06420680    0.11974630    0.08736020    0.00930060    0.00789700
C   -1.50439580   -0.86686350   -0.07674800   -0.00747740    0.06386390    0.02065170
C    1.49723800   -1.37329410    0.13341030   -0.18045080   -0.15359940   -0.03006950
C   -1.35140730   -2.13210010    0.22417020   -0.12059260    0.28623710    0.03856470
C    1.25137350   -2.56052310   -0.07514830    0.12219710    0.24175450    0.00709380
H   -2.41840830   -0.99245010    0.10785100    0.17430320   -0.04952200   -0.00598700
H    2.93099220   -1.47170900    0.29166480    0.07590790   -0.02933300    0.00655070
H   -1.71342950   -3.22760370   -0.10621500    0.05292650   -0.06817140   -0.01823180
H    1.60397230   -3.55220710    0.12210320   -0.08079980   -0.00410080    0.00438490
C   -0.03008370   -3.25959370    0.00183910    0.07376120   -0.12608880   -0.01671490
H   -0.30443880   -4.36461310    0.11430480   -0.01860230   -0.03183030    0.00271070
   15
   -420.26336301
H   -0.13964670    1.91094140    0.23015270    0.05450580    0.03366220    0.02964360
O   -1.09518470    1.32244000   -0.10146840   -0.07531390   -0.02716370   -0.03484910
O    1.49472390    1.00952620    0.11946100   -0.01760840   -0.08365940   -0.00747480
C   -0.62948030    0.06453580    0.02354720   -0.04197830   -0.07561920    0.01248850
C    0.86535860   -0.01095740    0.11800530   -0.00558900    0.08849680   -0.00021680
C   -1.46998630   -0.91934480   -0.11382150   -0.03730250    0.10336360   -0.01570080
C    1.67796450   -1.26659710    0.09749160    0.03747660    0.02160390    0.00857130
C   -1.23682250   -2.27323960    0.06761770   -0.05002450    0.14961080   -0.01039880
C    1.19294190   -2.57187450   -0.04309980   -0.04260370    0.13320600    0.01802740
H   -2.43203580   -0.94864740   -0.19948170    0.12140930   -0.03999370    0.01210420
H    2.76392800   -1.16206730    0.12037300    0.00597130   -0.00690190    0.00403460
H   -1.96343870   -3.21368420    0.34216900    0.01089180   -0.07543430    0.02000680
H    1.72123910   -3.72020430   -0.36724560   -0.03817470   -0.07181370   -0.01847860
C    0.06064380   -3.39663450   -0.03644850    0.15974370   -0.14955920   -0.03883700
H   -0.74407020   -4.16718940    0.39314260   -0.08141770    0.00022280    0.02102770
   15
   -420.21086232
H   -0.34726080    1.90932730    0.00072140   -0.01378420   -0.00007590   -0.00371140
O   -1.15331630    1.36192200    0.02610080    0.01507200    0.01643030    0.00548750
O    1.35986000    0.91343610    0.12726500   -0.04026970   -0.09087860   -0.00931090
C   -0.78610930    0.08546410   -0.02931100   -0.08212830    0.00840250   -0.02555410
C    0.81630410   -0.14407350    0.19739690    0.07455290    0.03045550    0.03229110
C   -1.56175610   -0.99453900   -0.07159160    0.11002960    0.02135760   -0.00678390
C    1.73415270   -1.30689130    0.14527940    0.01086760   -0.03079030    0.01352330
C   -1.34955850   -2.35368230   -0.16434250   -0.03855560    0.10158640   -0.04787400
C    1.27036180   -2.60945050    0.18541150   -0.02957370    0.06296410    0.06171190
H   -2.68496400   -0.99851400    0.17337140   -0.02439440   -0.02974260    0.01690550
H    2.63277570   -0.52972090   -0.06626210    0.00888980    0.06930610   -0.01183710
H   -2.45287540   -3.24798750    0.16872830   -0.06634390   -0.06093710    0.03174930
H    1.49807870   -3.82965620   -0.44109260   -0.03527720   -0.06254590   -0.04364130
C   -0.01962190   -3.10364600   -0.01514010    0.17503130   -0.00611380   -0.06961430
H   -0.74228230   -4.07333160    0.91224600   -0.06408790   -0.02939730    0.05664900
   15
   -420.23777767
H   -0.31853130    1.99336260    0.11566530    0.00699960    0.02237960   -0.00010100
O   -1.12165050    1.38249550    0.07046130   -0.00902430    0.05189290   -0.00911760
O    1.51241520    1.03409580    0.07177560    0.05357390    0.02338430   -0.02178290
C   -0.65509600    0.03120520    0.10706300    0.02904900   -0.01441910    0.02365450
C    0.76771860   -0.03571230    0.15373830   -0.07780620   -0.01655480    0.05149010
C   -1.59829980   -1.13557810   -0.01114700   -0.02357970   -0.16224500   -0.03945800
C    1.60481460   -1.26457530   -0.07489880   -0.06441790   -0.10098560   -0.08974960
C   -1.25890700   -2.40195790   -0.18682330    0.04725020    0.11156470   -0.03735050
C    1.32722370   -2.54922240    0.04407440    0.05560380    0.09125210    0.03083720
H   -2.45535730   -0.62856260    0.50519230    0.01374310    0.03286830    0.02769560
H    2.69777320   -0.65994110    0.62504350    0.04241730    0.04755370    0.06252190
H   -2.26912050   -3.19616740    0.10546350   -0.05797410   -0.04489700    0.02601640
H    1.27648740   -3.63889550   -0.40965750   -0.07820320   -0.00986310   -0.01022010
C    0.00063990   -3.08053440   -0.08146420    0.10352570   -0.00082140   -0.07044810
H   -0.37085660   -4.01455910    0.69844030   -0.04116530   -0.03113440    0.05605540
   15
   -420.11551052
H   -0.23826720    1.51069800   -0.38515560   -0.01060410   -0.06989560    0.00228200
O   -1.11521020    1.24743540   -0.07314770    0.07958810   -0.18850000    0.01933660
O    1.37057860    0.93100870    0.08861290   -0.28056550   -0.47394860    0.02583860
C   -0.77495100    0.12073260    0.00252570   -0.10213290    0.26642030   -0.02596090
C    0.77347670    0.08577030    0.16138970    0.24282590    0.50433600    0.00163630
C   -1.44600100   -1.07565560   -0.05169340    0.11681500   -0.02722920   -0.01794390
C    1.67606570   -1.25295790    0.02023310    0.11723280    0.07519000   -0.02181820
C   -1.36126660   -2.55148000   -0.11567500    0.02093740   -0.07701850   -0.03578620
C    1.31040420   -2.62980960    0.09780520    0.03803430   -0.03840620    0.05620930
H   -2.77857760   -0.58752790    0.31611530   -0.06320760    0.03229360    0.03161890
H    2.60862600   -0.94145740   -0.08935370   -0.08795150   -0.02280110    0.00485250
H   -2.58656280   -2.84341690    0.22113330   -0.08415020    0.01173000    0.02442220
H    1.57400550   -3.66500190   -0.23123580   -0.05905300   -0.02238640   -0.01685650
C   -0.06025490   -3.10866270   -0.10840190    0.08535150    0.03302040   -0.12531110
H   -0.26234940   -3.81200020    1.13579710   -0.01312330   -0.00280210    0.07749830
   15
   -420.15826157
H   -0.54139740    2.31287600   -0.56346780    0.01990800    0.09091870   -0.04514580
O   -1.00484990    1.41631560    0.03174870   -0.00168300   -0.01323550    0.04390550
O    1.58116940    1.07064560    0.16552040   -0.00969860    0.00448480   -0.01139490
C   -0.60265440    0.03963920   -0.04384870   -0.03890900   -0.02515930   -0.03057100
C    1.00914280   -0.01283310    0.20297960    0.09608030   -0.01639510    0.03252000
C   -1.56077280   -1.03517070   -0.08014750   -0.50359820    0.16071560   -0.20280030
C    1.59343540   -1.26818240   -0.07340870   -0.14022380    0.01443940    0.01299550
C   -1.31300010   -2.45084300   -0.08931930   -0.05660570    0.02354470   -0.04175270
C    1.32874700   -2.62179480    0.06372660    0.00604640   -0.00351570    0.08688470
H   -2.19437660   -0.77007180   -0.43165510    0.50739090   -0.19914420    0.24394290
H    2.78506550   -0.84008400   -0.31497900    0.05590930    0.03870100   -0.01101560
H   -1.96781450   -3.32039350    0.24439730    0.01060610   -0.04086130    0.01490110
H    1.74567010   -3.68184330   -0.48239230   -0.01655940   -0.06444750   -0.03962760
C   -0.01687660   -3.06042760    0.08893970    0.05387300   -0.08430860    0.04093250
H   -0.04407350   -3.45685520    0.96726750    0.01740980    0.11425100   -0.09373870
   15
   -420.28701506
H   -0.57796900    1.68308700   -0.64130580   -0.06037040   -0.06431370    0.06723200
O   -1.08247040    1.34407950    0.00949880    0.09981060   -0.03648470   -0.05989310
O    1.41609750    1.02537090    0.08252590   -0.03302300   -0.10474230    0.01123930
C   -0.77128520    0.11457820    0.01295110   -0.04319990    0.14048230   -0.00390450
C    0.77928910    0.04085360    0.10526780   -0.00547320    0.11397830   -0.02079470
C   -1.69071810   -0.95344830   -0.08613380   -0.12230520    0.03127350    0.00868770
C    1.76346630   -1.19503970    0.15353400    0.03938980    0.08434620   -0.00403610
C   -1.36205880   -2.48517590   -0.12615790   -0.07549060   -0.07676720   -0.02590250
C    1.35080540   -2.61839530    0.16201910    0.01094540   -0.06439120    0.11215770
H   -2.56443760   -0.48876770   -0.16888570    0.09136340   -0.01368970    0.00905510
H    2.89538450   -1.09798620    0.14602000    0.03180200   -0.01581300    0.00415700
H   -2.00368080   -3.10118480    0.37652700    0.05059770    0.02640390   -0.00961380
H    1.72041910   -3.19989590   -0.84175830   -0.02277250   -0.00771540   -0.06340430
C   -0.06772600   -3.03568600    0.07044100    0.04933430    0.01355010   -0.10222640
H   -0.22580410   -3.90392310    1.16682760   -0.01063260   -0.02608570    0.07726280
   15
   -420.21641241
H   -0.11528580    1.55842470    0.02906220   -0.00367750   -0.04230690   -0.00709960
O   -1.10018180    1.31081750    0.08179880   -0.02104060    0.00654130    0.00887130
O    1.42418300    1.02676560    0.09058460    0.06812980    0.05351500   -0.00697480
C   -0.80250450    0.03400930   -0.02253770   -0.07275510   -0.02924850   -0.01975590
C    0.77590650   -0.15282080    0.14591530   -0.02001740   -0.07193730    0.02525220
C   -1.72786530   -0.89201430   -0.11915000    0.07246800    0.10936250   -0.02894150
C    1.69961560   -1.24941460    0.17411470   -0.02945530   -0.05541480    0.04137700
C   -1.35678740   -2.34826420   -0.06481030   -0.02096820    0.00791720   -0.02392140
C    1.28855210   -2.54375020    0.16870310   -0.02437390    0.10058070    0.03032140
H   -2.83898880   -0.60696250    0.25483420   -0.04881110    0.01269520    0.03092130
H    2.65987010   -0.52403510   -0.19482870    0.02815070    0.06580960   -0.03334230
H   -2.19999520   -3.08518160    0.26324420   -0.02852350   -0.02881250    0.02238160
H    1.62853020   -3.84786500    0.00038780   -0.03243820   -0.08147830   -0.02061180
C    0.04661110   -3.08537940   -0.10419830    0.14978570   -0.02896410   -0.08511110
H   -0.33440580   -3.97051430    1.36753280   -0.01653260   -0.01823170    0.06665630
   15
   -420.22244132
H   -0.08820980    1.61887050   -0.40112060    0.04057770   -0.03038930   -0.01975500
O   -1.07119060    1.35371340   -0.09641070   -0.03868490   -0.01829630    0.01993230
O    1.40470320    0.94417460    0.10573910   -0.04139140   -0.10550430    0.01013430
C   -0.69728020    0.10711160    0.07674890   -0.00707980    0.04449800    0.00999320
C    0.75895580   -0.04331630    0.06123880    0.00815950    0.11283260   -0.02405300
C   -1.49447850   -0.97931500    0.01794700    0.10122540    0.01615510    0.08415010
C    1.64874890   -1.32818880    0.03651950   -0.07903740   -0.29933190   -0.02599210
C   -1.28761970   -2.38358440   -0.13520590   -0.04498460    0.10823580   -0.06466460
C    1.30108870   -2.47092360   -0.00869760    0.08496860    0.32987420    0.04825460
H   -2.57501490   -0.79211930   -0.59623100   -0.04436960   -0.00540310   -0.05124230
H    2.71656360   -0.32721550    0.23466730    0.03138060    0.07883570    0.01733540
H   -2.00628400   -3.30167250    0.25272030   -0.00088470   -0.06642400    0.03041430
H    1.63263080   -3.61502070   -0.33499910   -0.04446790   -0.06104330   -0.02507370
C   -0.06448690   -3.19159350   -0.07851490    0.06012090   -0.07226240   -0.08013430
H   -0.28442240   -4.04928020    0.86824790   -0.02552670   -0.03175710    0.07065420
   15
   -420.26697222
H   -0.29339160    2.00045380   -0.40546270    0.05996730    0.04974330   -0.04791920
O   -1.14681070    1.34675000    0.09984220   -0.05935770   -0.03786370    0.04744850
O    1.46187530    0.94025730   -0.00381900   -0.05023790   -0.15505810    0.01289510
C   -0.64453360    0.07596220    0.03518520    0.04295260    0.00469800   -0.00069850
C    0.75904210    0.00421300    0.02927810    0.02481780    0.12649510   -0.01947110
C   -1.48813060   -1.01724220   -0.05284080    0.06971270    0.00177870    0.06350360
C    1.65056030   -1.20349650    0.07465170    0.04612100    0.04166320    0.01891950
C   -1.20930610   -2.50512180   -0.13224780    0.04145800   -0.05508790   -0.02975160
C    1.24194960   -2.57215100   -0.01535580   -0.24173270   -0.08384760    0.04994450
H   -2.68940160   -0.57377330   -0.41718580   -0.06842610    0.03341770   -0.03130440
H    2.42862530   -0.43941970    0.07935170   -0.05276370    0.04817430   -0.00000480
H   -2.18981530   -3.15830090    0.09540290   -0.05024160   -0.02619580    0.00965130
H    1.74117480   -3.61669890   -0.37953350   -0.02417950   -0.05508840   -0.02900600
C    0.07995690   -3.00134060    0.05108610    0.27413790    0.08319460   -0.10105090
H   -0.07154810   -3.57372890    1.10967730   -0.01223910    0.02398330    0.05684510
   15
   -420.23640713
H   -0.51718440    1.77611710   -0.54840590   -0.06082680   -0.04545810    0.03418940
O   -1.06252810    1.27978110   -0.02044340    0.09764800   -0.03254430   -0.03722340
O    1.41721380    1.07418230    0.10800980    0.03755370    0.05702000    0.00969920
C   -0.75991460    0.06360630    0.05144740   -0.06607690    0.13125250    0.00816690
C    0.81736990   -0.11225230    0.11564920   -0.00381550   -0.13040550   -0.01931920
C   -1.67840460   -0.99693790   -0.10121040   -0.08806010    0.01854560    0.00864390
C    1.71846590   -1.15169240    0.15114980   -0.06557590    0.16416520    0.03192210
C   -1.33924450   -2.47110810   -0.15986700   -0.00158530    0.00838320   -0.09388810
C    1.43299930   -2.60337160    0.12771760    0.08447760   -0.02839730    0.08199950
H   -2.54214390   -0.57056440   -0.41800220    0.06772910   -0.00729480    0.01183720
H    2.86427490   -1.21775670   -0.11254000    0.04207500   -0.04000210   -0.01597660
H   -2.18839570   -3.22280910    0.51118360   -0.04145690   -0.04681920    0.05860170
H    1.68162430   -3.41460860   -0.73035740   -0.03901340   -0.03145610   -0.05182420
C   -0.01677960   -3.03200730    0.02807350    0.06697490    0.01710680   -0.09765730
H   -0.36118210   -4.06747440    1.18525700   -0.03010610   -0.03401720    0.07082480
   15
   -420.21656037
H   -0.59578310    2.05225920   -0.50888550   -0.02314120    0.00897280    0.00839170
O   -1.02296610    1.38931320    0.03562370    0.06016760    0.04228770   -0.01416420
O    1.46320490    0.95763510    0.10355560    0.04226230   -0.02014430   -0.00015890
C   -0.62923180    0.01001770    0.01964850    0.08708000   -0.10133290    0.01215760
C    0.65122610   -0.02308800    0.17209810   -0.22146660    0.02301920   -0.01773250
C   -1.43827570   -1.02702320   -0.02881980    0.15429120   -0.00271780    0.02042180
C    1.58154250   -1.22141710    0.16577370   -0.00960230    0.01894850    0.03666810
C   -1.22604970   -2.41335360    0.05656420    0.02882360    0.06790880   -0.02102950
C    1.29054750   -2.60118970    0.02209200   -0.08769950   -0.08331790    0.08978090
H   -2.69642920   -0.56762010   -0.13948180   -0.07351720    0.03312590   -0.00576830
H    2.44353080   -0.53009650   -0.07530860   -0.01269290    0.04798490   -0.01621810
H   -2.24637430   -3.55082900    0.33256260   -0.05101140   -0.07922660    0.01517020
H    1.52647690   -3.53590360   -0.71532520   -0.04516050   -0.04186680   -0.03978380
C    0.02574600   -2.97355910    0.05381920    0.10815310    0.04090640   -0.08382570
H    0.31578980   -3.69947650    0.83782930    0.04352270    0.04545930    0.01612930
   15
   -420.18954904
H   -0.09196590    1.87344080    0.31277040    0.01582140    0.00780890    0.03195170
O   -0.86218280    1.37815230   -0.15623180    0.02530700    0.00045110   -0.06167190
O    1.37388860    1.09067600   -0.18913670   -0.02199670    0.03991050   -0.01214640
C   -0.56877130    0.07936690    0.15074830    0.07868800   -0.01180590    0.05932220
C    0.80163170   -0.07132410   -0.04553320    0.02367840   -0.19022550   -0.00406930
C   -1.59626890   -0.88908930   -0.00814310    0.01184530    0.00150050   -0.11279150
C    1.43972510   -1.17007320   -0.06841870   -0.21074560    0.02991000    0.03120090
C   -1.39735780   -2.32214910    0.16910430    0.08498130   -0.02456530    0.11841180
C    1.03146510   -2.37519750   -0.07943730    0.00908240    0.19137790   -0.00357440
H   -2.36133510   -0.83193490    0.93581980    0.00250430   -0.02788340    0.06197100
H    2.65902160   -0.75298830   -0.26922140    0.06122450    0.04065880   -0.00966170
H   -1.96832010   -3.00696300   -0.77627980    0.01175820   -0.02581940   -0.07221360
H    1.83535340   -3.82228000   -0.36144710    0.02275870   -0.08022880   -0.01325240
C   -0.27822810   -2.96108060    0.07070140   -0.10042710    0.07914570   -0.05634500
H   -0.38491660   -4.03801490    0.55239930   -0.01445680   -0.03024040    0.04286830
   15
   -420.26143532
H   -0.25941080    1.86636440   -0.33394550   -0.07311120   -0.03400380    0.02201550
O   -0.95146250    1.38392330   -0.00918710    0.10468930    0.07679880   -0.03670700
O    1.54322710    0.91504640    0.10548820    0.04819990    0.01859130    0.01997980
C   -0.66018030   -0.01023780    0.08360680   -0.18272780   -0.24593900    0.01917940
C    0.77475400   -0.12626970   -0.00489540   -0.02569390   -0.04170350   -0.04711580
C   -1.41926970   -0.93184770    0.00407040    0.14650400    0.21698710    0.05851300
C    1.52208250   -1.32423800    0.11975940   -0.11341170   -0.17437160   -0.02160740
C   -1.21798670   -2.40429470   -0.06646220   -0.08250700   -0.07743470    0.00193480
C    1.34104560   -2.54365880    0.02080200    0.05411640    0.22502430    0.04986220
H   -2.37181480   -0.81210340   -0.37922430    0.05018600   -0.02378780   -0.00511610
H    2.49554530   -0.37804940    0.38818380    0.01068630    0.07582730    0.01660620
H   -2.03411690   -2.85870430    0.23466770    0.08441440    0.04936930   -0.02420280
H    1.90593710   -3.61733020   -0.26916300   -0.00521570   -0.07058790   -0.02971410
C   -0.06952850   -3.12531900    0.03199680   -0.00272700   -0.02645010   -0.06778590
H   -0.25939340   -3.59821530    1.07760200   -0.01337280    0.03172340    0.04415810
   15
   -420.05600118
H   -0.12018310    1.93231130   -0.52978050    0.06964570    0.03273560   -0.05987960
O   -1.07571760    1.30557110    0.15623890   -0.05468150   -0.08756850    0.06567920
O    1.43974000    0.88966200    0.05524050   -0.10793520   -0.18540660    0.00703500
C   -0.55455760    0.07526290    0.01246210    0.29674010   -0.01445330   -0.01159010
C    0.66232290    0.04220900    0.09299650   -0.14962990    0.23052560   -0.01882290
C   -1.52683180   -0.90378780   -0.01447420    0.03548300    0.06914380    0.04585380
C    1.48243330   -1.35259290    0.01894670   -0.09026720   -0.25464870    0.00726840
C   -1.18660270   -2.41005380   -0.05307170    0.08208870   -0.02823050    0.01247370
C    1.32350660   -2.55538190   -0.11776550    0.01005810    0.21059820    0.04360010
H   -2.78530580   -0.56119800   -0.22930930   -0.08400330    0.02096380   -0.01828750
H    2.29140350   -0.23045790   -0.08067770   -0.02182730    0.08075990    0.00004370
H   -2.35762980   -3.05930660   -0.30956980   -0.07915760   -0.02936840   -0.03014100
H    1.61198590   -3.90034330   -0.61014820   -0.03091120   -0.07567930   -0.02320790
C    0.07006630   -3.03646720    0.08626890    0.13046410    0.06077490   -0.09221170
H   -0.03350570   -3.95532260    1.02106470   -0.00604140   -0.03011060    0.07218670
   15
   -420.10849357
H   -0.28848220    1.81512010   -0.63685290    0.04389910    0.01948050   -0.05039060
O   -1.10387040    1.32850050   -0.05148470   -0.02095720   -0.07458510    0.05727150
O    1.45157750    0.92755860    0.03167910   -0.08225730   -0.22967930    0.04741580
C   -0.73988160    0.10521170    0.02006300    0.04049330    0.10071520   -0.00236560
C    0.76781150    0.03495900    0.13274880    0.03396380    0.20232180   -0.05761810
C   -1.73839530   -1.05378100   -0.02800190   -0.00083770   -0.10595650    0.03948660
C    1.72528550   -1.11563340    0.41068980    0.05017220    0.15765090    0.05548050
C   -1.22835510   -2.32045230   -0.07321780    0.02691590    0.15764000   -0.08304680
C    1.31968510   -2.58371970    0.21885660    0.06224730   -0.09055220    0.02017760
H   -3.01049590   -0.76335980   -0.36895750   -0.08337620    0.01720990   -0.02869040
H    2.64129630   -1.34022430   -0.22293470    0.00474970   -0.05007760   -0.02670070
H   -2.19540040   -3.31014630    0.53305500   -0.03802180   -0.05686790    0.04604830
H    1.58484060   -2.97699220   -0.70153920   -0.07996230    0.03788190    0.02238500
C   -0.04239720   -3.19009780   -0.01997590    0.02536070   -0.04020860   -0.11152150
H    0.04634590   -4.25914490    1.05150890    0.01763440   -0.04493280    0.07207070
   15
   -420.20526167
H   -0.19131690    1.81942720    0.20796430    0.04636050    0.02517990    0.01674330
O   -1.09654980    1.24693060   -0.01316540   -0.00174490   -0.15661030   -0.01565490
O    1.31570010    0.96786430    0.05467130   -0.04082310   -0.08822050    0.00189850
C   -0.75503060    0.05972780   -0.02342440   -0.00003530    0.08587720   -0.00926210
C    0.69491520   -0.04434200    0.12622220   -0.00664580    0.15330740    0.00475600
C   -1.74189320   -0.91350490   -0.10345030   -0.13887850    0.06652040    0.02357070
C    1.66208380   -1.39636360    0.14323840   -0.02615760   -0.24093810    0.03178150
C   -1.27563560   -2.30529760   -0.19419290    0.04249770    0.04666800   -0.05751980
C    1.24518440   -2.56635720    0.03254890   -0.02865330    0.17504520    0.05650440
H   -2.63341210   -0.84425170    0.30999880    0.09091040   -0.02283520   -0.01920570
H    2.53507750   -0.03106930   -0.53542890    0.00172800    0.05897180   -0.03371030
H   -2.15256610   -3.11531460    0.18973010   -0.04013410   -0.04668840    0.03362410
H    1.72170760   -3.62006540   -0.37262170   -0.01682380   -0.05609520   -0.02953390
C   -0.03485600   -2.96834140   -0.08198420    0.14015060    0.07500530   -0.04554720
H   -0.30717500   -4.30159580    0.43487230   -0.02177470   -0.07511880    0.04155430
   15
   -420.13402551
H   -0.15397960    1.86825050   -0.39316640    0.05047600    0.01758780   -0.04152250
O   -1.01133290    1.36872710    0.08159930   -0.02844430   -0.02903360    0.04708370
O    1.39805350    0.95639010    0.11315030   -0.13753380   -0.31170250   -0.00117380
C   -0.61351920    0.08300880   -0.04957040    0.06634210    0.00169200   -0.00995740
C    0.76978030    0.03725810   -0.00610620    0.10711100    0.22724990   -0.01176600
C   -1.50106450   -0.97772850   -0.05039320    0.02404130    0.05803660    0.00482960
C    1.57038530   -1.07842050    0.13627480   -0.08958360    0.12767380    0.05155250
C   -1.28909750   -2.42607680    0.03419320   -0.07172230   -0.04989780    0.00494310
C    1.32277380   -2.55899130    0.04375970   -0.03331500   -0.08159020    0.07005250
H   -2.58858670   -0.96821120   -0.02843110    0.00188110   -0.03704940    0.00217460
H    2.66883860    0.10969980   -0.06760090    0.02674080    0.06510410   -0.01830420
H   -2.11547250   -3.13077350    0.06929140    0.00151310   -0.00608340   -0.00449930
H    1.60526930   -3.74453760   -1.03812160   -0.01742900   -0.05632900   -0.06140060
C    0.03053870   -2.97192790    0.09120610    0.08769930   -0.13030420    0.06048770
H   -0.00559470   -3.70008420    0.63187430    0.01218450    0.20467040   -0.09251210
   15
   -420.08840973
H   -0.83208440    1.61405570   -0.51624970   -0.14004130   -0.23744040    0.42006920
O   -1.05803630    1.34608340    0.14741560    0.16069150    0.13363180   -0.39010760
O    1.33309130    0.88935710    0.10464060   -0.05528740   -0.16246560    0.01327340
C   -0.60930970    0.15501770   -0.08062620    0.11448660    0.14233700   -0.04114870
C    0.69691640   -0.12327560    0.07652510   -0.00520290   -0.04209870   -0.03463770
C   -1.47736360   -0.92449670   -0.08407580    0.08113440    0.03855830    0.04961880
C    1.56675410   -1.11337930    0.18931200   -0.12415120    0.14781730    0.09032380
C   -1.25444820   -2.36864290   -0.06024550   -0.18184500   -0.05742010   -0.02462970
C    1.29801670   -2.47661020   -0.13420010    0.00591340    0.02704560    0.04341880
H   -2.70276410   -0.90504090   -0.41121080   -0.06407800   -0.02330160   -0.02663150
H    2.64149890   -0.25416770   -0.38262400    0.04236780    0.06979530   -0.04402100
H   -2.00370050   -2.91451290    0.19983350    0.10118160    0.06956450   -0.01734720
H    1.42011340   -3.52896610   -1.22054510   -0.03573220   -0.05835960   -0.05602560
C    0.06414440   -3.08584770    0.16489300    0.11828100   -0.05533380    0.01807500
H   -0.17178850   -4.13926410    0.25400780   -0.01770340    0.00770310   -0.00028460
   15
   -420.16207816
H   -0.74650900    1.94861670   -0.50733920   -0.02943420   -0.04697360    0.04241480
O   -1.03831950    1.36325930    0.12816620    0.07149100   -0.01868250   -0.03757020
O    1.40112280    0.88252300   -0.00672040   -0.00237450   -0.06937490   -0.00285150
C   -0.57865000    0.15872290   -0.04473380    0.37493620    0.07695520    0.01990650
C    0.55950290   -0.04562000    0.15806130   -0.40945140    0.06907930   -0.02441850
C   -1.57722600   -0.96667790    0.00188480   -0.10648340   -0.02556950    0.02500650
C    1.48630420   -1.20437460    0.18305200   -0.06391800    0.00326560    0.00690450
C   -1.24159010   -2.44345910    0.03620770    0.04832920   -0.09662270    0.00326870
C    1.25283830   -2.52056230   -0.13255500   -0.00893090    0.05404950    0.03760380
H   -2.34592990   -0.25713830    0.00432830    0.06841890    0.01942710   -0.00031710
H    2.49316960   -0.39080970    0.24774360    0.03689350    0.06996390    0.00214150
H   -2.13706630   -2.96118690    0.20765970    0.01812050    0.02680670   -0.01053870
H    1.49674080   -3.80214600   -0.70021490   -0.03851210   -0.07876440   -0.03136620
C   -0.03151480   -3.03222280    0.01405540    0.04161510    0.04041200   -0.10557240
H   -0.04387750   -3.90403000    1.01928340   -0.00066280   -0.02397530    0.07535380
   15
   -420.17873450
H   -0.42845400    2.21093730    0.63469620    0.01286740    0.07162060    0.04217050
O   -0.90917980    1.43105870    0.03815210    0.03508740   -0.02578210   -0.03677750
O    1.48276820    1.22794710   -0.00746580   -0.00395500    0.08128080   -0.00539910
C   -0.63994050    0.10413100    0.11328790   -0.05002740    0.00246120    0.00259030
C    0.99475650    0.01388620    0.01870030    0.15432420   -0.19348130   -0.00934600
C   -1.62649160   -0.99095220   -0.01266920    0.02049110   -0.33127900   -0.12771830
C    1.56604730   -1.12856850   -0.11367950    0.02914560    0.16875740   -0.02451110
C   -1.40736170   -2.20779330    0.02311730   -0.11521950    0.25420460    0.07686990
C    1.35904820   -2.47036270    0.04564030    0.11773090    0.09619340   -0.00623170
H   -2.40894640   -0.60449510    0.97748530   -0.00544640    0.01317950    0.07245770
H    2.42556530   -0.86576170   -0.30284180   -0.19723170   -0.03290250    0.03878820
H   -1.75018450   -2.51207170   -0.99989840    0.04265110    0.03801710   -0.02232110
H    1.83391300   -3.57096330    0.06760970   -0.01541950   -0.06918500    0.00729590
C   -0.17261230   -3.02303570    0.01855540   -0.00415130   -0.08506940   -0.00742970
H   -0.47432800   -4.01335440   -0.28900420   -0.02082080    0.01195500   -0.00046760
   15
   -420.11023269
H   -0.71477040    1.77940000   -0.54894200   -0.03357190   -0.07073320    0.05351760
O   -1.07017080    1.35020220    0.16294630    0.04262500   -0.00336920   -0.03685070
O    1.34570980    0.88218380    0.05743640   -0.06539080   -0.19112170    0.01841970
C   -0.61192500    0.14858720   -0.06305840    0.09311890    0.10707590   -0.03083820
C    0.73166080   -0.12156470    0.13126950    0.05800840   -0.03566220   -0.01833670
C   -1.49930300   -0.89058930   -0.14547260    0.07451040    0.08255580    0.01696910
C    1.60098140   -1.09424620    0.23844470   -0.12815720    0.15265800    0.07401180
C   -1.27744200   -2.39494200   -0.09677790   -0.26529230   -0.12703170   -0.01068060
C    1.26509100   -2.41447930   -0.09990580   -0.00135110    0.05028840    0.02449660
H   -2.74453030   -0.92358680   -0.28276600   -0.06615540   -0.03136120   -0.00699830
H    2.63091590   -0.29062140   -0.27401840    0.03982210    0.07188340   -0.04043080
H   -2.00549440   -2.88455220    0.13413170    0.17488480    0.11846760   -0.03653900
H    1.51326670   -3.67800820   -1.23926380   -0.02497150   -0.05621070   -0.04391110
C    0.07589890   -3.12890910    0.21332130    0.08582310   -0.25548740    0.03134130
H   -0.11811280   -4.02610130    0.13593220    0.01610010    0.18802690    0.00583040
   15
   -420.08106848
H   -0.84264050    2.52778910   -0.44428210    0.00063810    0.11045750   -0.03332170
O   -1.04612520    1.36578700    0.13801420    0.03412280   -0.06606660    0.02726260
O    1.38490870    0.91745950    0.06675150   -0.00764380   -0.05842970    0.01226880
C   -0.67095030    0.02027130   -0.07884470    0.03498680   -0.06429170   -0.00248450
C    0.66139190   -0.07838710    0.04928810   -0.05015780   -0.01667870   -0.02290100
C   -1.60905320   -0.94320940   -0.02830330   -0.09850440    0.09462230    0.00973550
C    1.36472870   -1.23674370    0.24630470   -0.16459490    0.03453530    0.06128830
C   -1.32949200   -2.48317110    0.06135820    0.03301280   -0.05340010    0.03179550
C    1.33250200   -2.58409210   -0.04851880    0.02619690   -0.03623900    0.00310170
H   -2.33765390   -0.29116120   -0.06380780    0.12505890   -0.02596690    0.00261120
H    2.50849750   -0.40782650   -0.02245700    0.03898970    0.06824750   -0.02658330
H   -2.52572490   -2.96571630   -0.15488620   -0.08310010   -0.00697360   -0.02256460
H    1.36966180   -3.45457740   -0.75103230   -0.07774930   -0.00293290    0.00085440
C    0.07978020   -3.11682300    0.00643070    0.22335560    0.03484800   -0.10941030
H   -0.24203160   -3.95312750    0.93923840   -0.03460530   -0.01176680    0.06831830
   15
   -420.20128692
H   -0.35052660    1.78562470   -0.09611380   -0.16024520   -0.09835460    0.04359320
O   -1.05568350    1.37757640    0.13391770    0.18643710    0.12215190   -0.03782020
O    1.40090780    1.06844220    0.25139890    0.02911700   -0.01968440    0.01446050
C   -0.75380220    0.02065730    0.01402850   -0.19297540   -0.18950150   -0.01337830
C    0.77791760   -0.03366020    0.06945650    0.07519770   -0.04638540   -0.03668180
C   -1.48245260   -0.94826300    0.03646940    0.18719920    0.18897820    0.04425120
C    1.67218890   -1.07020080    0.06443190   -0.03072370    0.04753900    0.01488410
C   -1.23522480   -2.43975480   -0.11859280    0.07220810   -0.00052500   -0.05819340
C    1.33104450   -2.42054020    0.06876370    0.00038300    0.01662480    0.08021210
H   -2.55996320   -0.71225080   -0.13762510   -0.00968420    0.00213490   -0.01295440
H    2.31797770   -0.04961980    0.06409150   -0.05896200    0.05979130    0.00377230
H   -2.14597780   -3.40447690    0.16270860   -0.04733430   -0.07362230    0.02533620
H    1.60924930   -3.55230040   -0.84168210   -0.02204670   -0.06805460   -0.06128750
C   -0.02873590   -2.86178830    0.18441390   -0.05117900    0.13326660   -0.02796680
H    0.13655250   -4.18697930    0.51272040    0.02262790   -0.07434410    0.02177750
   15
   -420.06774717
H   -0.21108050    1.76943430   -0.37756090    0.00106500    0.01653990   -0.02603730
O   -1.07608520    1.30859690   -0.01243190    0.03640360   -0.11958820    0.01897330
O    1.35038350    1.00038790   -0.07309730    0.07133800    0.08013600   -0.01812760
C   -0.88840080    0.10231810    0.04224290   -0.12276790    0.08465430    0.00169210
C    0.59489640   -0.23789560    0.15092220   -0.08615630   -0.12466820    0.04454420
C   -1.74033760   -0.92501930   -0.08796540    0.02998470    0.00427040   -0.01458790
C    1.49697480   -1.34955440    0.14759520   -0.07226310   -0.24155780    0.02813550
C   -1.42662830   -2.21153460   -0.19193580   -0.12420470    0.19719730   -0.05304020
C    1.29887410   -2.53983900    0.20024910    0.05621910    0.27253180    0.06171810
H   -2.55391040   -0.92223470    0.52267600    0.07878010   -0.02403420   -0.00791880
H    3.08131810   -0.20641030   -0.39672360    0.04795040    0.03857450   -0.02103690
H   -1.79868730   -3.31502350    0.13480420    0.04321920   -0.07064320    0.02064210
H    1.66568310   -3.67568290   -0.42380540   -0.01841220   -0.06669130   -0.04893940
C   -0.07029980   -2.97808630    0.05038370    0.05580380    0.01410860   -0.04205400
H   -0.18236310   -4.13813320    0.72424130    0.00296360   -0.06079760    0.05611380
   15
   -420.15801220
H   -0.54441900    1.74000020    0.42123150   -0.01008600   -0.01506990    0.00612340
O   -1.21108410    1.13491440    0.04252220    0.02565280   -0.04702570   -0.01561300
O    1.24453450    1.14539180    0.15864760   -0.01507730    0.01095690    0.01129420
C   -0.63050370   -0.00552940    0.02920510    0.01254320    0.04380040    0.03379960
C    0.76284740   -0.01990980    0.01614590   -0.03546130   -0.01591090   -0.05906620
C   -1.42247910   -1.08551950   -0.19797570    0.11545520   -0.14861770   -0.00700240
C    1.58583090   -1.20543820    0.33853690   -0.07082910   -0.06902000    0.09247960
C   -1.34720600   -2.34809730   -0.38101230   -0.05413580    0.18240140   -0.10468710
C    1.39395680   -2.51200320    0.08599980    0.13170460   -0.07132940    0.00351550
H   -2.73171960   -0.32686660   -0.05324570   -0.05837600    0.05521370    0.01205840
H    2.56352580   -0.71018840   -0.10273720    0.00939080    0.02901330   -0.04564990
H   -2.17296150   -2.99099500    0.32160960   -0.03403120   -0.02653700    0.06099900
H    1.70445230   -3.41123280    0.10520640   -0.11303240    0.10986030   -0.01543170
C    0.05659600   -3.02390420   -0.04518370    0.10486510   -0.01415970   -0.04405750
H   -0.18061850   -3.97515040    1.43497590   -0.00853860   -0.02355650    0.07122430
   15
   -420.14018918
H   -0.09954310    1.89528980   -0.08816990    0.03876590    0.05401140    0.00372930
O   -1.11751970    1.26210880   -0.17510970   -0.01718710   -0.13321720    0.00281980
O    1.35264680    0.88725910   -0.01791140    0.07060210    0.02034950   -0.01832240
C   -0.85570470    0.06986840   -0.01239230   -0.02173430    0.08489770   -0.01879540
C    0.58341490   -0.21945240    0.18952890   -0.12589790   -0.03722120    0.04272130
C   -1.82725350   -0.94911510   -0.04782900   -0.08774070    0.05707380    0.01728700
C    1.61839470   -1.37727580    0.17784240    0.00821860   -0.04462950    0.02427350
C   -1.25152670   -2.26573510   -0.25735400    0.05393110    0.07918450   -0.05584280
C    1.24971170   -2.71290930    0.23056780   -0.06131110   -0.01047980    0.06314650
H   -2.73191910   -1.03463460    0.43627520    0.05195070   -0.01849700   -0.00075580
H    2.95805240   -0.17542980   -0.42935780    0.04764780    0.05136980   -0.03112790
H   -2.12263490   -3.43778850   -0.05716670   -0.02996300   -0.08354460    0.01834010
H    1.54962100   -3.69654100   -0.34295920   -0.04079450   -0.03116710   -0.04209880
C   -0.04450560   -3.00085330   -0.01261050    0.12864690    0.01686080   -0.06059810
H   -0.37477440   -3.83699910    0.76830810   -0.01518640   -0.00502530    0.05518280
   15
   -420.01641817
H   -0.41470520    1.99540710   -0.46041790    0.01185760    0.07791360   -0.04330360
O   -0.94742820    1.15543080    0.02665980    0.11190780   -0.27190880    0.02601400
O    1.20793280    1.00000610   -0.07231220   -0.02049840    0.02550950    0.00144790
C   -0.66080250    0.01138340    0.09228330    0.07409910    0.15936870    0.02272780
C    0.64380120   -0.19458000    0.08698630   -0.19964880   -0.06717450    0.02389690
C   -1.64136500   -0.94874650   -0.13839480   -0.07029230    0.10994700   -0.01309460
C    1.64398390   -1.20710010   -0.07659360    0.01515190   -0.00992660    0.02997090
C   -1.33198730   -2.45884150   -0.07161730    0.02639200   -0.04395880   -0.03266460
C    1.25792320   -2.46968120    0.22668400   -0.04258900    0.03945140    0.12920170
H   -2.61013410   -0.92142200    0.14788000    0.06605150   -0.03258380   -0.00111890
H    2.58983500    0.01834160   -1.12812200    0.02317580    0.04376440   -0.04993990
H   -2.41033110   -2.97813140    0.39246930   -0.06913510   -0.01200670    0.03676880
H    2.11750410   -3.59100650   -0.74974470    0.02032160   -0.04185860   -0.05531740
C   -0.04343840   -3.09396700   -0.07633100    0.03157870   -0.01098850   -0.13270690
H    0.01912130   -3.56291770    1.04709670    0.02159810    0.03440500    0.05814070
   15
   -420.06542193
H   -0.07272580    1.81552060   -0.00133400    0.02863780    0.03739500    0.00565420
O   -1.06024550    1.33043810   -0.11307790   -0.02295930    0.03290790   -0.02585830
O    1.27917190    0.90254170   -0.01999160    0.03061100    0.02721750   -0.02156600
C   -0.80082010   -0.02893930    0.09321100   -0.06388950   -0.11741190    0.03068780
C    0.60969160   -0.29417230    0.21304600   -0.04094630   -0.16189780    0.03772570
C   -1.77935660   -0.91384030   -0.00543280    0.03740820    0.02943740   -0.03913230
C    1.48183070   -1.29460380    0.21045980   -0.08338710   -0.01568990    0.01211020
C   -1.41731390   -2.18750030   -0.23421090   -0.04924550    0.19402520   -0.06841630
C    1.22237460   -2.57627190    0.21056940   -0.00946250    0.08538090    0.05870100
H   -2.37679160   -0.74745030    0.87820060    0.05201800   -0.00442940    0.01751930
H    3.10110180   -0.09940390   -0.25095920    0.05058760    0.03901760   -0.01781980
H   -1.96194730   -3.37756290    0.12990990    0.00997230   -0.09101170    0.03024470
H    1.65037090   -3.38057070   -0.47440670   -0.03636250   -0.00951880   -0.04105900
C   -0.06466290   -3.00086980   -0.00099190    0.13612030    0.01482330   -0.03401960
H   -0.52359980   -4.23103800    0.69100400   -0.03915200   -0.06024160    0.05522410
   15
   -420.05413594
H   -0.42196000    2.09694710   -0.21260450   -0.00491420    0.05203560   -0.01135730
O   -0.96979050    1.25773680   -0.04765180    0.15275470   -0.31937340    0.01671860
O    1.26647430    0.97193760    0.06668530   -0.00659810   -0.05629040    0.00693990
C   -0.77763540    0.12771800   -0.01469980    0.00216300    0.28877860    0.00329510
C    0.57734830   -0.04364190    0.04696400   -0.17813220    0.07484190   -0.01698590
C   -1.67624720   -1.00837410   -0.08615200    0.06221420   -0.01398010    0.02759440
C    1.63084560   -1.25152300    0.03579060   -0.02252660   -0.27209710    0.03921590
C   -1.35339450   -2.50141620   -0.16748480    0.00333110   -0.02618730   -0.06174290
C    1.26900350   -2.40161440    0.11814510   -0.02405030    0.19407450    0.11900610
H   -2.92849730   -0.65635880   -0.21952230   -0.07489750    0.02266810   -0.01048270
H    2.75280920   -0.03343310   -0.63338450    0.03207710    0.05912490   -0.03795560
H   -2.41631760   -3.31158540    0.47465570   -0.06694770   -0.04627890    0.04940780
H    1.98926520   -3.14819470   -0.53420500    0.01047810   -0.01868980   -0.05359230
C    0.00162390   -2.98357640   -0.18095900    0.08433010    0.01764760   -0.11055540
H    0.16790180   -3.53703100    0.82368330    0.03070540    0.04374110    0.04044020
   15
   -420.11031439
H   -0.07120620    1.79404460    0.50531230    0.04845890    0.01551970    0.04823000
O   -1.06566190    1.45501560   -0.03422550   -0.04560380    0.02060900   -0.05680230
O    1.28467130    1.00252260    0.10496110    0.00967130   -0.00108160   -0.00066640
C   -0.82538280    0.09344070   -0.00459240   -0.02062380   -0.06077970    0.02619700
C    0.68623780   -0.10839080   -0.06758110   -0.04788200   -0.04227120   -0.02728070
C   -1.75924320   -0.83698080   -0.10035090    0.05203280    0.15067700   -0.03643380
C    1.67820390   -1.17541560   -0.01592960    0.02018840    0.12691170    0.02796510
C   -1.29051110   -2.44202710   -0.13314040    0.07953540   -0.06541310   -0.08336080
C    1.20465440   -2.57562640   -0.06646600    0.00595500    0.03947890    0.04076220
H   -2.86386770   -1.32136370    0.54266770   -0.05052990   -0.07506330    0.04845830
H    2.80666050   -1.15953460   -0.13752630    0.03272850   -0.02395760   -0.00502340
H   -2.02356930   -2.73344240    0.75390700   -0.01741260    0.01939950    0.05591190
H    1.31411860   -3.99791230   -0.54971550   -0.04332770   -0.07247710   -0.02705100
C   -0.13105530   -3.04921050   -0.00832880    0.00113700    0.01245590   -0.06197010
H   -0.49350770   -4.40261240    1.13795810   -0.02426430   -0.04395440    0.05107640
   15
   -420.04348067
H   -0.34422350    1.83930000   -0.80836150    0.02569530    0.03308370   -0.05450790
O   -1.04704620    1.31942350   -0.16422720    0.00411280   -0.08226900    0.04616510
O    1.34863960    1.04743990    0.06882740    0.00825410    0.05126510   -0.00005590
C   -0.72112060    0.11253220    0.03298720   -0.02803850    0.08784360   -0.00313910
C    0.75809090   -0.16272500    0.17011590   -0.01721190   -0.11591370    0.02762550
C   -1.68976440   -0.92444310    0.13124530    0.01643280    0.01648770   -0.05739770
C    1.60348520   -1.26020660    0.13576580   -0.02596020    0.04325480    0.01976500
C   -1.29659490   -2.33739620   -0.09596360   -0.03081590   -0.08811090   -0.01899210
C    1.20299270   -2.60721000    0.13962220   -0.04672260    0.00267440    0.08030380
H   -2.69032450   -0.58135400    1.00789420   -0.04854050    0.02581220    0.07215680
H    3.06045410    0.10391880   -0.36812270    0.04424930    0.03432460   -0.02178500
H   -1.88771670   -3.11490750    0.09882210    0.07964920    0.03733070   -0.00959550
H    1.76105800   -3.90581460   -0.82512370   -0.00270870   -0.05441090   -0.05342500
C   -0.07404660   -3.02981590   -0.20102740    0.04952130    0.03680710   -0.09948780
H   -0.43665500   -4.04650020    0.81730190   -0.02790440   -0.02815990    0.07234060
   15
   -420.12426281
H   -0.45536220    1.90110180   -0.49346070    0.03547170    0.02645040   -0.06215740
O   -1.02085740    1.31278910    0.25323850   -0.03080110   -0.04402090    0.08819940
O    1.41765270    0.83708070    0.19025370   -0.01589310   -0.23651680   -0.02222280
C   -0.58576670    0.04183380   -0.08952950    0.10482720   -0.00598060   -0.05718480
C    0.71990370   -0.12657970    0.28986840    0.06897740   -0.07421580   -0.00903380
C   -1.52654510   -0.91292700   -0.07114360    0.06616710    0.11267560   -0.00945610
C    1.62693160   -0.98128920    0.09973410   -0.17564940    0.22412160    0.08435150
C   -1.29125660   -2.48321230    0.03206740   -0.03132730   -0.02576880   -0.06399890
C    1.29506260   -2.27721980   -0.16349170    0.01526970    0.08012300    0.04765510
H   -2.70566460   -0.88936490    0.03643440   -0.05011760   -0.02793500    0.01307960
H    2.52239510   -0.21215920   -0.35092180    0.01720990    0.08455590   -0.02641210
H   -2.24393060   -3.10787220    0.57601550   -0.05298270   -0.03130130    0.04375330
H    1.76256430   -3.41309450   -1.49780560   -0.00139550   -0.04836610   -0.05671570
C    0.06187840   -3.02816110    0.19221230    0.07991480    0.01429880    0.04758660
H   -0.11009230   -4.20576900    0.03842720   -0.02968470   -0.04805470   -0.01745470
   15
   -420.13182013
H   -0.61688540    2.06564500   -0.50098140    0.02030220    0.04226270   -0.04465030
O   -1.10419350    1.35968660    0.13570170   -0.02516130   -0.03432400    0.06108270
O    1.37600850    0.95395520    0.13874720    0.00818810   -0.07119540   -0.00036730
C   -0.58680390    0.08643350   -0.11691260    0.16661460   -0.02759500   -0.02211590
C    0.68165690   -0.08947010    0.18009660   -0.11401740   -0.07927690   -0.01679840
C   -1.53504870   -0.88913220   -0.09721440    0.06825750    0.07107330    0.01272720
C    1.58376980   -1.08832230    0.25537350   -0.12886680    0.07607590    0.06476970
C   -1.24221630   -2.33797820   -0.05540420   -0.08310900    0.00282840   -0.03251490
C    1.36799100   -2.37092430   -0.05237570    0.03674760    0.05716730    0.03788970
H   -2.92177120   -0.85913820   -0.10184900   -0.09200580   -0.01999140    0.00282270
H    2.84364880   -0.38219120   -0.25635960    0.06593610    0.05404100   -0.03845200
H   -2.17088420   -2.83206460    0.13674710    0.00086110    0.02569810    0.00349600
H    1.74608120   -3.41625620   -1.70622440   -0.01007970   -0.02695640   -0.04864770
C    0.12993150   -3.09500840    0.12116420    0.10700460   -0.04006710    0.00861900
H   -0.07265340   -4.19702830    0.34045520   -0.02065290   -0.02971950    0.01215560
   15
   -420.01426105
H   -0.48459110    2.10527920   -0.56607480    0.02335540    0.05950110   -0.04122110
O   -1.11883600    1.32650390   -0.11633900    0.00242270   -0.16625800    0.03811140
O    1.31088310    0.92671380    0.10080500   -0.00474260   -0.05269780    0.00516000
C   -0.69223630    0.18137760   -0.01767340    0.05851250    0.16434480   -0.00578540
C    0.70758050   -0.19661510    0.09222370    0.01953820   -0.14705010    0.00959540
C   -1.74657390   -0.85736830    0.04813960   -0.02391420    0.05473980   -0.03828310
C    1.61242820   -1.15363770    0.14857240   -0.10102540    0.07135760    0.03165600
C   -1.29746730   -2.31411590   -0.21693970   -0.07292670   -0.14435950    0.02130340
C    1.33547020   -2.43588870    0.00922080    0.06326510    0.14197270    0.07222140
H   -2.87662690   -0.96495430    0.93732480   -0.06603400   -0.02459360    0.06604950
H    2.91794220   -0.00926750   -0.23583130    0.04939960    0.05345550   -0.02592570
H   -1.92232910   -2.75507100    0.33624200    0.11540070    0.09120910   -0.05326040
H    1.55690870   -3.87703840   -0.65793270   -0.03031260   -0.06904410   -0.03919390
C   -0.09981620   -3.03721520   -0.32372370    0.02498930   -0.02201980   -0.08990810
H   -0.56970010   -3.88801800    0.44856480   -0.05796130   -0.01057640    0.04946370
   15
   -420.03706166
H   -0.64952100    1.96242070   -0.52414150    0.00763220    0.00418210   -0.03071330
O   -1.04341590    1.37012410    0.19260690   -0.01402580   -0.01951100    0.05660240
O    1.40168860    0.94183850    0.09885390    0.01266780   -0.05087630   -0.00367170
C   -0.53030240    0.11104010   -0.14166550    0.22739150   -0.01822680   -0.02614040
C    0.68262960   -0.11650180    0.19102200   -0.19855580   -0.08206570   -0.01807080
C   -1.51153340   -0.83305550   -0.09692950    0.07391710    0.11773850    0.02267660
C    1.58153530   -1.13176560    0.22729500   -0.09916950    0.00094710    0.01771070
C   -1.29007820   -2.36023070   -0.08032690   -0.14611100   -0.03253290   -0.03627270
C    1.35869660   -2.33377700   -0.07402320    0.07010640    0.16669000    0.05487570
H   -2.89246140   -0.95403040   -0.17383920   -0.08607240   -0.04094300   -0.00236490
H    3.04245230   -0.10380080   -0.20725040    0.05442490    0.04610340   -0.02095360
H   -2.09822660   -2.80488100    0.32068020    0.05961510    0.04455860   -0.00960320
H    1.74278090   -3.43112210   -1.54961890   -0.00997140   -0.03506000   -0.05062520
C    0.04995240   -3.13897750    0.20211980    0.06061880   -0.06645620    0.06030870
H   -0.05784010   -4.27211470    0.04636290   -0.01248900   -0.03452750   -0.01373940
   15
   -420.08366675
H   -0.92472880    1.91552620    0.50381950   -0.01331380   -0.04018170   -0.03156240
O   -0.98901680    1.39040610   -0.26086270    0.04161290    0.07766810   -0.01198090
O    1.26543310    1.25043750    0.01869270   -0.05684000    0.07709060    0.00571040
C   -0.66917650    0.04874310    0.18038690   -0.05731480   -0.04437430    0.09190000
C    0.97693560    0.00921440   -0.02856700    0.11727950   -0.11241910   -0.03620590
C   -1.56024860   -0.93245900   -0.17297520    0.04981140   -0.07793540   -0.12889270
C    1.55749310   -1.22523480   -0.17578170   -0.15639100   -0.10626240    0.03446680
C   -1.26589190   -2.22464730   -0.06422340   -0.02265360    0.19518260    0.07857640
C    1.25013390   -2.45200760   -0.12908730    0.06646360    0.20134290   -0.05200790
H   -2.29904650   -0.78633460    0.94531920    0.00589720   -0.00573040    0.07293050
H    2.81056860   -0.59932150   -0.56400690    0.05063900    0.05245640   -0.02146400
H   -2.02707510   -2.94487280   -0.74064350   -0.01091620   -0.03641690   -0.05085920
H    1.58865370   -3.99757620    0.28689040   -0.02865720   -0.07392220    0.02844220
C   -0.12046580   -3.14396900    0.01882390    0.02651990   -0.10521100    0.05651300
H   -0.30088380   -3.95471580   -0.75142390   -0.01218380   -0.00129280   -0.03558910
   15
   -420.11372884
H   -0.15617390    1.86428700   -0.44624150    0.04591840    0.05843310   -0.03834060
O   -1.03430710    1.22375020   -0.08048590    0.03530070   -0.14202760    0.03567180
O    1.19567830    1.00632960    0.01264610   -0.06830160   -0.09193320    0.00343220
C   -0.80007920    0.00634220    0.00616360   -0.04294100    0.04803870   -0.01263690
C    0.73714420   -0.06869900    0.12032370    0.04240920    0.11725660    0.01236730
C   -1.71992070   -0.97557640    0.06592930    0.03920780    0.12520850    0.01392620
C    1.49660950   -1.32479860    0.02872020   -0.04994290   -0.05062070    0.03831520
C   -1.32607880   -2.53103440   -0.03517450    0.01226380    0.00279330   -0.05786010
C    1.37564900   -2.60793540   -0.23112300    0.03086070    0.05583120    0.01937630
H   -2.90962240   -1.09239060    0.15465070   -0.05521490   -0.03588930    0.00887170
H    2.77028770    0.26918790   -1.04402000    0.00627890    0.03415240   -0.01911790
H   -2.44789070   -3.23535110    0.26511340   -0.07823610   -0.03679840    0.01854250
H    2.07941370   -3.83280930   -0.64792980    0.02295440   -0.08773320   -0.02596720
C   -0.01618610   -3.13587270    0.04428970    0.00025170    0.00743180   -0.02484840
H    0.44970870   -4.00620430    0.68917520    0.05915340   -0.00417100    0.02825120
   15
   -420.11262302
H   -0.08475670    2.07465510   -0.50876810    0.04049640    0.09376860   -0.03991280
O   -0.96739470    1.19432170   -0.14503330    0.05500500   -0.14890990    0.03674140
O    1.24172070    1.02229440    0.04738070   -0.03363810   -0.00176010   -0.01207430
C   -0.76962550   -0.02795340   -0.02890530   -0.02870590    0.03990480   -0.01384830
C    0.75613000   -0.11287160    0.17765650    0.00913940    0.00058490    0.03226650
C   -1.77305260   -0.99943490    0.02246510   -0.12006930    0.06655260    0.03159350
C    1.50195380   -1.30978460    0.05295820   -0.05336370   -0.09985240    0.02259140
C   -1.33391690   -2.50232450   -0.08868390    0.01090490   -0.02839050   -0.10697350
C    1.36189900   -2.54376220   -0.15660580    0.03514110    0.14144320    0.04955980
H   -2.76281850   -0.87346690    0.22486080    0.05308970   -0.01833630    0.00030340
H    2.69873680    0.26660740   -1.28779410    0.00403990    0.02793730   -0.02012380
H   -2.21643840   -2.88374170    0.65849330   -0.04179060    0.01570150    0.04823490
H    1.98178480   -3.65125970   -0.58653440    0.01201070   -0.08073450   -0.02935430
C   -0.03065300   -3.09690360    0.03233620    0.00888700   -0.00692040   -0.02004140
H    0.34716180   -3.99322720    0.63318200    0.04879530   -0.00088750    0.02111320
   15
   -420.07600089
H   -0.18548930    2.02793360    0.01638600    0.02003020    0.06081720   -0.01947210
O   -1.08077790    1.36244770    0.18687000    0.01709970   -0.08635090    0.00073460
O    1.30997570    1.15662090    0.18122670    0.04718680    0.09192530    0.00087270
C   -0.82873140    0.14383930    0.02190220   -0.13920320    0.00782830    0.01975550
C    0.63421890   -0.21622280    0.09012760   -0.04164760   -0.19370620    0.02387050
C   -1.59794740   -0.87400400   -0.18648520    0.07201800    0.05024260    0.00095580
C    1.63778400   -1.14229490   -0.06174550    0.05488190    0.07515680   -0.01663090
C   -1.19405410   -2.24720280   -0.20198490    0.15606530   -0.05287570   -0.09474750
C    1.19096120   -2.53731140   -0.11701250   -0.01039610   -0.03556320    0.00257760
H   -2.54551350   -0.64537640    0.25136480    0.03007670    0.00467600    0.01668490
H    2.43076160   -0.52812070    0.31565710   -0.03901510    0.02226830    0.00591870
H   -2.23511480   -2.49287360    0.80627310   -0.05401730    0.01953640    0.06102860
H    1.54077890   -3.48923060    0.11085950   -0.06583630    0.01698070   -0.00454960
C   -0.13827340   -2.92952250   -0.30595320   -0.05060390    0.02099060   -0.02484790
H    0.09606970   -3.83516170    2.00133200    0.00335160   -0.00188380    0.02780240
   15
   -420.05068255
H   -0.19805700    1.60511870   -0.57706980    0.03058180   -0.00510010   -0.04695680
O   -1.09604440    1.20014930   -0.06819440    0.04944790   -0.14882710    0.05387290
O    1.12537130    1.05842490    0.10455190   -0.05504900   -0.06235220    0.00626570
C   -0.76862650    0.03886810   -0.05257080   -0.00596220    0.13948880   -0.02840550
C    0.64137910   -0.05225960    0.14517680   -0.05866060    0.08955760    0.02589510
C   -1.57131660   -1.09051830   -0.00989060    0.11144820   -0.10455530    0.03492040
C    1.50038630   -1.28324780   -0.04723760    0.00460610   -0.03773460    0.02084710
C   -1.28156770   -2.32829950   -0.25966530   -0.05947760    0.21036780   -0.11495350
C    1.33542560   -2.60725160   -0.07852750    0.02750100    0.08964310    0.00740130
H   -2.94639140   -1.02094060   -0.09029320   -0.08367320   -0.01692310   -0.00959640
H    2.56105300    0.66333890   -1.35251560    0.00313460    0.02297800   -0.01870640
H   -2.04392660   -2.85834210    0.39769590    0.00072210    0.00950260    0.04049120
H    2.03988980   -3.81940530   -0.22253000    0.01540060   -0.08698880   -0.00914980
C   -0.05297530   -3.26330660    0.05365120   -0.01512270   -0.13802500    0.04167550
H    0.21944830   -3.94485870    0.82147680    0.03512690    0.03897200   -0.00354870
   15
   -420.04849385
H   -0.12842280    1.53252460   -0.16153350   -0.08538580   -0.07372550   -0.00645570
O   -0.99372350    1.21628180   -0.04380650    0.16889320   -0.24985880   -0.00381970
O    1.19631480    1.14350970    0.10815440   -0.01530130    0.05411550   -0.01449270
C   -0.80404790    0.09915210   -0.14687530   -0.07488860    0.27146860   -0.02424290
C    0.73310330   -0.08208980    0.12602640    0.04976730   -0.14739400    0.03203440
C   -1.69592490   -0.91550630   -0.12628900   -0.09791570    0.07489450    0.02827570
C    1.31547320   -1.18061320   -0.18266570   -0.15201740    0.09897810    0.01794100
C   -1.18103380   -2.45876310   -0.11475420    0.12662190   -0.15488200   -0.00335150
C    1.49770690   -2.48594600   -0.01281740    0.07850170    0.08116120    0.03510650
H   -2.64630380   -0.54636850   -0.13399750    0.06360590    0.00545660    0.00215560
H    3.43624600   -0.12067510   -0.84335850    0.02634490    0.01690970   -0.01030020
H   -2.19767820   -2.68883390    0.15921220   -0.00477300    0.05588410   -0.00553570
H    2.13352190   -3.80019330   -0.14176990    0.01550700   -0.09396900   -0.00611140
C   -0.02144440   -3.02442800   -0.06434610   -0.09938990    0.07087410   -0.10031410
H   -0.05005280   -3.81673880    0.87214220    0.00041860   -0.00986000    0.05913530
   15
   -420.04547148
H   -0.13767420    1.47244330   -0.58815680    0.02083360   -0.02255280   -0.04562060
O   -1.07182210    1.15476130   -0.06730060    0.05452680   -0.16836330    0.04980480
O    1.05341000    0.91999040    0.05657480   -0.13980820   -0.24444300    0.00893560
C   -0.76254040    0.00270490   -0.07427720   -0.04249370    0.09273130   -0.03266370
C    0.63694820   -0.13474750    0.14529930   -0.00847770    0.19315310    0.03803640
C   -1.54850740   -1.00579160   -0.04218030    0.09977480    0.13414740    0.00932550
C    1.55414050   -1.21593820   -0.15659660    0.01100520    0.06584920    0.01492160
C   -1.18500760   -2.32931190   -0.30724280   -0.03865550    0.15953580   -0.09430030
C    1.34008910   -2.63579740   -0.08855640   -0.01529550    0.01815360    0.00603500
H   -2.62488880   -0.99962160    0.19433500   -0.00479730   -0.01815350    0.01232170
H    2.53966010    0.59442960   -1.44478430    0.00530810    0.02868310   -0.02381420
H   -1.82102220   -3.23461490    0.04518860    0.02260440   -0.04801650    0.02322660
H    1.87068320   -3.77170660   -0.15453270   -0.02582400   -0.08164230    0.00158110
C    0.05449100   -3.27391030   -0.02863380    0.00078130   -0.12087350    0.01403400
H    0.41324000   -4.14674040    0.57164200    0.06040470    0.01180300    0.01807650
   15
   -420.14804992
H   -0.23644810    1.60789680   -0.29305970   -0.01716800   -0.04703840   -0.01375700
O   -1.14579440    1.31241060   -0.02937140    0.01349760   -0.02781040    0.02115100
O    1.20043980    1.10459000    0.07875290   -0.00905510    0.04196070   -0.03666670
C   -0.78888930    0.08900230   -0.10526590   -0.01120330    0.06958350   -0.05746970
C    0.74233230   -0.10038550    0.30677090    0.04014650   -0.11174540    0.10126970
C   -1.70125300   -0.91872290   -0.13858480   -0.00505190    0.01946950    0.01842480
C    1.41912880   -1.20583630   -0.13049970   -0.08386090   -0.02766910    0.00425160
C   -1.21834730   -2.32420290   -0.09456210    0.06338490   -0.00093090   -0.07529780
C    1.54503000   -2.47165110   -0.05697750    0.06669650    0.13598380   -0.00209910
H   -2.75637760   -0.46470940   -0.08027530   -0.02301540    0.03505430    0.00903160
H    3.29222190    0.07120100   -1.09121650    0.02329020    0.02203030   -0.01590960
H   -2.05257760   -2.91903320    0.58272150   -0.02691780   -0.02310140    0.04864460
H    2.20365830   -3.47921990   -0.11109300    0.01452370   -0.06551430    0.00321490
C   -0.03550780   -3.04984470    0.08416770   -0.00013970   -0.01825410   -0.05760610
H   -0.41369020   -3.63771950    1.09087350   -0.04527520   -0.00183630    0.05277920
   15
   -420.05292090
H   -0.35298920    1.77332180   -0.19235980   -0.06576800   -0.03974130   -0.00086610
O   -1.12135930    1.27588000   -0.08772580    0.07460430   -0.00934110    0.00495070
O    1.27305530    1.14055730    0.02582770    0.01096150    0.09751480   -0.04468030
C   -0.82253170    0.03564020   -0.12642340   -0.10691090   -0.04529800   -0.04883140
C    0.85848560   -0.16561020    0.26703350    0.07710900   -0.22811310    0.07938100
C   -1.71845140   -0.87568860   -0.09944670    0.07154670    0.08980400    0.02927730
C    1.46449270   -1.19895380   -0.24089740   -0.11316000   -0.09901720    0.04094830
C   -1.15785650   -2.23464110   -0.02687350    0.06064620    0.04721500   -0.08523290
C    1.50828780   -2.39601270   -0.05507390    0.05117410    0.26656650    0.03086140
H   -2.90303190   -0.54289210   -0.14406200   -0.06205750    0.02791610   -0.00004780
H    3.35826870   -0.02106290   -1.04092960    0.02798440    0.02174720   -0.01386500
H   -2.08342040   -2.78219170    0.66338620   -0.04936660   -0.00855890    0.04770410
H    2.21126330   -3.76901710   -0.58524420    0.01661920   -0.07555560   -0.02687500
C    0.05193660   -3.00252580    0.07108270    0.00420670   -0.07770950   -0.01134530
H   -0.01004940   -3.70990000    0.85413120    0.00224520    0.03269020   -0.00149230
   15
   -420.04407918
H   -0.30994880    1.51434490   -0.59981220   -0.02230520   -0.05489660   -0.00141420
O   -1.11267070    1.20892220   -0.16240590    0.05428360   -0.18865640    0.01855530
O    1.24496470    1.09865380    0.07883930    0.00017540    0.06448170   -0.01989980
C   -0.75413040    0.08071390   -0.03606630   -0.03544800    0.17538610   -0.03434360
C    0.75311480   -0.12352730    0.17576750    0.01457750   -0.11937570    0.06240780
C   -1.69388760   -0.85035820   -0.08775020   -0.03576380    0.13134090    0.03984680
C    1.42870080   -1.21751050   -0.33224300   -0.09445570    0.03463200   -0.01096150
C   -1.21337020   -2.38728640   -0.20696720    0.04969210   -0.04848050   -0.12925080
C    1.52550990   -2.52779930   -0.15834830    0.05469380    0.05946850    0.00552830
H   -2.75500990   -0.85875610   -0.18426240    0.01075880   -0.02108970    0.00381420
H    3.73201530   -0.18966790   -0.70145300    0.03083130    0.01471870   -0.00450030
H   -1.90501250   -2.58257700    0.74436600   -0.00560740    0.03142360    0.04552150
H    2.28672380   -3.81564550   -0.13736280    0.03295970   -0.08955240    0.00880610
C   -0.06147640   -2.97214430    0.16747610   -0.10886320    0.01816600   -0.00338010
H    0.35582450   -3.77971170    0.88686850    0.05458370   -0.00770400    0.01966390
   15
   -420.04649548
H   -0.46547100    1.88737100   -0.18306900   -0.08783520   -0.05953040    0.01318680
O   -1.00498580    1.20783230    0.00498520    0.17958480   -0.04598100   -0.02104730
O    1.27929710    1.15320350    0.14423040    0.03350740    0.12573190    0.02271440
C   -0.78487550    0.00507620    0.11810630   -0.09260520    0.05360040    0.03249280
C    0.71880860   -0.12846290    0.02108430   -0.08085690   -0.10283190   -0.05597010
C   -1.65167650   -0.97598780   -0.05009980    0.05849250    0.11130840   -0.00507650
C    1.51920430   -1.33276180    0.09332620   -0.01596650   -0.21136170    0.00109340
C   -1.29459670   -2.49969530    0.05111680    0.04073330   -0.08827990   -0.00862840
C    1.35748100   -2.51691500   -0.00825040    0.06331410    0.20897340    0.11060740
H   -2.78584560   -0.95166550   -0.09382110   -0.03021410   -0.02069680   -0.00012680
H    3.32892060    0.96829060   -1.54789320    0.00444860    0.01039620   -0.00676910
H   -2.04170740   -3.14129430    0.43572660    0.02480010    0.00885470   -0.00101310
H    1.74818610   -3.33208300   -0.76857060   -0.02112880   -0.03028530   -0.04726540
C   -0.13613440   -3.04339280   -0.08861030   -0.12225250    0.07959850   -0.09090280
H    0.32870430   -4.15855260    0.82439510    0.04592580   -0.03948770    0.05671010
   15
   -420.01964897
H    0.13952120    1.80535280    0.14838650    0.02123670    0.05141120    0.01224520
O   -1.02014560    1.17943190    0.03133750    0.00345710   -0.10253420   -0.00103780
O    1.32368560    1.00872710    0.03020890    0.01268260    0.02167960   -0.01606900
C   -0.67803170   -0.00532270   -0.01428080    0.02842830    0.07377040   -0.01066660
C    0.77911400   -0.15741540    0.10523940   -0.06357790   -0.01805370    0.01598380
C   -1.58600730   -1.08311030   -0.04623890    0.03546970    0.06065930    0.00333810
C    1.55448400   -1.43148060    0.05857290   -0.07149660   -0.57598110   -0.04574430
C   -1.24421390   -2.44876250    0.09497840    0.00511350    0.07320350   -0.03587590
C    1.32067810   -2.48649380   -0.03882010    0.09615410    0.57736870    0.09544020
H   -2.70442140   -1.42907680   -0.14234810   -0.02196910   -0.07056740   -0.00126710
H    3.62870240    0.99904380   -1.21697850    0.00431210    0.01028220   -0.00515010
H   -2.16764360   -3.43108370    0.67576750   -0.03935370   -0.06768540    0.04071530
H    2.15377200   -3.26754240   -0.43004370    0.02954850   -0.02218740   -0.02386090
C   -0.11317650   -3.20468630   -0.06653680   -0.03470340   -0.00361120   -0.06826650
H   -0.10032000   -4.03851440    0.72796580   -0.00533920   -0.00769500    0.04017050
   15
   -420.00088933
H   -0.14217790    1.62415100   -0.10947620   -0.00855290   -0.01285320   -0.01445480
O   -0.99895380    1.12869250    0.05094380    0.01750830   -0.09033800    0.00420470
O    1.26580030    0.91247530    0.20501330   -0.03887110    0.00778580    0.01210950
C   -0.59696340   -0.04918190    0.02662360    0.04235150    0.09214410    0.02847340
C    0.85293810   -0.31276520    0.05452700    0.06552550   -0.23105170   -0.02396420
C   -1.61307250   -0.92927220   -0.18304510   -0.11379820    0.15629860   -0.03416950
C    1.53503600   -1.35230240    0.00113380   -0.07758210    0.05866060    0.01621250
C   -1.47929830   -2.46482580    0.12867500   -0.19285420   -0.09155930    0.07559620
C    1.23928050   -2.57580730    0.19190200   -0.07133610    0.10650360    0.06474210
H   -2.56090120   -0.99771330   -0.23224950    0.14163650   -0.04940840    0.01040410
H    3.59443050    1.27470470   -1.13039470    0.00832570    0.00926760   -0.00620410
H   -2.08590370   -2.80879580    0.84259870    0.06395320    0.04444280   -0.03754860
H    2.39386950   -3.12576680   -0.23068750    0.05730600   -0.00341500   -0.03842130
C    0.03501240   -3.26255390    0.01010970    0.13695940   -0.03882880   -0.06711330
H   -0.37648420   -3.83992930    0.83844490   -0.03036790    0.04224290    0.01010400
   15
   -420.00902574
H   -0.43430350    1.76902000   -0.03018150   -0.23667030   -0.21872360   -0.02729860
O   -1.00232340    1.21475060   -0.10023790    0.31442550    0.03214860    0.04614930
O    1.28245500    0.95910560   -0.04026550   -0.02457740   -0.02253940   -0.00413030
C   -0.70843680    0.07957370    0.08448830   -0.02267090    0.18886220   -0.00002050
C    0.72301630   -0.14253630    0.09151110   -0.07154290    0.00352580    0.01011910
C   -1.51217640   -1.00778150   -0.08125290    0.05565360    0.01535730    0.02398510
C    1.48638930   -1.37745430   -0.01229640   -0.01668060   -0.22030880   -0.01498700
C   -1.21434430   -2.40936010   -0.03593280   -0.05546500   -0.02276500    0.00141100
C    1.29742280   -2.56102100   -0.01523430   -0.03950140    0.23748950    0.02430400
H   -3.23541430   -0.90889140   -0.65605670   -0.07239830   -0.00471900   -0.03004260
H    3.38159650    1.45197890   -1.02373470    0.00950850    0.01062320   -0.00520850
H   -2.06014020   -2.78349580    0.44793040    0.02638120    0.04535780    0.00642480
H    2.36239930   -3.46309610   -0.03114860    0.05815170   -0.04893390   -0.00247550
C    0.02859730   -3.12661250   -0.19763780    0.09259800    0.04833220   -0.02986090
H   -0.16993190   -4.28675330   -0.14767300   -0.01721720   -0.04377880    0.00160720
   15
   -420.01739943
H    0.11287450    1.77624040   -0.25079890    0.04204620    0.02091170   -0.03498550
O   -1.02293680    1.20614890    0.04828290   -0.02804620   -0.11003580    0.02106410
O    1.31719010    1.04428420    0.31303520   -0.04245280   -0.07473820    0.01836840
C   -0.52901040    0.06293000    0.12478630    0.22677070    0.11837930    0.04051580
C    0.78109630   -0.03705300    0.14924480   -0.15079370    0.12732350   -0.01985070
C   -1.69536800   -1.01173870   -0.09829260   -0.06012710    0.10470960   -0.03520640
C    1.61952180   -1.39946520    0.10041510    0.02848370   -0.11466980    0.01545500
C   -1.43309420   -2.62317270    0.20092010   -0.14457630   -0.14669590    0.06668640
C    1.15687080   -2.60496820    0.01369820   -0.07401630    0.07940730    0.03860530
H   -2.81727780   -1.18816080   -0.25219680   -0.02610030   -0.05382540   -0.00417820
H    3.16250040    1.24904220   -1.15496560    0.00750350    0.01157540   -0.01012400
H   -2.24249970   -3.06120020    0.61518390    0.05085450    0.04465530   -0.01518040
H    1.78831240   -3.55498930   -0.36982220   -0.00906710   -0.04314790   -0.02340910
C   -0.02247820   -3.21735650    0.00309040    0.23298160    0.01230420   -0.08601440
H   -0.42789980   -4.04397620    0.65838530   -0.05343620    0.02380530    0.02821850
   15
   -420.01447951
H   -0.20376460    1.77188740   -1.15233760    0.04252570    0.03204000   -0.08337790
O   -0.96881580    1.31892400   -0.16402420   -0.00156590   -0.00467270    0.09007920
O    1.26313060    0.88849060   -0.08452410   -0.06025610   -0.03517060    0.00367650
C   -0.67814470    0.01748980   -0.11812690    0.06969410    0.06974980   -0.05311200
C    0.71341690   -0.19834510    0.09645490   -0.04751420   -0.01212710    0.01175070
C   -1.63729200   -1.15527540    0.13789160   -0.00043680   -0.26908200    0.08903130
C    1.48682230   -1.39934690    0.11955040    0.01256120    0.02194240   -0.00011120
C   -1.37407960   -2.36657320    0.22643010   -0.01052960    0.24469820   -0.07571800
C    1.31989410   -2.74900280    0.05862590    0.05631230   -0.05224920    0.01878700
H   -2.33341810   -1.13358860   -0.69093110    0.04529110   -0.02426430   -0.01674140
H    3.51676990    1.10710850   -1.76468140    0.00519780    0.00715660   -0.00621780
H   -2.40439590   -3.14254290    0.70628980   -0.05490610   -0.04223170    0.04298970
H    2.24819920   -3.18091570   -0.37503290    0.02302140    0.02439670   -0.01245470
C   -0.23339010   -3.10310330    0.09795950   -0.05751350    0.10678280    0.00296020
H   -0.49401420   -4.33577210   -0.04726870   -0.02210090   -0.06699400   -0.01165870
   15
   -420.27106570
H   -0.13028840    1.52127790   -0.00655870    0.00725840   -0.09587390   -0.02240140
O   -1.15496990    1.31243160    0.16332300   -0.08174970    0.00308710    0.01873580
O    1.43556850    1.18656100    0.11578990   -0.03091920   -0.04932170    0.00697520
C   -0.52316040    0.17379650   -0.07127090    0.11604710    0.14870980    0.00293770
C    0.98843290    0.07749950   -0.17019950    0.09370710    0.01337740   -0.02424370
C   -1.50028380   -1.00172310   -0.09950870   -0.17834880   -0.00842640    0.03961420
C    1.70108590   -1.10015240   -0.34583410    0.00503270    0.04284790    0.01075310
C   -1.20823450   -2.47463150   -0.14997710   -0.00811910   -0.06888400   -0.03300140
C    1.34049120   -2.49351830   -0.31658220   -0.01769410    0.05035890   -0.02701570
H   -2.47632190   -0.88443060   -0.29091550    0.07151180   -0.04278880    0.01395420
H    2.65860960   -0.62033230   -0.44681340   -0.03024850    0.02953570    0.00244860
H   -2.20113460   -2.10029200    0.32167900    0.00588610    0.10493110   -0.01936670
H    2.22854500   -3.40382580   -0.26102700    0.04020840   -0.06229360    0.00874250
C    0.05223490   -3.18776760   -0.01962030    0.01108840   -0.21671190    0.06403980
H    0.02909460   -4.07551000    0.28547380   -0.00363700    0.15145810   -0.04217390
   15
   -420.17551523
H   -0.35548980    1.52191050    0.12835230   -0.22359100   -0.15117390    0.00224510
O   -1.16281620    1.33924540    0.20400280    0.14604620    0.11346090    0.00221280
O    1.48738680    1.15766180    0.11849900    0.00991920    0.00396220    0.00549280
C   -0.50010840    0.07538990   -0.07478010    0.13479730    0.05256070   -0.01296400
C    0.97116270    0.01873210   -0.10741810    0.02606820   -0.07323980   -0.01864060
C   -1.48993830   -0.94024130   -0.13585660   -0.03176490    0.02809350    0.04252790
C    1.82230160   -1.02706650   -0.37200050   -0.04394820    0.09475130    0.00295470
C   -1.20557040   -2.52053260   -0.09944920    0.02987630   -0.10201740   -0.00803630
C    1.41952480   -2.47398080   -0.21698700    0.01450470    0.02363660    0.02310230
H   -2.83893340   -0.96232230   -0.20055080   -0.07712550   -0.04417440   -0.00063040
H    2.93327840   -0.37766720   -0.49021780    0.05421940    0.06081330   -0.00549400
H   -2.25355110   -2.04850950    0.16347110   -0.00250790    0.11408960   -0.01794150
H    2.00276740   -3.51474350   -0.38653950   -0.00449990   -0.06473870   -0.00896500
C   -0.00775900   -3.18746050   -0.04509130   -0.01539140   -0.08853360   -0.00843440
H   -0.09474890   -4.05383480    0.55375610   -0.01658480    0.03255280    0.00260130
   15
   -420.10572440
H    0.01104810    1.66777450    0.00922740    0.01372570   -0.04997790   -0.02082620
O   -1.10752470    1.23676200    0.06379840   -0.04066230   -0.16070450   -0.01781240
O    1.50695950    1.25163180    0.16454550    0.01534960    0.00116330    0.02116860
C   -0.47313640    0.23977400   -0.09043970    0.07267840    0.23231970    0.04402000
C    1.02701350    0.08076990   -0.15638010    0.16179980   -0.04797650   -0.03323280
C   -1.60674830   -0.95380140   -0.16661590   -0.22849480    0.00877740    0.01888180
C    1.66698730   -1.08524480   -0.36099680    0.08409600    0.08133790    0.00983490
C   -1.18824660   -2.34420490   -0.15488360   -0.01793940   -0.00116000    0.00197380
C    1.45861990   -2.45098450   -0.30843950    0.14488720   -0.01853000    0.00608650
H   -2.48812170   -0.70524530   -0.54486830    0.08293700   -0.02606410    0.02043780
H    2.24710070   -0.35157770   -0.23690590   -0.22353220   -0.03985880   -0.00523810
H   -2.06293990   -1.99022470    0.51217010    0.02503520    0.07219310   -0.02748350
H    2.22445840   -3.06075430   -0.39224470   -0.07913900    0.05974650    0.00594390
C    0.05924050   -3.21783260   -0.23792800   -0.00573910   -0.26521490    0.05376910
H    0.17871260   -3.99948880    0.25402400   -0.00501670    0.15394190   -0.07756440
   15
   -420.20231092
H   -0.10327240    1.86937950    0.15996490    0.05963310    0.00938590   -0.00781910
O   -1.15261860    1.30637720    0.15629390   -0.09420390   -0.04218170    0.00350310
O    1.40922410    1.19841240    0.11424500   -0.02831130   -0.09534840    0.00005330
C   -0.53728300    0.14135340   -0.05925100    0.15710540    0.04349870   -0.00290050
C    0.85697030    0.18167770   -0.17968780   -0.02685480    0.14789360   -0.03077710
C   -1.53037700   -0.96946260   -0.09611090   -0.02788650    0.01136930    0.06326300
C    1.80563520   -1.11508490   -0.30177320    0.11711930    0.00571210    0.01143160
C   -1.21863300   -2.52306490   -0.11644030    0.09201460   -0.13446630   -0.03222770
C    1.28154650   -2.46962340   -0.28855840    0.01200610    0.00880570   -0.00338720
H   -2.91556260   -0.93228200   -0.27574910   -0.08664810   -0.02948720   -0.00483580
H    2.49660770   -0.41005000   -0.70583840   -0.05520740    0.03397730    0.01027880
H   -2.18611490   -1.98237130    0.43869600   -0.00201220    0.08969860   -0.01822680
H    1.69253440   -3.44302700   -0.60524610   -0.04078660   -0.02277340    0.00089420
C   -0.07054040   -3.12467920    0.11454240   -0.04735960   -0.03320510    0.01240250
H   -0.24868940   -4.16897400    0.35500090   -0.02859270    0.00714370   -0.00167120
   15
   -420.16431416
H    0.29542200    1.88707770    0.35798750   -0.00230080    0.02465610    0.01932260
O   -1.15893790    1.28677660    0.19515220   -0.06648160    0.01453720    0.01355070
O    1.45576990    1.28241410    0.02955550    0.06485240    0.01363700   -0.01073600
C   -0.61173730    0.09137580   -0.13478640    0.05456660   -0.04509070   -0.03591990
C    0.88709420    0.12210810   -0.14298110   -0.04140010    0.05159050    0.00446210
C   -1.51498810   -0.99274960   -0.16941030   -0.00420100    0.11515630    0.03088720
C    1.81029240   -1.22297060   -0.26073610    0.07522200   -0.18401780    0.00817370
C   -1.29101640   -2.66840550   -0.18038450   -0.18275270   -0.09113190    0.01991850
C    1.22360230   -2.35210210   -0.28883040    0.04925500    0.09125370   -0.01169980
H   -2.59075520   -1.62454030   -0.21277740    0.00299620   -0.14344190    0.01461980
H    2.64102000   -0.88378720   -0.75371880   -0.06112060    0.00135950    0.00462860
H   -2.19079510   -2.47527350    0.17150130    0.07715720    0.10396120   -0.05688620
H    1.74571560   -3.19156530   -0.14074030   -0.09199090    0.04936960    0.00938930
C    0.08579010   -3.11872460   -0.09383600    0.12595880    0.02532070   -0.03646850
H    0.22004930   -4.15827500    0.39220510    0.00023420   -0.02714290    0.02673590
   15
   -420.19026301
H    0.07156850    1.73005180    0.15647480    0.01734280   -0.02544900   -0.00568390
O   -1.10966740    1.32084200    0.11504110   -0.08513160   -0.01883690   -0.00317770
O    1.38282550    1.25206540    0.12111950   -0.06609620   -0.16782600   -0.02152920
C   -0.50605490    0.19845350   -0.02509500    0.06476240    0.12577240    0.02175790
C    1.04318310    0.16571840   -0.14555370    0.11289210    0.16356000    0.00364220
C   -1.44302760   -1.02868850   -0.10506080   -0.05993700   -0.10556470    0.03144630
C    1.76292110   -1.07028560   -0.29187830    0.35982270    0.08952920   -0.00683020
C   -1.18875130   -2.48156900   -0.14786880    0.07058940   -0.12672700   -0.01194850
C    1.30940310   -2.46979840   -0.29056770    0.00705890    0.06517060   -0.02904860
H   -2.53396880   -0.36941010   -0.23709850   -0.04582150    0.05336320   -0.00596690
H    2.59284970   -0.94619300   -0.31430640   -0.36521870   -0.04692440    0.01338990
H   -2.27218290   -2.01574580    0.09760780    0.01185420    0.09849230   -0.01192970
H    1.90839940   -3.65006450   -0.24786860   -0.00229840   -0.08822460    0.00920090
C    0.03158620   -3.10329690   -0.02859450    0.01492200    0.01645400    0.00974830
H   -0.20010580   -4.23209030    0.12238010   -0.03474890   -0.03266320    0.00696190
   15
   -420.04808987
H    0.18445270    2.10553290    0.06277180    0.01806070    0.05192690   -0.01298490
O   -1.03647290    1.40817340    0.15919620   -0.02499420   -0.06968820    0.00112240
O    1.46269810    1.21550950    0.12675930   -0.00009690   -0.02832630    0.02897310
C   -0.64181780    0.26298330   -0.08478760    0.00262690    0.08884410    0.02370060
C    0.96280970    0.13377610   -0.28239420    0.08760100   -0.00227130   -0.05510070
C   -1.55052920   -0.95651670   -0.14088700   -0.03192950   -0.03870710    0.03540580
C    1.56236990   -1.11207380   -0.36888880   -0.10765500   -0.08372760    0.05565060
C   -1.28218260   -2.36197750   -0.14365590    0.00292850   -0.00020140   -0.03151080
C    1.36251890   -2.40209780   -0.39015250    0.05021020    0.15218110   -0.08525140
H   -2.66557630   -1.23999930   -0.35556090   -0.00330240   -0.12008370    0.02884280
H    2.94994500   -0.47027650   -0.92982110    0.05417700    0.04243740   -0.03505390
H   -2.54143720   -1.96118970    0.19564240   -0.04094360    0.12275600   -0.03437990
H    2.43434690   -3.39879340    0.29280860    0.05003210   -0.05416790    0.05019820
C   -0.11304030   -3.13712790   -0.03441510   -0.02866390   -0.01237110    0.02113050
H   -0.32961540   -4.29060090    0.14715580   -0.02802280   -0.04861820    0.00925540
   15
   -420.21053764
H   -0.57456430    2.34645460    0.29446250    0.01013530    0.08262890    0.01299970
O   -1.07233350    1.38451200    0.17919180   -0.00490490   -0.01484630    0.00535190
O    1.46296210    1.22513280    0.07826690   -0.06882460   -0.06982940   -0.00486910
C   -0.45362340    0.13540620   -0.09906010    0.05253430    0.01915470   -0.04208810
C    0.96683710    0.17097460   -0.10184750    0.01756610    0.11216790    0.00049420
C   -1.35182880   -1.08514660    0.04780950   -0.08404170   -0.09668640    0.06090370
C    1.78253240   -1.25471040   -0.32158580    0.08155000   -0.13201160   -0.01116850
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C   -0.01439040   -3.12814950    0.08187040   -0.04875460    0.08413620    0.03046130
H    0.00066560   -4.49652580    0.36311930   -0.00350610   -0.08771930    0.02028600
   15
   -420.26255039
H   -0.32409860    2.13005240    0.07736040    0.01771260    0.05199670   -0.00176210
O   -1.05263470    1.37318010    0.12376260   -0.00251850   -0.01639580    0.00824460
O    1.45206470    1.19261690    0.04532260   -0.04774550   -0.05995440    0.00216440
C   -0.65225230    0.12462080   -0.13851270   -0.05800630   -0.03360280   -0.01268630
C    1.05333570    0.11082770   -0.23718140    0.13194020    0.02356890   -0.01970310
C   -1.50726380   -0.96265710   -0.10153460    0.03737390   -0.03924450    0.05340540
C    1.66569060   -1.11007280   -0.38861980   -0.06930100    0.01396110    0.04220870
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H   -2.73762840   -0.72201550   -0.30080800   -0.06338330   -0.01196760   -0.00580160
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C   -0.02412150   -3.23304800    0.00299650   -0.01707430   -0.08852500    0.05663920
H    0.14672960   -4.36828930   -0.18491210    0.02143170   -0.04121070   -0.01390670
   15
   -420.30203651
H   -0.19018460    1.68098020   -0.35399710    0.03426220   -0.03938780   -0.04082250
O   -1.04469490    1.29300440    0.15423620   -0.06263730   -0.01035610    0.05046900
O    1.37770920    1.31785430    0.15778580   -0.04477880    0.01445740    0.01854880
C   -0.46661060    0.10952550   -0.10963740    0.07611160    0.07632930   -0.01918770
C    1.07416240    0.13686440   -0.11709610    0.06600630    0.03865790   -0.02209790
C   -1.47474830   -0.95759960   -0.08439400   -0.18183740    0.02908720    0.04576100
C    1.82051970   -1.20633940   -0.12143560   -0.00255760   -0.09403560    0.03102830
C   -1.23913720   -2.51005000   -0.16990720    0.00603930   -0.09615610   -0.05742350
C    1.34127830   -2.45817180   -0.43536820    0.00213480    0.05977690   -0.07371140
H   -2.37184760   -0.73529200    0.29990940    0.06994160   -0.03675230   -0.01489640
H    2.85057980   -0.76202320   -0.14229080    0.00214490    0.03753880    0.00074940
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H    2.04146670   -3.34963280   -0.34530150   -0.00488800   -0.03280680    0.01475790
C    0.10086030   -3.13627450    0.04318560    0.06726710   -0.02861480    0.05324770
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   15
   -420.24265115
H   -0.21442230    2.11449450    0.02107380    0.04648380    0.06414310   -0.01615650
O   -1.08490710    1.33250090    0.18081490   -0.05599490   -0.03389820    0.03042030
O    1.48088160    1.19692330    0.20528390   -0.00740730    0.02177260    0.02658600
C   -0.61041630    0.12831020   -0.13598040   -0.07371870    0.01430040   -0.05943420
C    1.03261730    0.07313170   -0.14567190    0.05845990   -0.01944230   -0.03370470
C   -1.51209600   -1.01983820    0.05221790   -0.09115760   -0.06370310    0.05821170
C    1.76394170   -1.17505660   -0.32774690   -0.05733390   -0.04224630   -0.00244620
C   -1.25965640   -2.38445550   -0.27733110    0.01185910   -0.00893610   -0.09373310
C    1.37629650   -2.52075060   -0.21570360    0.04066950   -0.02512240    0.01202030
H   -2.12643960   -0.37402310   -0.46248170    0.09683100    0.00770890    0.01736180
H    2.96504270   -0.68942670   -0.42315880    0.06168080    0.04682890   -0.00087260
H   -2.38916140   -2.11367090    0.44772110   -0.02338290    0.05393320    0.02480460
H    2.07906400   -3.23498210   -0.70930370    0.00720720   -0.00425420   -0.02496480
C   -0.03743430   -3.06489080    0.16006540   -0.03319920   -0.01069920    0.08443550
H    0.09667670   -4.11090100   -0.18306580    0.01899960   -0.00039200   -0.02253470
   15
   -420.19490794
H   -0.11167010    1.74441090    0.30455550    0.03759900    0.00195300    0.00048140
O   -1.06638310    1.22218750    0.24430830   -0.06420440   -0.02212060   -0.00085180
O    1.47733020    1.31812770    0.03466640   -0.02302730    0.01272020    0.00208520
C   -0.54292440    0.05925380   -0.07626650    0.01893990    0.05328930    0.00736760
C    1.15916480    0.13773440   -0.17463160    0.13891650    0.00936910   -0.00095890
C   -1.57341420   -1.06296670   -0.11932290   -0.13734960   -0.09658220    0.02682110
C    1.75998290   -1.13611300   -0.36295700    0.27098850    0.04501640    0.06181950
C   -1.22918360   -2.52358800   -0.10535160    0.06700630   -0.11523240   -0.00978420
C    1.32027140   -2.42574940   -0.40209720    0.01066930    0.09578180   -0.06089170
H   -2.47542210   -0.47030970    0.16434760    0.00661210    0.03174540    0.01143740
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H   -2.23862730   -2.15164200    0.14224440    0.03998040    0.10975580   -0.02975830
H    2.23434630   -3.53435200   -0.18277110    0.04546410   -0.07782230    0.01930860
C   -0.01740950   -3.06886490    0.00385210   -0.05933020   -0.08682850    0.06766750
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   15
   -420.19168002
H   -0.49481930    2.19611050   -0.21344330    0.02801260    0.08578560   -0.04448310
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O    1.54972160    1.28398250    0.12059210    0.00426250    0.04707330    0.03708290
C   -0.45353910    0.03201770    0.01147450    0.01694700   -0.05263570    0.02564400
C    1.11856280    0.13170720   -0.22554990    0.02525000   -0.01972960   -0.06569550
C   -1.45217570   -0.91595280   -0.11310040   -0.25324470    0.05803670    0.05565690
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C   -1.12967270   -2.45053830   -0.15867430    0.04979650   -0.08423950   -0.04289480
C    1.34341490   -2.42670920   -0.38033220    0.01090470   -0.01928420   -0.05151090
H   -2.34244070   -0.90165200    0.17415960    0.15429410   -0.06673730   -0.04112780
H    3.10878350   -1.00281680   -0.59026420    0.07532190    0.00576600   -0.02079600
H   -2.36526920   -2.04403480    0.01529440   -0.03757760    0.13437430    0.00155630
H    2.12142130   -3.11902210   -0.42164180   -0.02833170    0.02644530    0.00671650
C    0.13003550   -3.07471510    0.11424720    0.05221200   -0.36736850    0.14871260
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   15
   -420.25135117
H   -0.08874490    1.90934860   -0.10369630    0.02397690    0.01888290   -0.02438280
O   -1.06747730    1.31344740    0.09400910   -0.06063300   -0.01387070    0.01673630
O    1.32132210    1.39594170    0.12024900   -0.04431110    0.03689030    0.03350860
C   -0.48988240    0.15242780   -0.03866010    0.06992870    0.06549480    0.02419990
C    1.10522130    0.13974040   -0.21644600    0.11458650   -0.03592970   -0.05726800
C   -1.51646740   -1.00972660   -0.10423050   -0.06307360   -0.04029780   -0.01792510
C    1.73796400   -1.12446440   -0.27879400   -0.00143700   -0.04786480    0.03473020
C   -1.16713730   -2.51102000   -0.08791560   -0.01575980   -0.11464280   -0.01719490
C    1.33945540   -2.48653610   -0.54913280   -0.05568700   -0.01198550   -0.07173290
H   -2.75264770   -0.70304090    0.19244660   -0.07459320    0.01121660    0.02349270
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H   -2.23173460   -2.21579760   -0.07807890    0.02312770    0.10409720   -0.01147030
H    2.49592990   -2.85463060   -0.63823900    0.06690700    0.02147490   -0.00237640
C    0.18709930   -3.10754370    0.08730080    0.06237900    0.03897370    0.04047730
H   -0.01977050   -4.25963690    0.41914790   -0.03115250   -0.05071030    0.02565200
   15
   -420.20337853
H   -0.02083880    1.86508170    0.30413560    0.03601730    0.00439670   -0.00248350
O   -1.03817870    1.35147760    0.29037950   -0.01686760   -0.11382050   -0.01579270
O    1.35051720    1.17652770    0.04900610   -0.10981470   -0.21871950   -0.02486070
C   -0.60556080    0.24635400   -0.00850580    0.00961140    0.18224200    0.02024280
C    0.89302050    0.14765150   -0.01388130    0.04269320    0.23516900    0.04537700
C   -1.49357000   -0.94353390   -0.14889720   -0.07524110   -0.15128550    0.01991890
C    1.83777640   -1.21728650   -0.25838300    0.07444460   -0.16801670   -0.00334700
C   -1.21356750   -2.32834320   -0.08584840   -0.13720740    0.03025160    0.01580910
C    1.35498610   -2.40896000   -0.34124810    0.17300000    0.05083640   -0.02687200
H   -2.53339710   -0.42633990    0.01321480   -0.02144680    0.03624110    0.01328140
H    2.87972020   -0.98024790   -0.41603580   -0.00380770   -0.00357010   -0.00422200
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C    0.05007280   -3.14735310    0.08156730    0.03538800   -0.01958750    0.03468620
H   -0.03491990   -4.43996280    0.23454270   -0.00946950   -0.08578820    0.01071660
   15
   -420.11704028
H   -0.24488460    1.28456880   -0.49922170    0.01892760   -0.11454850    0.00942900
O   -1.12951850    1.34224930    0.12804190   -0.06694820    0.03814640    0.02978690
O    1.34528660    1.35114880    0.22376860   -0.03964470    0.07931680    0.04149650
C   -0.41382830    0.15453370   -0.01412530    0.15794350    0.14331350   -0.02464630
C    1.03635420    0.07325270   -0.17804320    0.05601260   -0.09300100   -0.06502660
C   -1.47636460   -1.04968780   -0.08512980   -0.12509800   -0.01419650   -0.00489970
C    1.63846670   -1.16804870   -0.30530780   -0.13763500   -0.05144960    0.00277320
C   -1.20724740   -2.56853090   -0.20812050   -0.00055260   -0.09595590   -0.03300040
C    1.35013630   -2.45823980   -0.51545630    0.01493780    0.12288050   -0.05208030
H   -2.50207280   -1.03641760    0.29736200   -0.00151730   -0.04483630    0.00024870
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C    0.09992850   -3.14969890    0.08135500    0.01962670    0.03986090    0.06743280
H    0.14657150   -4.39627000    0.33049630   -0.00067350   -0.07201990    0.02064800
   15
   -420.24910113
H   -0.38758610    2.23821020   -0.19781600    0.02884260    0.07892290   -0.03258430
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O    1.28555390    1.25917980    0.12881350   -0.11122360   -0.09788560   -0.00246740
C   -0.49045670    0.20796750    0.02933200    0.01424650    0.14092450    0.05985710
C    1.02112380    0.13995520   -0.16210050    0.07930800    0.06626230   -0.02980440
C   -1.39456410   -0.89988140   -0.09772090   -0.02213700   -0.03094330   -0.02178310
C    1.80713450   -1.09824580   -0.18037030   -0.04606070   -0.04140620    0.00833420
C   -1.16557380   -2.45139010    0.00954830    0.01364530   -0.10502120   -0.00501730
C    1.37526500   -2.40664750   -0.43768860    0.10622940   -0.07528500   -0.06705730
H   -2.54198890   -0.61915140    0.23384520   -0.05217690    0.00264370    0.02447860
H    3.12031650   -0.63911430    0.09431120    0.07583990    0.04074190    0.02597670
H   -2.16758710   -2.06067860    0.23302280    0.02622200    0.10163770   -0.02075720
H    2.16516860   -2.95711160   -0.35574290   -0.08948100    0.08559900    0.00033510
C    0.02773250   -3.09066370    0.06253310   -0.03507480   -0.10629430    0.06164520
H    0.12820740   -4.07118840    0.18055550   -0.00563690    0.08455220   -0.01066400
   15
   -420.28374304
H   -0.05498500    1.93502440   -0.14243730    0.03159050    0.01979880   -0.03253790
O   -1.02610860    1.32087460    0.13934860   -0.07945490   -0.01430270    0.03402280
O    1.40717730    1.34757690    0.13014740   -0.03616190   -0.00500270    0.01956190
C   -0.39557520    0.16878150   -0.04790780    0.09513410    0.08897590   -0.00221560
C    1.10021780    0.12693120   -0.11403320    0.08318050   -0.07462160   -0.03297550
C   -1.42083670   -1.00241640   -0.04964870   -0.19769850    0.00679320    0.03120130
C    1.82892800   -1.01064020   -0.13021300   -0.06037370    0.09388080    0.07790120
C   -1.23062530   -2.51161790   -0.03724810    0.04664040   -0.12704350   -0.03340190
C    1.37685930   -2.47384760   -0.49060880    0.00456250   -0.04501450   -0.10478110
H   -2.31991990   -0.62318330    0.00863430    0.09828140   -0.04014240   -0.00060560
H    2.99181220   -0.77576240   -0.42215330    0.05369030    0.01698780   -0.02394280
H   -2.30258150   -2.10191590    0.41795980   -0.02468910    0.09844110   -0.00162630
H    2.35824860   -3.06804510   -0.31217140    0.04043100   -0.00402200    0.01876470
C    0.01993640   -3.11356280    0.05166860   -0.06656970    0.01877560    0.05063930
H    0.16202000   -4.25084850    0.14158300    0.01143920   -0.03348310   -0.00002060
   15
   -420.25246440
H   -0.18720920    1.83591710    0.31779870   -0.00315760   -0.02456130   -0.00005380
O   -1.05856090    1.37080700    0.21987900   -0.02861420    0.04414940    0.00573280
O    1.36806140    1.29553810    0.11914200   -0.03731920    0.02190800    0.03540500
C   -0.48837640    0.14638150   -0.02869000    0.05865860    0.01384000   -0.00397160
C    0.95774540    0.15357500   -0.28624630    0.00698100    0.02325010   -0.06972620
C   -1.39553270   -0.98277100    0.14210020   -0.01812100   -0.10965420    0.12102940
C    1.67505140   -1.22939210   -0.30408010   -0.04943190   -0.15371740    0.01975640
C   -1.20582200   -2.31603640   -0.20250870   -0.08992760    0.06252370   -0.04622840
C    1.30079460   -2.45671120   -0.23753070    0.00118970    0.22318680   -0.02272060
H   -2.45289820   -0.56199590   -0.32785320   -0.03519420    0.02369530   -0.04874450
H    2.78851960   -1.16543770   -0.38673530    0.01816610   -0.01229140   -0.00342730
H   -1.90042120   -2.20461150    0.58044370    0.07381530    0.08214130   -0.02966740
H    2.16344860   -3.39291290   -0.15881950    0.02459570   -0.06210490    0.00858090
C    0.13881010   -3.26567980   -0.00644190    0.10895100   -0.04490220    0.03203080
H   -0.13329910   -4.56206360    0.02145160   -0.03057280   -0.08740940    0.00199940
   15
   -420.15409302
H   -0.39111170    1.97122580    0.31457620   -0.01866770    0.00849360    0.00236610
O   -1.05479410    1.27665560    0.19670970    0.03515210    0.04861870    0.00245860
O    1.21978640    1.34055080    0.17519830   -0.08285650    0.04186340    0.02037020
C   -0.52971780    0.01338410   -0.01692160   -0.03354130   -0.08820100    0.00909460
C    1.08726390    0.11616080   -0.13852030    0.10093700   -0.02468230   -0.03784500
C   -1.31686820   -1.03675610   -0.02241640    0.08221660    0.06274890    0.00810140
C    1.78374320   -1.17611510   -0.23630250    0.18051340   -0.04319110    0.03630200
C   -1.06531090   -2.48694200   -0.07736560   -0.10282800   -0.08797480    0.01580970
C    1.35639630   -2.51993620   -0.43401840   -0.02737500   -0.04800330   -0.06671520
H   -2.56545800   -1.55629500    0.38786300   -0.01608220   -0.11819950    0.02088570
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H   -1.88377320   -2.37156930    0.43576040    0.07996630    0.12126550   -0.06002500
H    2.45961640   -2.60140470   -0.30407490    0.01924520    0.09055840    0.00797510
C    0.13114180   -3.08008080    0.14321980   -0.00887060    0.00389770    0.06809200
H   -0.32390390   -4.02472580    0.19991290   -0.03766190    0.05957930   -0.01268650
   15
   -420.12950051
H   -0.38212750    1.87540600    0.42950770   -0.02392240   -0.02243630   -0.00483500
O   -1.08400150    1.28300990    0.17431900   -0.02870340    0.03524800    0.01802220
O    1.41642610    1.00885430    0.18932090   -0.10725840   -0.15541650   -0.02978110
C   -0.45979960    0.07455550   -0.10791220    0.03687430    0.01504460   -0.04131760
C    1.08498600   -0.07464350   -0.06658480    0.20168110   -0.04288870   -0.03550280
C   -1.49873060   -0.89651830   -0.05428390   -0.11015440   -0.04970690    0.08907390
C    1.71384730   -1.16866190   -0.32385670   -0.10288620    0.02806230    0.06983370
C   -1.24486960   -2.23903480   -0.27379880   -0.05806460    0.07602060   -0.05940870
C    1.23409520   -2.40851910   -0.38490150   -0.07947750    0.10778800    0.04486620
H   -2.16232180   -0.29318520   -0.58878330    0.07393550    0.00802520   -0.00509470
H    2.67543310   -0.63391260   -0.88801230    0.02652940    0.05186800   -0.02936960
H   -1.82528290   -2.07008170    0.64441810    0.05904400    0.06337810   -0.02828360
H    2.49461550   -2.96193940   -1.10692960    0.06937730   -0.00473390   -0.03869510
C    0.13597210   -3.22503640    0.08181620    0.05290670   -0.06201420    0.07306450
H   -0.01664080   -4.34519850   -0.26842930   -0.00985390   -0.04823710   -0.02256930
   15
   -420.17420008
H   -0.50187770    2.30352190    0.48419120    0.01722440    0.09921460    0.03725110
O   -1.03366350    1.30613630    0.15499900    0.00788230   -0.08185620   -0.01239680
O    1.40357750    1.22765920    0.18839630   -0.03516050   -0.01589140   -0.00316330
C   -0.51380170    0.09775940   -0.16326890   -0.05191560   -0.04421030   -0.07535970
C    0.94154940    0.13103760   -0.07576250   -0.01424100    0.05354360    0.01966520
C   -1.48545080   -0.87615580   -0.05586830   -0.05982100   -0.09366960    0.09266170
C    1.82575890   -1.13485240   -0.47884350    0.04982780   -0.12949210   -0.03950760
C   -1.38272720   -2.24101720   -0.06087110   -0.12538640    0.03161220   -0.01264110
C    1.32763130   -2.36098590   -0.41525530   -0.04217320    0.10229560   -0.01635270
H   -1.95480140   -0.15795880   -0.81283630    0.06798610    0.04120170   -0.02263800
H    2.73675960   -0.50575440   -0.46784190   -0.01659240    0.04139590    0.01578420
H   -2.32328470   -1.98199000    0.26972660    0.09042930    0.07863080   -0.02800830
H    2.36692980   -3.13764190   -0.65813600    0.06957920   -0.02873510   -0.01387580
C    0.06673380   -3.05560750    0.17183870    0.04111470   -0.12178280    0.04986490
H   -0.12666860   -3.89915320   -0.36604720    0.00130120    0.06776570    0.00869200
   15
   -420.24850943
H   -0.08723040    1.72268580    0.32872670   -0.02332250   -0.05719250   -0.00824160
O   -0.97441150    1.34960120    0.26751770    0.01084140    0.01358170   -0.00567960
O    1.32861090    1.16566850    0.11803320   -0.13659450   -0.19067940   -0.02959090
C   -0.46329710    0.15647870    0.04029150    0.14930320    0.06886120    0.01274610
C    0.90952340    0.16005760   -0.22482020    0.01480830    0.22747860    0.01408570
C   -1.46545630   -0.91050800    0.06612730   -0.03235270   -0.01441260    0.10579650
C    1.64869660   -1.20419510   -0.36158370   -0.02385220   -0.03985130    0.00591430
C   -1.25127590   -2.35247630   -0.23704880   -0.03576760   -0.00807030   -0.07843830
C    1.27592750   -2.52430380   -0.24467210   -0.04903390    0.08036880   -0.02813370
H   -2.57559440   -0.64159490   -0.39202310   -0.05294030   -0.00150480   -0.03872450
H    2.79649590   -1.31943360   -0.41388000    0.03671750   -0.04227430    0.00109230
H   -2.15378310   -2.09648210    0.48483020    0.00734520    0.08127320    0.00881160
H    2.49683430   -3.06962580   -0.08098360    0.08337360   -0.00584460    0.01215870
C    0.07452830   -3.29322680   -0.02012650    0.06777330   -0.11436850    0.02417910
H   -0.18996960   -4.31269790    0.22860130   -0.01633100    0.00264210    0.00404120
   15
   -420.22188155
H   -0.33875130    2.00751180    0.02071010   -0.02968970   -0.01037550   -0.00157340
O   -0.98204450    1.30745150    0.06233130    0.04567030    0.01137440   -0.00327030
O    1.39127360    1.31758000    0.01811660   -0.05382000    0.04390140    0.00208850
C   -0.47751370    0.10404990   -0.07456140    0.03976760    0.05896840    0.00049870
C    1.08232670    0.10201880   -0.10257370    0.07508320    0.02254080    0.02253140
C   -1.54082510   -1.00974910   -0.04481580   -0.27439960   -0.01756950    0.13771670
C    1.74214800   -1.30069780   -0.36696760   -0.10869280   -0.11246420    0.00256550
C   -1.30608410   -2.47854170   -0.05030580   -0.01105720   -0.06653830   -0.02522660
C    1.44681470   -2.59076920   -0.55402410    0.11428970    0.03450180   -0.06224800
H   -2.20821360   -0.97173210    0.56500360    0.16927430   -0.07824900   -0.12678080
H    3.03931260   -0.99703660   -0.45702380    0.07415010    0.02258240   -0.00373530
H   -2.44668710   -2.14009770    0.41818170   -0.03368380    0.12337830    0.01313500
H    2.17721110   -3.37141050   -0.45610660   -0.01096310    0.00191630    0.01186500
C   -0.03074020   -3.18635630   -0.08481890    0.01003910   -0.15771820    0.07161120
H   -0.09907390   -4.05910440    0.30933510   -0.00603410    0.12377050   -0.03918150
   15
   -420.17606161
H    0.04360370    2.23569310   -0.02751390    0.03341620    0.06418010   -0.02772310
O   -0.91829790    1.41507500    0.31896170    0.00546050   -0.11730280    0.03634500
O    1.53803240    1.31062390   -0.05335150    0.03189780    0.04373810   -0.03938480
C   -0.52282160    0.29625900   -0.10697810   -0.03211600    0.09081390   -0.06916300
C    0.90965990    0.14930030    0.17999900   -0.08545890   -0.03233820    0.12552750
C   -1.35228390   -0.82269980   -0.26675430    0.02463500    0.00656530    0.05586780
C    1.72897670   -1.06316480   -0.39046970    0.12380610   -0.04190560   -0.06717080
C   -1.28931710   -2.49794740   -0.03861370   -0.04463340   -0.11229830   -0.02000530
C    1.36668530   -2.38415710   -0.30825950    0.09742590    0.00436260   -0.02163580
H   -2.27246700   -0.29441790   -0.85830210   -0.02056380    0.04363360   -0.03608370
H    2.67729920   -0.81586060   -0.69929470   -0.04496270   -0.01247720    0.00904970
H   -2.36199340   -2.10286120    0.57959420   -0.04645960    0.06426100    0.02604960
H    2.31726060   -2.60060980   -0.42472250   -0.08298320    0.09431920    0.02009330
C    0.11084730   -3.23785980    0.02920110    0.02580700   -0.27952010    0.05990310
H   -0.17245580   -4.07208620    0.29895860    0.01476110    0.18396010   -0.05168420
   15
   -420.10433184
H   -0.78863790    2.11744440   -0.08039710   -0.08606720   -0.24967980    0.07459340
O   -0.96355290    1.34810060    0.10876060    0.10244390    0.27010630   -0.05441450
O    1.52632350    1.21832580    0.29865170    0.00672840    0.04475430    0.03024720
C   -0.47255280    0.11581280   -0.33937280   -0.02516170   -0.05879150   -0.07958710
C    0.98325770    0.16850180   -0.14741680   -0.03627940    0.03191750   -0.02101200
C   -1.46639400   -0.88024520   -0.00916340   -0.09490030   -0.06715310    0.11439510
C    1.79554050   -1.22333200   -0.36261530    0.05354230   -0.03942120    0.04421520
C   -1.20603280   -2.20956230   -0.31046070    0.01286180    0.07016550   -0.14834420
C    1.28232470   -2.58554700   -0.45834050    0.27532960   -0.34509560    0.02513240
H   -2.14152620   -0.22978220   -0.52367570    0.06628530    0.01994340   -0.01572220
H    2.69352250   -0.83991710   -0.86287350   -0.01309570    0.02150970   -0.01536800
H   -2.15491270   -2.15358670    0.58938860   -0.01585980    0.05554600    0.03801660
H    1.84716940   -3.12648610   -0.23548850   -0.32606350    0.30131070   -0.07946800
C    0.08822840   -3.01726840    0.22293350    0.05400520   -0.05130810    0.09940010
H    0.20105220   -4.10795560    0.30857690    0.02619180   -0.00381720   -0.01207640
   15
   -420.14237564
H   -0.62439540    2.09282950   -0.08875850   -0.02288910   -0.01025500    0.00062080
O   -1.03590280    1.29614980    0.23703650    0.00637260    0.03014540    0.01028660
O    1.37308010    1.18939770    0.24450620   -0.08389030   -0.05125490    0.00194590
C   -0.38398130    0.08862320   -0.09435060    0.14269690   -0.00348650   -0.02733950
C    0.99173210    0.12093640   -0.15746190    0.02358770    0.07195640   -0.01673040
C   -1.46382140   -0.90156010    0.04782990   -0.06464860   -0.09417460    0.08837400
C    1.71580640   -1.17334270   -0.51593570    0.02249170   -0.16264260   -0.01523250
C   -1.40447850   -2.21054090   -0.27305110   -0.06015070    0.09866050   -0.14597290
C    1.43356140   -2.40092990   -0.44742910    0.02644640    0.20007670   -0.02855090
H   -2.30693200   -0.32900560   -0.34045410    0.02274780    0.00826260   -0.02800150
H    2.56698640   -0.66773040   -0.76371260   -0.07197970    0.00767010    0.02416740
H   -1.93911560   -2.38847100    0.89012170    0.00908640    0.02531240    0.06097110
H    2.34760670   -3.12237350   -0.69792360    0.04110960   -0.02398260   -0.00940850
C    0.11619680   -3.13692190    0.22560560    0.06285700   -0.02739150    0.10595090
H   -0.52700450   -4.49508600   -0.13618960   -0.05386260   -0.06886880   -0.02111920
   15
   -420.17975016
H   -0.51936750    2.15448880   -0.25564720    0.03743300    0.06773090   -0.05509980
O   -1.08285050    1.21853370    0.28563010   -0.06079010   -0.12181550    0.06555080
O    1.41934830    1.10840970    0.22061620   -0.08334200   -0.10001530   -0.02930710
C   -0.44203470    0.12861400   -0.19533730    0.12296630    0.02977410   -0.05520450
C    0.95666150    0.07859450   -0.11165470    0.05596220    0.04953680    0.03608710
C   -1.50339310   -0.82727490   -0.00819230   -0.04807560   -0.01271680    0.09808240
C    1.63681220   -1.06395210   -0.57441270    0.15087210    0.02022890   -0.05694950
C   -1.31109850   -2.21825180   -0.25662240   -0.02253390    0.05705890   -0.15098010
C    1.39736010   -2.36184840   -0.35896750    0.00220080    0.08764440   -0.01840580
H   -2.47705760   -0.21763400   -0.20006540   -0.02081670    0.04135250   -0.02290700
H    2.46920030   -0.78149270   -0.84848730   -0.17780270   -0.04300990    0.05561370
H   -1.84419860   -2.30824110    0.96569140    0.00783600    0.03069310    0.06304290
H    2.48910510   -2.70764300   -0.48632250    0.03916850    0.03170550   -0.00291680
C    0.11915570   -3.20931600    0.16111730   -0.00398890   -0.12520790    0.08132420
H    0.08843440   -4.29955120   -0.02596090    0.00093100   -0.01289580   -0.00796020
   15
   -420.18913041
H   -0.11629540    1.87454230    0.15772320    0.03355590    0.01830710    0.00314760
O   -1.11206390    1.35766080    0.12134300   -0.06363640    0.02772580   -0.00481230
O    1.36236920    1.38325450    0.13928780    0.00131150    0.08428730    0.07996190
C   -0.61814190    0.08078210    0.00710080   -0.07087180   -0.07738660    0.03677640
C    1.01757060    0.16497380   -0.47704570    0.01179820   -0.03759810   -0.15460610
C   -1.36418730   -1.01093630    0.22926820    0.00225110   -0.01058600    0.08847060
C    1.77090540   -1.12687700   -0.29613970   -0.00640380    0.02894820    0.01220510
C   -1.00706730   -2.42168420   -0.14506070    0.10390820   -0.02888700   -0.10830170
C    1.30290280   -2.51207360   -0.24750040    0.13344550   -0.10939140   -0.01145650
H   -1.84602560   -0.46089000   -0.79996220    0.02931170    0.03110630   -0.04368310
H    2.91555130   -1.28428220   -0.13863980    0.03681040   -0.03177790    0.01329090
H   -1.94422810   -2.59003170    0.56192440   -0.00948360    0.04849040    0.05209690
H    1.94369050   -3.16741530   -0.32716200   -0.15595950    0.11870910    0.00690230
C    0.04260910   -3.25013690   -0.02715320   -0.00812260   -0.01107130    0.02717290
H   -0.27958230   -4.40479040    0.06429100   -0.03793540   -0.05090150    0.00286000
   15
   -420.08649603
H   -0.19485450    1.77484530   -0.19986120    0.03506170   -0.02895070   -0.02196270
O   -1.13759380    1.45433210    0.07547030   -0.06762810    0.03910280    0.02855380
O    1.55653970    1.21767600    0.28333410    0.06673300    0.11261640    0.06355980
C   -0.67796600    0.10833520   -0.09604640   -0.05543950   -0.09942270   -0.00326950
C    0.92323260    0.08890320   -0.19655310   -0.05486600   -0.04540910   -0.05049280
C   -1.49139610   -0.87624490   -0.00433960    0.10155260    0.13736890    0.05288710
C    1.76773370   -1.32487980   -0.44471030   -0.10838000   -0.30992600    0.04662040
C   -1.44031670   -2.46584490   -0.12673800   -0.13539730   -0.08558630   -0.03497220
C    1.23429280   -2.38930510   -0.26444040    0.09178680    0.23981330   -0.05453980
H   -3.06136420   -1.63885890   -0.07173490   -0.02319500   -0.07190950    0.00425590
H    3.04683340   -1.08967270   -0.69877460    0.08250840    0.01642320   -0.02231770
H   -2.09209140   -2.23031540    0.69938960    0.01292410    0.07735090   -0.02378810
H    2.02208060   -3.05119830    0.00261440   -0.01481800    0.03249600    0.00701750
C   -0.03960350   -3.02381550    0.02441000    0.11440930   -0.02728700   -0.00077380
H   -0.37288820   -3.90509520    0.59572540   -0.04523850    0.01331380    0.00919450
   15
   -420.09593265
H   -0.03278610    2.19272160   -0.04535060    0.03595610    0.06560590   -0.02158800
O   -0.99925620    1.27095540    0.13678040    0.01455690   -0.11978390   -0.00056550
O    1.43784230    1.34295210    0.18801270    0.01233530   -0.02688010    0.03606590
C   -0.49252280    0.14535550   -0.06258540    0.05930700    0.05822720   -0.01124870
C    0.85449330    0.33060960   -0.24082300   -0.16984550    0.11712850   -0.04414310
C   -1.43285240   -1.04071410    0.15535300   -0.03660180   -0.09230660    0.13104220
C    1.80170340   -1.11364230   -0.29891370   -0.01681270   -0.03862090   -0.03356170
C   -1.15509720   -2.41705050   -0.30731630    0.04633910   -0.02316310   -0.13598140
C    1.27838410   -2.39334080   -0.16347030    0.10708990   -0.08252270   -0.02706980
H   -2.33925000   -0.27116540   -0.44682090   -0.01879100    0.06844470   -0.05119290
H    3.19353580   -1.12918400    0.02574480    0.08731870   -0.01312480    0.03157600
H   -1.94582130   -2.42700450    0.67006230    0.01489650    0.04585160    0.04410970
H    1.72824770   -3.17597220   -0.37865470   -0.13915290    0.12621650    0.02988670
C    0.01504460   -3.16188350    0.06649420    0.01120740   -0.25161580    0.02693610
H    0.03701900   -4.05930570   -0.19064100   -0.00785740    0.16657430    0.02576620
   15
   -420.19204395
H   -0.35153760    2.31875880   -0.42966790    0.04228010    0.05213690   -0.04435000
O   -1.20209710    1.36380820    0.12135190   -0.04433330   -0.15525550    0.03304980
O    1.55213490    1.23945230    0.09072710   -0.00886110   -0.01271450    0.03260300
C   -0.53225620    0.34206960   -0.01240780   -0.00777340    0.18023170    0.02900870
C    0.97604750    0.18533900   -0.27674590    0.00748660   -0.00780600   -0.07244550
C   -1.47188180   -0.84709670    0.04578250   -0.10401580   -0.01769730    0.04800800
C    1.69013710   -1.09147570   -0.24028310    0.03322630    0.09887530   -0.00592860
C   -1.11233190   -2.46357940   -0.07861320    0.10370910   -0.12515220   -0.05908690
C    1.33848980   -2.56260980   -0.14537250   -0.00343790   -0.01634800    0.01636920
H   -2.23093130   -0.26913390   -0.48403620    0.03821340    0.03758870   -0.01503450
H    2.69089790   -1.25427290    0.03804200   -0.03601810   -0.03975600   -0.00007760
H   -1.91184950   -2.23301450    0.82513030   -0.00760850    0.06197230    0.03818360
H    2.15449050   -3.49005090    0.08422250    0.03222370   -0.06568070    0.01504310
C    0.02466340   -3.12555280   -0.21194730   -0.04922310    0.09001650   -0.01407470
H    0.02100810   -4.46147430   -0.15604640    0.00413660   -0.08042140   -0.00124500
   15
   -420.11088847
H    0.11786840    1.73422410    0.23575920   -0.00442390   -0.03799380   -0.00780880
O   -0.84222340    1.39786320    0.38354630    0.05543700   -0.08758860    0.00997420
O    1.58027190    1.27820080   -0.08875020    0.06090330    0.06893850   -0.04326900
C   -0.59585280    0.25730880   -0.04993250   -0.09142360    0.15434420   -0.06118670
C    0.87887880    0.10578210    0.16758890   -0.05981530   -0.08039560    0.09202100
C   -1.31273840   -0.95451040   -0.15085130    0.03799900   -0.08893090    0.03436260
C    1.54683660   -1.04261900   -0.20756340   -0.04218460    0.06157730    0.04278920
C   -1.20390210   -2.52389110   -0.00342200    0.03799680   -0.13151210   -0.03034000
C    1.42449120   -2.44751380   -0.23091800    0.17919210   -0.01740610   -0.04240170
H   -2.29393750    0.02823660   -0.48365500   -0.00483550    0.08563220   -0.01385200
H    2.48277700   -1.24964180   -0.88751410    0.01028190   -0.09726510   -0.01958870
H   -2.33604320   -2.25387940    0.59232230   -0.05391460    0.06423610    0.03022390
H    2.40668320   -2.33059640   -0.35049520   -0.08427960    0.11134990    0.00255500
C    0.04195530   -3.13968900    0.09108870   -0.01853510    0.06759640    0.00711130
H   -0.12351690   -4.40509210    0.18433590   -0.02240060   -0.07255210   -0.00049850
   15
   -420.25128883
H   -0.09747850    1.98357590   -0.00452190    0.04426860    0.03445810   -0.01713410
O   -1.06918090    1.27048000    0.08633750   -0.09805510   -0.06126040    0.02057780
O    1.38994500    1.11136670    0.13148410   -0.11897460   -0.17572900   -0.03608260
C   -0.40564250    0.19322790   -0.15893220    0.07369390    0.14361130   -0.01685610
C    1.11526090    0.00909100   -0.13401890    0.11790730    0.06984310    0.02908210
C   -1.39154710   -0.96846420   -0.05786870   -0.08163940   -0.05445500    0.06253050
C    1.84096350   -1.14131700   -0.47863170    0.00691350   -0.00978480   -0.00287760
C   -1.22073510   -2.32276520   -0.27063510   -0.01845120    0.03240400   -0.10734520
C    1.35886910   -2.44819920   -0.54591160    0.01228250    0.01113900   -0.04294570
H   -2.25805530   -0.49915700   -0.41321340    0.04757350    0.00125290   -0.00955050
H    2.90697090   -0.90019070   -0.58410340    0.00402290    0.01032960    0.00258130
H   -2.19582820   -2.16944290    0.66711260   -0.02700760    0.04868120    0.04513620
H    2.18263450   -3.06477970   -0.70956830   -0.02737510    0.02963840    0.01488580
C    0.25029030   -3.20293350    0.01380050    0.06551990   -0.03745990    0.09445940
H    0.18548750   -4.27935960   -0.51733570   -0.00065480   -0.04258610   -0.03646290
   15
   -420.15075829
H   -0.53299290    1.84501510   -0.40788740   -0.04470640   -0.06303710    0.02934890
O   -1.00915790    1.33756430    0.18687590    0.03911510    0.00241020   -0.03136460
O    1.47941890    1.30343170    0.04663140   -0.01734760    0.03615340    0.03340950
C   -0.54411000    0.15256000   -0.03715120   -0.09685980    0.04871420   -0.01007700
C    1.10293560    0.12058580   -0.25324780    0.07485260   -0.11084110   -0.06074660
C   -1.40156900   -0.89063130    0.10511760   -0.00686270    0.01589980    0.07898310
C    1.77810760   -1.03918070   -0.30994320   -0.05795080    0.15868470   -0.01698780
C   -1.06909130   -2.39628360   -0.26294910    0.06481630   -0.03406570   -0.07783070
C    1.32307430   -2.43926760   -0.20227430   -0.00488340    0.05147660    0.03845620
H   -2.04924070   -0.04433720   -0.55864720    0.03147420    0.07783740   -0.02800520
H    2.87648290   -1.32131640   -0.07365600    0.02271020   -0.04632420    0.01664380
H   -2.55477470   -2.22732210    0.73334970   -0.03717330    0.02485910    0.03867520
H    2.03906540   -3.47087770   -0.52418700    0.00904630   -0.07694340   -0.02369180
C    0.07070020   -3.20718830   -0.05197520   -0.00776850   -0.04655740    0.02540040
H    0.30493030   -4.33637360   -0.20293640    0.03162630   -0.03823910   -0.01221130
   15
   -420.06755697
H   -0.26005560    1.92234080   -0.47746000    0.06612880    0.01736870   -0.06601060
O   -1.17588510    1.39973170    0.22084440   -0.11027230    0.00644590    0.05850420
O    1.49455610    1.27088590    0.07297000   -0.07209370   -0.12551480   -0.00508970
C   -0.55802940    0.12906470    0.05712910   -0.00321620    0.02403710    0.01989260
C    1.13283920    0.23735590   -0.29509000    0.13839180    0.12553630   -0.03467380
C   -1.56003580   -1.08657960    0.07251470   -0.07326340   -0.06211800    0.02330760
C    1.60746510   -1.09227960   -0.16313600   -0.11829240    0.02376490   -0.01536500
C   -1.11829410   -2.47509570   -0.24008460    0.05877860   -0.00926000   -0.13910000
C    1.19022490   -2.42995450   -0.32588340   -0.11180430    0.01376040   -0.02087400
H   -1.71611780   -0.15882600   -0.53913190    0.06642610    0.02273680    0.02903920
H    2.95283240   -1.00604510    0.35030590    0.07602910    0.00671310    0.03890640
H   -1.89546290   -2.71156430    0.88013190   -0.01927590    0.02714950    0.07276560
H    1.81676420   -3.39077490   -0.17834360   -0.03986140   -0.05289890    0.00525260
C    0.12553410   -3.15014620   -0.06997070    0.15395920   -0.08471980    0.04534480
H   -0.02231280   -4.12437730    0.14521960   -0.01165980    0.06697180   -0.01188680
   15
   -420.10765711
H   -0.15749460    1.93391820    0.04306090    0.05148360    0.00155950   -0.02190060
O   -1.11823990    1.48630160    0.27715280   -0.10821890    0.04841480    0.04224280
O    1.40227190    1.22943330    0.10859260   -0.06091320    0.00976520    0.01667280
C   -0.46101580    0.11282210   -0.04012540   -0.04085060   -0.14153400   -0.01105490
C    1.04080370    0.07322440   -0.17555610    0.09656160   -0.00378410   -0.00766810
C   -1.23301150   -0.83984310    0.19050530    0.15411810    0.18583010    0.10503100
C    1.72347600   -1.24422110   -0.32599350   -0.04529320   -0.08962590   -0.06734530
C   -1.17629280   -2.51013420   -0.34879500   -0.03709970   -0.07487780   -0.16558860
C    1.37680690   -2.55859400   -0.15521200    0.03116080    0.04460440   -0.01018080
H   -2.30027420   -0.77389780   -0.29573840   -0.02707050   -0.02133360   -0.04707690
H    2.56742840   -0.69621240    0.31954560   -0.01464450    0.05245810    0.04184550
H   -2.22196210   -2.47841830    0.90228290   -0.03300600    0.02704690    0.06034570
H    1.93207300   -3.47845780   -0.18846920   -0.05188670   -0.01313020   -0.00454470
C    0.13984760   -3.17530440    0.14628090    0.07192910   -0.19703020    0.07633460
H   -0.23797360   -4.03123240    0.05999590    0.01372410    0.17163910   -0.00709150
   15
   -420.17313589
H   -0.01771360    1.88455350    0.09693850    0.05422780    0.03057060   -0.00659690
O   -1.11907390    1.21899340    0.14787510   -0.12424750   -0.01430940   -0.01877170
O    1.46845760    1.21327630    0.09378280   -0.01971910   -0.05420020    0.03790950
C   -0.40413150    0.01861750    0.20892550    0.08310530    0.00089400    0.05730810
C    1.00972560    0.13517360   -0.30375810   -0.00060170    0.08839980   -0.11044900
C   -1.43773290   -1.05285160    0.19557450   -0.08411550   -0.01003070    0.06209910
C    1.84132010   -1.17773430   -0.17575840    0.07576990   -0.03517630    0.02165300
C   -1.18957150   -2.46821460   -0.23436940    0.05818210   -0.06739750   -0.08833230
C    1.37239660   -2.44376040   -0.08114480    0.03668850    0.13625530   -0.01142590
H   -2.15718190   -0.37057870   -0.23983010    0.03744830    0.02647260   -0.00806290
H    2.85760750   -1.12350580   -0.17731730   -0.05785920   -0.01509340    0.00462410
H   -2.61825240   -2.20867630    0.71317700   -0.04027720    0.03038540    0.03137140
H    2.11820220   -3.49632140   -0.10734560    0.02561800   -0.07229190   -0.00344210
C   -0.02505950   -3.16404850    0.09059290   -0.04184230   -0.22749960    0.02944190
H   -0.15122640   -4.07920760    0.02843560   -0.00234530    0.18297240    0.00266420
   15
   -420.17971538
H   -0.22746790    1.88528330   -0.37452880    0.06865860    0.00590010   -0.04202250
O   -1.22369520    1.35595590    0.08424730   -0.13311560   -0.02719080    0.05667800
O    1.47953500    1.21295730   -0.05225040   -0.04977620   -0.08987380    0.01408970
C   -0.56940840    0.15531100   -0.04346020    0.01414220    0.02694490   -0.02234980
C    1.03110160    0.14152940   -0.27515230    0.11770310    0.07600310   -0.04570310
C   -1.47961390   -0.87515050    0.28326250   -0.04761520    0.03360610    0.10902600
C    1.75102190   -1.10775950   -0.22227350    0.08541210    0.03205030    0.00084150
C   -1.10007090   -2.53964480   -0.04309760    0.01578600   -0.09098680   -0.14558830
C    1.45012440   -2.46217610   -0.01897530    0.06790630   -0.00494550    0.02292440
H   -2.19133320   -0.35580390   -0.45934320    0.02630250    0.03633130   -0.03917150
H    2.65215310   -0.76210200   -0.03691180   -0.10691070   -0.01014360   -0.00384250
H   -1.71956090   -2.67836970    1.14003440   -0.00682710    0.03184100    0.07489030
H    2.14992760   -3.13095740   -0.31907180   -0.06639420    0.03398680   -0.00488660
C    0.18917460   -3.20330350    0.14270390   -0.01837050   -0.25678290    0.03175580
H   -0.25978190   -4.00510490    0.10444020    0.03308710    0.20320220   -0.00666010
   15
   -420.11132193
H   -0.23692380    2.09992470   -0.20356250    0.05000810    0.02731050   -0.04028660
O   -1.04566520    1.49075220    0.23853790   -0.10162040    0.01099130    0.04616630
O    1.39457020    1.22409820    0.14168510   -0.04766410    0.02097970    0.04636870
C   -0.33698780    0.17408340    0.01274820    0.12597880   -0.05927640   -0.00082530
C    0.94676350    0.09273560   -0.33695650   -0.10187370   -0.04467180   -0.05805550
C   -1.24430460   -0.75858270    0.13858400    0.10548100    0.09904750    0.09444300
C    1.78839790   -1.13135500   -0.40530650    0.09708860    0.00508260    0.01126430
C   -1.23367390   -2.37539110   -0.42050680   -0.04903560   -0.05837190   -0.17145370
C    1.44259370   -2.49094500   -0.20875200   -0.03356510    0.03575050    0.02392770
H   -2.27096080   -0.26284030   -0.15495050   -0.02821650    0.02858880   -0.03366250
H    2.50304140   -1.09483580    0.28178490   -0.09893400   -0.02988420   -0.02981360
H   -2.23328020   -2.66160650    0.90957770   -0.03406880    0.00154590    0.06526080
H    2.58320040   -3.08682240   -0.41459820    0.07137940   -0.01766100   -0.02956980
C    0.17753060   -3.06229560    0.13507220    0.09239560    0.00399370    0.08645890
H   -0.26582280   -4.13392340    0.17555110   -0.04735400   -0.02347010   -0.01025130
   15
   -420.05954894
H   -0.34588870    1.93305370   -0.21230200    0.02846850   -0.03052380   -0.02495740
O   -1.13233000    1.55706260    0.31992400   -0.09397020    0.06006510    0.04053380
O    1.38470170    1.29371000   -0.02981450   -0.08921770   -0.05288000    0.01652170
C   -0.38343900    0.21666170    0.02201560    0.18063860    0.05115180   -0.01072730
C    1.00100940    0.18233640   -0.29216310    0.06774650    0.07057110    0.00199360
C   -1.44718950   -0.83088950    0.07628430   -0.12286180    0.01172830    0.05999250
C    1.75620390   -1.28848200   -0.31540230   -0.03887710   -0.25261680   -0.06259630
C   -1.02765230   -2.37440900   -0.32551050    0.06472780   -0.05443920   -0.14001240
C    1.41848180   -2.49619210   -0.24685930    0.01199320    0.21017340   -0.03559200
H   -2.41707770   -0.34522620    0.01554080    0.00747660    0.01903230   -0.00681960
H    2.13740110   -0.53269570    0.61342480   -0.04849090    0.06952000    0.03336430
H   -2.32101690   -2.68381630    0.71580490   -0.04976040    0.00981640    0.05356130
H    1.97226500   -3.55012520   -0.02740860   -0.03263970   -0.05561960    0.00100190
C    0.26114120   -3.18243700    0.05894280    0.16297710   -0.05821730    0.08702270
H   -0.26092530   -4.16647850   -0.10740500   -0.04820090    0.00221130   -0.01327830
   15
   -420.13867233
H   -0.42677630    2.04246400    0.37580750   -0.08506810   -0.07356740   -0.01592110
O   -1.00767430    1.39186140    0.21872500    0.06586630    0.11441800    0.00283380
O    1.38149140    1.21399050    0.07805670   -0.06329350    0.00570590    0.04246820
C   -0.47818730    0.07641370    0.23051600    0.00218640   -0.08691300    0.04671720
C    1.06897090    0.06565950   -0.28837220    0.08719150   -0.01274420   -0.10119200
C   -1.45564580   -0.82988410    0.33769530   -0.00062410    0.02552410    0.04244190
C    1.67310470   -1.23046910   -0.25962030   -0.13323950   -0.08020410    0.04851550
C   -1.05094930   -2.23013440   -0.10880870    0.06004920   -0.00676060   -0.08990910
C    1.39501100   -2.48959300   -0.09520000    0.06118920    0.11698570    0.00529460
H   -2.67585780   -0.12984160    0.40684400   -0.06218750    0.04837140    0.00595020
H    3.02200530   -1.30376470   -0.58324540    0.07720200   -0.03026700   -0.02234740
H   -2.29010240   -1.92181940    0.75281390   -0.02764880    0.05891640    0.03029620
H    2.33460450   -3.00657000   -0.18500490    0.00742130    0.02819360   -0.00613420
C    0.05901610   -3.22108320    0.00613200    0.05745760   -0.05029870    0.03931890
H   -0.38687530   -4.33969530   -0.36081380   -0.04653270   -0.05737770   -0.02835980
   15
   -420.01609888
H   -0.07572400    1.99275190   -0.43775810    0.05703740    0.01471640   -0.06211250
O   -1.05425550    1.37709370    0.28382760   -0.14671630   -0.03013820    0.06580850
O    1.42164690    1.18294210    0.09421770   -0.15419960   -0.20776590   -0.02359360
C   -0.22903480    0.20393900    0.03440070    0.23392320    0.05571220   -0.01417320
C    1.08186100    0.13366690   -0.25080040    0.06246150    0.14660750    0.02857530
C   -1.26347190   -0.76531030    0.11154210    0.02562210    0.04407950    0.09959640
C    1.77750950   -1.12331290   -0.40331450    0.06869380    0.01081150   -0.00144720
C   -1.22332260   -2.43062980   -0.35176150   -0.03774690   -0.06394860   -0.16063110
C    1.38721080   -2.49518990   -0.19577660   -0.11787620   -0.00658990    0.01775020
H   -2.20361580   -0.03588860   -0.26920520   -0.02995530    0.06363560   -0.03355480
H    2.55921880   -0.75647340    0.10552840   -0.10136660    0.00549850   -0.01490040
H   -2.20984160   -2.66796810    1.05370500   -0.03087670    0.00112110    0.06297520
H    2.52587070   -3.14364600   -0.34267030    0.06910130   -0.02647740   -0.02226510
C    0.24282020   -3.06365810    0.22118240    0.09524140   -0.14135310    0.09675310
H    0.11288730   -3.96624390    0.49209210    0.00665100    0.13409640   -0.03878570
   15
   -420.08533113
H   -0.34053950    1.80971760   -0.45174580    0.02538630   -0.02721810   -0.03915950
O   -0.94825450    1.54711730    0.33919700   -0.05246960    0.06569340    0.05153310
O    1.42768450    1.20408120    0.17708560   -0.04059760    0.02467640    0.04994740
C   -0.39244190    0.12049560    0.09335280    0.03180300   -0.07900980    0.01472480
C    0.99252080    0.09943860   -0.31908330   -0.01135930   -0.06429720   -0.08541960
C   -1.35016270   -0.74876680    0.04924930    0.06272480    0.12347850    0.06213150
C    1.84663660   -1.05266300   -0.47106220    0.01292850    0.01620300   -0.06827980
C   -1.22625820   -2.33406000   -0.38223100   -0.05717900   -0.04433860   -0.14399250
C    1.38578330   -2.35875450   -0.17225750   -0.09417930    0.04944010    0.04612830
H   -2.39867220   -0.46831730   -0.13439180   -0.00936460   -0.00499830   -0.01962240
H    2.75830890   -0.91818090    0.21886990    0.00377740   -0.00558580    0.04744910
H   -2.05059210   -2.56172460    1.34675770   -0.01289120    0.00448770    0.05224010
H    2.52879540   -3.04047530   -0.49157160    0.06740010   -0.02346480   -0.03609670
C    0.20974250   -3.02226660    0.16181650    0.12586040    0.02088410    0.09804670
H   -0.21621230   -4.19924910   -0.09458710   -0.05185120   -0.05593920   -0.02965820
   15
   -420.14213566
H   -0.40586070    2.25964900   -0.32182510    0.02262820    0.07895770   -0.02352630
O   -0.97500110    1.36260150   -0.00094240   -0.01456230   -0.02453440    0.03612420
O    1.43926110    1.18005590    0.11392370   -0.07488440   -0.10502750   -0.02493360
C   -0.50775590    0.06924990   -0.26980390    0.00060690   -0.02593880   -0.03300250
C    1.09435250    0.09826450   -0.12012790    0.07639310    0.12265370    0.04040910
C   -1.53119160   -0.91843040   -0.14496370   -0.01006740    0.00483080    0.07192610
C    1.84365730   -1.15056830   -0.40159600   -0.04304080    0.06684350    0.01696000
C   -1.19085580   -2.47581670   -0.12093000    0.03239700   -0.09660230   -0.09279050
C    1.27915150   -2.54623170   -0.70929250   -0.03013190   -0.03961560   -0.10361740
H   -2.59892850   -0.33906400   -0.64820340   -0.05333180    0.04982780   -0.04335040
H    3.12937160   -1.15463310   -0.33699820    0.07795440   -0.00857240    0.00801680
H   -2.51699710   -2.33840420    0.99121350   -0.04821320    0.02967430    0.04517130
H    1.90183040   -3.45961540   -0.55603490   -0.02777000   -0.02254800    0.03345600
C    0.21827410   -3.18541040    0.08611090    0.11441250   -0.07530210    0.08310260
H   -0.23514770   -3.99179310   -0.48246690   -0.02236870    0.04531710   -0.01393860
   15
   -420.05360927
H   -0.77024430    1.65537030   -0.85971710    0.00323130   -0.02452090   -0.01462740
O   -1.07234220    1.37417210    0.04037420   -0.03439830    0.00840770    0.03441640
O    1.60286080    1.32882180   -0.00718350    0.02235380    0.09276130    0.02910470
C   -0.45803920    0.13362350    0.05801690    0.01178790    0.00021150   -0.00842650
C    1.09757620    0.10527020   -0.18958160    0.02588360   -0.13137330   -0.04786260
C   -1.44677860   -0.78821250    0.36011570    0.00383760    0.09391940    0.12777780
C    1.84721610   -1.04912410   -0.30049430    0.08303060    0.10619270   -0.01207420
C   -1.09959830   -2.42990750   -0.08197980   -0.04433830   -0.01167450   -0.11500550
C    1.56657750   -2.44824640   -0.08311040    0.01812160   -0.03045770   -0.05737260
H   -2.37307430   -0.62686250   -0.83190080   -0.03129590   -0.00163930   -0.08130330
H    2.78795700   -1.21955230   -0.26821670   -0.14259490   -0.03618220    0.00671540
H   -1.19055660   -3.38490290    1.40429260    0.00559510   -0.02026700    0.05021150
H    2.38260070   -3.19231340    0.39090030    0.02120190   -0.03882930    0.03756480
C    0.25891930   -3.03503370    0.18965510    0.06683610   -0.28894770   -0.01788350
H    0.37379540   -3.84455970   -0.11833510   -0.00926060    0.28241650    0.06874900
   15
   -420.07287345
H    0.05108430    1.76144680   -0.16935640    0.06617880   -0.01954550   -0.04981520
O   -0.85784640    1.50272620    0.41462430   -0.08417700    0.04553700    0.04402170
O    1.44334380    1.11300350    0.24247960   -0.14093900   -0.20275980   -0.03318080
C   -0.32058770   -0.01494900    0.23698540    0.10216220   -0.08954040    0.00621810
C    1.08137710    0.10423020   -0.10825130    0.09524930    0.18667620    0.01965640
C   -1.45060780   -0.69363770    0.19781110    0.04208090    0.07945760    0.06859490
C    1.82374530   -1.05773030   -0.46238720   -0.07660730    0.00264330   -0.04789920
C   -1.17065700   -2.40739040   -0.36363010   -0.04203850   -0.01363390   -0.13695810
C    1.46182220   -2.39159810   -0.30410760   -0.04441740    0.01406990   -0.00806750
H   -2.62339730   -0.13356060    0.06050040   -0.07668710    0.04355170   -0.01465490
H    3.03461250   -0.73587500   -0.05202330    0.06162010    0.02593490    0.04368370
H   -1.68724270   -2.95358290    1.51568360   -0.00320030   -0.00268270    0.04725990
H    2.43382290   -2.97162130   -0.32812270    0.02611370    0.00058530   -0.00459010
C    0.25074240   -3.06984940    0.07987170    0.08237780   -0.07121670    0.06638750
H    0.17497960   -4.13389570    0.26106500   -0.00770960    0.00088880   -0.00066690
   15
   -420.01522266
H   -0.56494380    2.28935050   -0.02684730    0.02169990    0.09373130   -0.01734370
O   -1.14648680    1.27434610    0.15960350   -0.06043330   -0.04674480    0.00607820
O    1.57285590    1.29063170   -0.20463100    0.03026020    0.07191890    0.01478710
C   -0.51652990    0.02535390    0.21235880   -0.01311920   -0.06130090    0.02364520
C    1.14531160    0.05300960   -0.19243800    0.01739430   -0.08671690   -0.05819390
C   -1.56157070   -0.91302940    0.31729120    0.01684730    0.04599780    0.11112940
C    2.03425780   -1.06530710   -0.09128320    0.04598130    0.03780310    0.06946160
C   -1.20684030   -2.52361620   -0.26089930    0.00820280   -0.09608980   -0.07182060
C    1.31487260   -2.53096880   -0.19673380   -0.10721510   -0.02359440   -0.05072460
H   -2.39757020   -0.33597930   -0.50624270   -0.03000620    0.04478650   -0.06117430
H    2.98864810   -0.60405070   -0.71308870    0.03255560    0.04617300   -0.03964330
H   -3.38962600   -2.12437690    1.23998720   -0.02054490    0.00098150    0.01238290
H    2.04505470   -3.45215280    0.00343190    0.01692980   -0.04526330    0.02493120
C    0.06401640   -3.02454090    0.12169010    0.06876600    0.06150520    0.07779130
H   -0.13044000   -4.18311130   -0.36740150   -0.02733190   -0.04317040   -0.04134130
   15
   -420.00756003
H   -0.39111460    2.07358490   -0.55305520    0.04159310    0.05695630   -0.05892360
O   -1.11025140    1.25569550    0.08036790   -0.02829490   -0.16155290    0.05175900
O    1.60303590    1.26977860    0.00241850    0.04125900    0.03453440    0.00511830
C   -0.57315660    0.12697940   -0.05355770   -0.02470290    0.05821300   -0.01384360
C    1.00440590    0.12505030   -0.01960150    0.03588000   -0.09831870    0.00933530
C   -1.54014750   -0.84847130    0.10320320    0.03284540    0.10088090    0.05346080
C    1.74161400   -0.99462840   -0.08791330   -0.06110770    0.11041930   -0.00716950
C   -1.01855010   -2.67009480   -0.38890240   -0.01361890   -0.05665610   -0.09002130
C    1.43144270   -2.38417150    0.12157600    0.04080120   -0.08243800    0.01401300
H   -2.99154930   -0.65876040   -0.07490960   -0.09871120    0.00856800   -0.01208720
H    2.90128080   -1.00220470   -0.16834260    0.04165310   -0.02549940   -0.00151040
H   -1.83212300   -2.88071270    1.96708200   -0.00572760    0.00199280    0.02478410
H    2.31799910   -2.77554580    0.04133740   -0.09067010    0.07141710   -0.00450200
C    0.28486730   -3.11489650    0.19109290    0.11714270    0.06921510    0.01020900
H    0.07888580   -4.55325870    0.48841000   -0.02834620   -0.08772610    0.01937780
   15
   -420.01987957
H   -1.26413120    1.63364470   -1.32460200   -0.02890950    0.01389090   -0.10316260
O   -0.90614710    1.40574340   -0.02764170    0.02142170    0.01963390    0.11379280
O    1.66479960    1.31902030    0.08134500    0.02627960    0.00045410    0.00146050
C   -0.36106510   -0.01400670   -0.08938090    0.07494120   -0.08029420   -0.02613220
C    1.08005250    0.20772300   -0.01424400   -0.00125980   -0.04930030   -0.00607990
C   -1.44693310   -0.85507140    0.11551710   -0.03651080    0.06060430    0.08131010
C    1.93596620   -0.81795810   -0.05542730   -0.02920700    0.23428080   -0.00403720
C   -1.07440920   -2.56674820   -0.15170080    0.01832440   -0.06840300   -0.07338990
C    1.56210090   -2.47104390    0.01587310    0.04053720   -0.03834020   -0.03249020
H   -2.42802230   -0.42479880   -0.38262210   -0.03388300    0.02572240   -0.03596140
H    3.01342350   -0.82595260   -0.03712800   -0.00323760   -0.01748950    0.00416900
H   -1.89493960   -3.19369660    2.23475680   -0.00359650   -0.00363120    0.02478530
H    2.29326610   -3.35749960    0.14020220    0.00799680   -0.04179730    0.00814530
C    0.06625550   -3.15539780    0.36675050   -0.02739670   -0.00264140    0.03283180
H   -0.10500680   -4.30151570    0.67341360   -0.02548360   -0.05263020    0.01473140
   15
   -420.00950365
H   -0.99406800    1.40005190   -1.12126550    0.00309190   -0.03168680   -0.09346710
O   -0.91610800    1.45124360    0.10479400    0.00494680    0.05887410    0.13132260
O    1.64959710    1.33325730   -0.01224970   -0.09857850   -0.22132830   -0.02203460
C   -0.36246430    0.08757750   -0.16529090    0.03474250   -0.00462640   -0.04992790
C    1.21902770    0.32659280   -0.15995050    0.14592260    0.21797770    0.02465900
C   -1.29421140   -0.99849490    0.07149740    0.03481490   -0.01255510    0.05184360
C    1.84363220   -0.93765440   -0.09220270   -0.05422280    0.06599180   -0.08604600
C   -1.14577780   -2.50260600    0.02287400   -0.01917370   -0.05607400   -0.02287130
C    1.42091530   -2.29408930    0.07185660    0.10666100   -0.08044310    0.02528030
H   -2.46475010   -0.64314150   -0.25362410   -0.06270000    0.01641130   -0.03414770
H    2.92374260   -0.68498510    0.85322490    0.04570700    0.01934240    0.06650600
H   -1.50280140   -3.09459300    2.90693120    0.00139760   -0.00071520    0.01579810
H    2.26398110   -2.73999080    0.25639360   -0.08399400    0.07811540   -0.02862640
C   -0.04644560   -3.23492990    0.23547520   -0.06365600   -0.06992490    0.03439300
H    0.21837830   -4.24212680    0.03351770    0.00502110    0.02053280   -0.01278520
   15
   -420.14870020
H   -1.40076200    1.97344170   -0.32824020    0.04195330   -0.07505810    0.11564890
O   -1.09277180    1.45872980    0.30293890   -0.06311190    0.13500760   -0.10002630
O    1.47153170    1.29122920    0.08877800    0.02117760    0.07043670    0.00620790
C   -0.40980740   -0.19979260   -0.14853000    0.02264330   -0.13865380   -0.03127030
C    1.02172490    0.08876530   -0.01900130   -0.02009270   -0.07653150    0.00551230
C   -1.50005650   -0.93172840   -0.18549760    0.03145820    0.03538790    0.06794940
C    1.89793710   -1.02413340   -0.09817440   -0.08313630    0.02254550   -0.03348960
C   -1.14990020   -2.37512540   -0.33916860   -0.03314920    0.01326190   -0.07387360
C    1.54760770   -2.29746830    0.12068590    0.06040270    0.05953980    0.00054840
H   -2.42421370   -0.39718790   -0.76396260   -0.03432640    0.03346450   -0.04589080
H    3.05148760   -0.97131270    0.10127270    0.04142570   -0.02150870    0.01653450
H   -1.83487340   -3.66452920    1.31910100   -0.00453020   -0.02695930    0.03752210
H    2.18030370   -3.18052170    0.38134490   -0.00726030   -0.02745190    0.00869260
C    0.15956070   -2.84718770    0.09422350    0.02903090    0.07420050    0.03151760
H    0.16765120   -4.12853890    0.10607790   -0.00248480   -0.07770950   -0.00562710
   15
   -420.08618061
H   -1.71446260    1.48142460   -0.62899500    0.05190600   -0.02865110    0.11284370
O   -1.31600450    1.35710500    0.14381250   -0.11134180    0.03297630   -0.09568250
O    1.63438310    1.22294780    0.10301760    0.04872310    0.05640930    0.00177860
C   -0.51499220   -0.08226830   -0.11524450   -0.09802770   -0.15794300   -0.03734520
C    1.04968310    0.09454990   -0.00000590   -0.04490680   -0.03599660    0.01246620
C   -1.53288350   -0.80790880    0.01869000    0.02857230    0.15976600    0.04858710
C    2.00958290   -1.10648960   -0.16004820    0.09199730   -0.01536490    0.00112400
C   -1.19088730   -2.40174370   -0.19489100   -0.04969240   -0.02963710   -0.08551130
C    1.50399860   -2.35066580   -0.23870180   -0.05244930    0.05988820   -0.02959120
H   -2.23735130   -0.13718030   -0.43814470    0.04893390    0.03468110   -0.01516310
H    3.02587320   -1.03633730   -0.11284720   -0.05315320   -0.02202620   -0.00191300
H   -1.80322100   -3.23764560    1.75051790   -0.00769760   -0.01455730    0.04596230
H    2.05350780   -3.33971760    0.00592430   -0.01929190   -0.04324660    0.02384260
C    0.26820130   -2.82652420    0.04373480    0.18382560    0.09131600    0.01028340
H    0.11943170   -4.20462250    0.22221730   -0.01741060   -0.08762710    0.00834970
   15
   -420.00575300
H   -1.38275390    1.73443580   -0.93905650   -0.04686060    0.05116010   -0.07833370
O   -0.75288730    1.26725860    0.00182750    0.10908960   -0.10589940    0.06215990
O    1.48124200    1.37184090    0.00244280   -0.04234780   -0.05201730    0.00119680
C   -0.39557980    0.03336370    0.11669080   -0.00976570    0.07754240    0.05090410
C    1.09760460    0.23223890    0.03533910    0.04220490    0.01604470   -0.01523460
C   -1.40317270   -1.04174670    0.02612570   -0.06220760   -0.01744920   -0.03934940
C    1.94956450   -0.82776920   -0.00520200   -0.02350040    0.10584920    0.00019600
C   -1.27808090   -2.65592950    0.06223600   -0.06156270   -0.05353670   -0.06480810
C    1.33766080   -2.35434720    0.01673600   -0.09075240   -0.02097750   -0.00274220
H   -2.06639500   -0.17905210    0.36511090    0.04348830    0.05695140    0.01330330
H    3.12623590   -0.31507030   -0.08805210    0.06003480    0.05380720    0.00031490
H   -1.30206620   -2.99606890    2.30042290    0.00360560   -0.00048640    0.03746810
H    2.23995280   -2.99819490   -0.14965520    0.00985770   -0.00919940   -0.00662930
C    0.21852120   -3.21762220    0.36052400    0.08334570   -0.01004700    0.04564500
H    0.18277100   -4.58054490    0.32954310   -0.01460430   -0.09176970   -0.00409990
   15
   -420.03208134
H   -0.97635180    2.03590270   -0.83232200   -0.01200670    0.04011720   -0.03150150
O   -0.70966710    1.51697090    0.02167630    0.05808350    0.02955150    0.01916600
O    1.49815100    1.40118190   -0.08116020   -0.10553500   -0.10189960    0.01068860
C   -0.32787250    0.03802270    0.00856850   -0.09269260   -0.10208760    0.00475000
C    1.21955600    0.29254520   -0.00911920    0.11638170    0.16094640   -0.01534620
C   -1.04511830   -1.02477530    0.20068090    0.05146970    0.07568120    0.03697630
C    1.92201110   -1.04893130    0.10970560   -0.07941200    0.01220040    0.01498200
C   -1.02708370   -2.87932630   -0.03858580   -0.05662950   -0.06486140   -0.07594710
C    1.61478780   -2.48863750    0.13992200    0.07266360   -0.06362680   -0.02892210
H   -1.95291800   -0.59437560   -0.15531180    0.04401370    0.01684080   -0.01163780
H    3.22727110   -0.58047560    0.01649810    0.06879160    0.04732620   -0.00823020
H   -1.55153630   -3.48729670    2.29042180   -0.01002230   -0.00446200    0.03394470
H    2.42219240   -3.04491030    0.38021510   -0.05922060    0.03658690   -0.00322550
C    0.26841450   -3.41910090    0.47511130    0.02693550   -0.06999540    0.07013960
H    0.21127460   -4.52475790    0.35096210   -0.02287210   -0.01237560   -0.01581630
   15
   -420.02592198
H   -1.34644810    1.52660900   -0.81193630    0.02174130   -0.00424250    0.02895850
O   -0.87441390    1.49954050    0.00138400   -0.01311130    0.08734430   -0.03275420
O    1.58236300    1.37823880   -0.02622220   -0.04222870   -0.12997650    0.01188530
C   -0.41590540   -0.07041810    0.07232480   -0.03553710   -0.08438290    0.00174940
C    1.23265080    0.30047400    0.14690050    0.10228490    0.11170830   -0.00077080
C   -1.35167610   -1.08590840    0.07044720   -0.01180980   -0.02271290   -0.01094890
C    2.08495850   -0.77353000    0.20491640    0.02975920    0.19259890    0.00764940
C   -1.09157100   -2.51894800    0.01821920   -0.05175540    0.04345120   -0.05089360
C    1.55766970   -2.46905220    0.11317510    0.15359070   -0.20801420   -0.06216690
H   -2.27839880   -0.48572410    0.31099560    0.00155670    0.03730760    0.01371070
H    3.13135050   -0.74388010    0.05597580   -0.02019620   -0.00529890   -0.00025550
H   -1.99567520   -4.04711500    2.06877150   -0.00116750   -0.01556260    0.02085080
H    2.05789640   -3.16093180   -0.20949390   -0.14717650    0.13889910    0.06095770
C    0.07544240   -3.38408570    0.17272660    0.01285910   -0.18206960    0.01889510
H    0.15008050   -4.25607880    0.72088700    0.00120310    0.04089160   -0.00686910
   15
   -420.25915435
H   -0.13110630    2.14899710   -0.05135200    0.05726520    0.06420500   -0.03377830
O   -1.03692940    1.38575930    0.23638540   -0.02671200   -0.09297960    0.01822270
O    1.53920260    1.12751210    0.59607920    0.00456370   -0.02222600    0.02204500
C   -0.57419910    0.17563730    0.29187360   -0.00633280    0.00891820    0.03709820
C    0.86301370    0.14075190    0.25922930   -0.01813100    0.04077530   -0.04613430
C   -1.40808130   -0.89827260    0.08808060   -0.03079450    0.06358760    0.00001740
C    1.47964610   -1.15490460    0.23822530   -0.12654180    0.02006880   -0.02681670
C   -1.21277140   -2.36258200   -0.10671510    0.09053070   -0.01616110   -0.00284340
C    1.21811770   -2.49842340    0.16255730    0.01916360   -0.02180910    0.01578490
H   -2.42020490   -0.80539520   -0.04769070    0.04743280   -0.03024240   -0.00082870
H    2.68337340   -1.10891450    0.55096220    0.05571760   -0.01212210    0.02498260
H   -2.42583070   -2.85874570   -0.26704670   -0.08015810   -0.01966630   -0.00370980
H    1.87450260   -3.46861340   -0.14820840   -0.04799200   -0.07093670   -0.03950690
C   -0.07372100   -3.07042400   -0.04599080   -0.06659580    0.05028440    0.02148240
H    0.95154290   -3.84806660   -0.39247290    0.12859530    0.03829680    0.01402280
   15
   -420.16496560
H   -0.18587010    2.15166600    0.19234650    0.04482450    0.06092600   -0.00549860
O   -1.03387890    1.39041680    0.18468250   -0.01227840   -0.12101050   -0.00740150
O    1.66458150    1.11267000    0.51160780    0.06542070    0.03933870    0.03951450
C   -0.58279850    0.21619940    0.23993890   -0.06584530    0.05336510    0.03807530
C    0.88665560    0.05763480    0.17754030    0.00107330   -0.12552020   -0.06786180
C   -1.34954420   -0.89066840    0.05592540    0.07008950    0.04857830   -0.00034160
C    1.45780060   -1.13824450    0.32779250   -0.18839050   -0.00824340   -0.02424300
C   -1.25991990   -2.29777510   -0.17325080    0.03785040    0.03116490    0.00203370
C    1.29085790   -2.41487430    0.16197060    0.07639680    0.05606730    0.01976280
H   -2.42605380   -0.95693860    0.08716790    0.01341720   -0.05002260   -0.00339450
H    2.74605530   -0.75266990    0.63505070    0.06759620    0.02976320    0.02202700
H   -2.62925970   -2.98128620   -0.42097960   -0.08248960   -0.03794950   -0.01281150
H    1.83104750   -3.42732920   -0.18163970   -0.06452010   -0.06823660   -0.03581640
C   -0.12913920   -3.00490800   -0.04899500   -0.09682140    0.02593150    0.01572850
H    0.84448410   -3.66600710   -0.26523720    0.13370490    0.06580230    0.02022380
   15
   -420.17319940
H   -0.12641070    2.07899460   -0.15337880    0.05977140    0.03909760   -0.03995460
O   -1.07843410    1.43992200    0.20095270   -0.06278630   -0.04972030    0.03700690
O    1.62621300    1.21916290    0.56485290    0.07342030    0.05069500    0.04788790
C   -0.57064520    0.21077560    0.17614310    0.01910190   -0.02929470    0.00411190
C    0.84151250    0.14262380    0.21170730   -0.06755200   -0.06186640   -0.06880690
C   -1.42516700   -0.83893340    0.03405270   -0.09950990    0.08276500   -0.01710400
C    1.47070660   -1.07726530    0.31053950   -0.14158720    0.07221550    0.01631800
C   -1.31548220   -2.28176110   -0.07758420   -0.13709440    0.03215690    0.01639180
C    1.36559640   -2.47548150    0.18659590    0.11516410   -0.05083140   -0.00089310
H   -2.34170500   -1.03955150   -0.11019540    0.15619280   -0.05290400    0.01605720
H    2.66747040   -1.02215140    0.30363200    0.04451670   -0.02278030   -0.00351480
H   -2.12829530   -2.77261780   -0.57132400    0.01189060    0.00943440   -0.00507020
H    1.73845060   -3.37553330   -0.30970440   -0.10732570   -0.03737650   -0.03505150
C    0.04103830   -3.05007790   -0.08085970    0.00801210   -0.01442140    0.02001590
H    1.01965400   -3.87570490   -0.70988500    0.12779630    0.03280290    0.01265660
   15
   -420.16630349
H   -0.18914350    1.65936670   -0.09968750   -0.00083180   -0.06476310    0.00242270
O   -1.09582790    1.44457770    0.14229180   -0.01561470    0.05999670   -0.01518450
O    1.45846320    1.06789950    0.60798510   -0.09231720   -0.15924370   -0.03048270
C   -0.53660960    0.10118350    0.28535390    0.06687120   -0.06851370    0.05093340
C    0.85471560    0.20081560    0.14977490    0.04710130    0.17323590   -0.01594420
C   -1.36441050   -0.91346140    0.05030430   -0.02640150    0.10053480   -0.01825460
C    1.44104860   -1.10840880    0.17561100   -0.05356800    0.10513900   -0.01991150
C   -1.27336170   -2.40937880   -0.04828650    0.01707850   -0.01705400    0.03832610
C    1.27716740   -2.54819040    0.10226700    0.03529900   -0.04846970    0.06038830
H   -2.35885540   -0.78816450   -0.00808560    0.06748070   -0.03576400   -0.00023670
H    2.28544820   -1.19977030    0.80109880   -0.04993100   -0.03536780   -0.00046740
H   -2.50554370   -2.69297880   -0.32704120   -0.08396760    0.00933610   -0.01365120
H    1.83166400   -3.63810240   -0.45809170   -0.04338170   -0.07798240   -0.05549080
C   -0.00379370   -3.07224290   -0.20067640    0.01388960    0.04927630    0.02037810
H    0.85637630   -4.02089820   -0.66852090    0.11830880    0.00953520   -0.00287660
   15
   -420.05673856
H   -0.30289160    1.98392400   -0.37126350    0.04747250    0.03964700   -0.07178730
O   -1.07622120    1.32141730    0.38126570   -0.02284210   -0.06639280    0.06753130
O    1.49994100    1.20253090    0.53656870    0.05960550    0.03088190    0.04071430
C   -0.52221220    0.12841230    0.27148870    0.23390470    0.02145450    0.00557930
C    0.70924950    0.11776750    0.24810660   -0.34933730   -0.04001520   -0.06103430
C   -1.32837530   -1.00334030    0.16989340    0.06640180    0.01043880    0.02740750
C    1.50920050   -1.03367810    0.43597510   -0.08986620    0.13828970    0.01171170
C   -1.21830840   -2.39509560   -0.13990360    0.03071990   -0.08463820   -0.02764100
C    1.17728280   -2.56480160    0.12787390    0.06208370   -0.24130490   -0.05335780
H   -2.42351080   -0.79059260    0.01302990   -0.01973170   -0.01069580   -0.01568960
H    3.02465510   -1.05892710    0.81299090    0.09214000   -0.01585790    0.02367280
H   -2.06637590   -2.93338060   -0.08011840    0.06857080    0.02840370    0.01223990
H    1.56156240   -3.41604630   -0.09647560   -0.18773190    0.04949690   -0.03038620
C   -0.11604600   -3.05072510   -0.12131410   -0.14594940    0.07839950    0.02795590
H    0.92007070   -3.86271080   -0.47851420    0.15455360    0.06186280    0.04309030
   15
   -420.24096830
H   -0.11411330    1.75740790   -0.12029100    0.03654900   -0.03334510   -0.03040770
O   -0.99736810    1.38652490    0.30594830   -0.01497660   -0.07160580    0.01980040
O    1.61058840    1.06631620    0.68789240    0.04538570    0.01245370    0.06328650
C   -0.50197330    0.22164330    0.32555970    0.09541840    0.13961160    0.05108050
C    0.83112000    0.10880690    0.11733770   -0.10715040   -0.01720650   -0.10388270
C   -1.43186010   -0.96386640    0.05548750   -0.04225340   -0.04295300   -0.02914320
C    1.45008490   -1.14056280    0.21571500   -0.15052420    0.02466480    0.01269530
C   -1.36627160   -2.35394720   -0.01889100   -0.04123020    0.03278210    0.02923920
C    1.28463750   -2.48219030    0.11140520    0.09714790    0.02369950    0.02084200
H   -2.41993440   -0.67421140    0.09531100    0.04501370   -0.02333860    0.00058930
H    2.64756180   -0.93795240    0.32711780    0.05206010    0.00204660    0.00214230
H   -2.27833730   -2.91746350   -0.33024190   -0.01113190   -0.01112200   -0.01346760
H    1.66282500   -3.66940240   -0.02252090   -0.08120870   -0.08524060   -0.01968750
C   -0.11963530   -3.02651230   -0.09515890   -0.05771610    0.00089640   -0.02020390
H    0.67041820   -3.89210820   -0.09787420    0.13460650    0.04865860    0.01711890
   15
   -420.10380951
H    0.12794770    2.08833480   -0.08899000    0.04966970    0.04897690   -0.04143970
O   -1.00117880    1.40727220    0.26801290   -0.05615600   -0.00313220    0.02461740
O    1.52882720    1.16415950    0.50227030   -0.00997500   -0.03317730    0.02896490
C   -0.53622250    0.14389920    0.18949160   -0.05942430   -0.07071750    0.03070190
C    0.98395990    0.10595700    0.12798290    0.09200160   -0.11867770   -0.03770210
C   -1.25131230   -0.95726530    0.01138030    0.14460760   -0.01166750   -0.01510860
C    1.46608500   -1.07622740    0.22518790   -0.20192140    0.00530330   -0.05125270
C   -1.25406060   -2.29407090   -0.19789750   -0.07441320    0.10998340   -0.01894830
C    1.25061310   -2.29117920    0.20346050    0.06496600    0.21326960    0.00467420
H   -2.40190880   -0.76521940    0.13746430   -0.03588860   -0.01280500    0.00535440
H    2.84939470   -1.13546430    0.84322790    0.06400840   -0.01386110    0.03658830
H   -2.13456230   -2.95385950   -0.16303080    0.00352630   -0.01904330    0.01141920
H    1.83481610   -3.62038490    0.28035900   -0.02087180   -0.06254740   -0.00691200
C   -0.03249090   -3.08417980   -0.00883540   -0.02197670   -0.03012700    0.03343520
H    1.20406770   -4.13789000   -0.33785130    0.06182920   -0.00181600   -0.00435220
   15
   -420.13578589
H   -0.06788860    1.77941020    0.62581530    0.02465010   -0.02536540    0.02099540
O   -0.94883010    1.43243640    0.16957220   -0.02007210   -0.02989640   -0.03534720
O    1.65670750    1.13857040    0.51975700    0.07215330    0.03855140    0.03631050
C   -0.51754660    0.20154600    0.18011320    0.03628880    0.02009730    0.02002410
C    0.85671490    0.10797290    0.15615830   -0.13297620   -0.05022750   -0.07744700
C   -1.29925410   -0.90698950    0.13150080    0.12868930   -0.00500470    0.03134210
C    1.46648350   -1.14281670    0.30348270   -0.11714370    0.01196260    0.02113350
C   -1.22814040   -2.21697380   -0.19885440   -0.09736670    0.12924980   -0.02602350
C    1.23086030   -2.39150330    0.17518590    0.09682730    0.09813180    0.01935280
H   -2.51448440   -0.95315780   -0.02051720   -0.04950850   -0.04813880   -0.01840410
H    2.68557200   -1.49119960    0.32165810    0.03781260   -0.05389270    0.00216210
H   -1.94965880   -2.95914770   -0.39136590    0.05198410   -0.01030940    0.01423330
H    1.64687880   -3.71728360   -0.60844610   -0.05018230   -0.03827010   -0.01688510
C   -0.13342790   -3.13214400    0.05129950   -0.05943670   -0.06127940    0.00964960
H    0.83717250   -3.99479830   -0.22328060    0.07829140    0.02436440   -0.00113170
   15
   -420.13138311
H   -0.08045180    2.09021520   -0.18346890    0.04112050    0.05251060   -0.03704410
O   -0.93425800    1.45349500    0.17419810    0.01487720   -0.08367610    0.01482150
O    1.54884320    1.03538210    0.58832760    0.03102890    0.01523110    0.04123180
C   -0.60126200    0.23904210    0.39860300    0.01470820    0.11991820    0.07901900
C    0.76066410    0.03386930    0.24253360   -0.07046530   -0.05721050   -0.07079410
C   -1.43002020   -1.05101070    0.10185200   -0.00511690   -0.11612900   -0.01876600
C    1.39244480   -1.19112110    0.28680420   -0.17445610    0.10557350   -0.09531070
C   -1.31643340   -2.43432520    0.02433010    0.01248360   -0.02037630   -0.01823740
C    1.35536340   -2.62290770    0.22480120    0.09607320   -0.08016000    0.06006790
H   -2.41314580   -0.70229510   -0.04009850    0.03370120   -0.00494980   -0.00351190
H    2.50803740   -1.06464820    1.05788820    0.04969080   -0.01070310    0.05417710
H   -2.29793770   -2.89379160    0.26952440   -0.01547490    0.01152800    0.01993870
H    1.82366890   -3.82777080    0.06897680   -0.04740510   -0.08554390   -0.02486150
C   -0.11180710   -2.97305390   -0.15106530   -0.12589660    0.11084600   -0.02619500
H    0.78408960   -3.84686500   -0.06058360    0.14517420    0.04310140    0.02552180
   15
   -420.11787786
H   -0.38605730    1.74929350   -0.19550820   -0.09625450   -0.08566060    0.03339250
O   -1.05351130    1.28769630    0.15142720    0.11973050    0.01436010   -0.02556200
O    1.58456830    1.13636790    0.39829600   -0.02298940   -0.11361510   -0.00569900
C   -0.60991380    0.09167050    0.19471050   -0.12025820   -0.03351140   -0.03612590
C    0.95759540    0.13117840    0.44564800    0.04508790    0.09098380    0.03025050
C   -1.35295620   -0.95214600    0.05530590    0.18970930    0.00079990    0.00376520
C    1.68782520   -1.06159590    0.32889490    0.05636120    0.10380110    0.01045530
C   -1.40525690   -2.21461630   -0.07331340   -0.08464390    0.23913030    0.01024870
C    1.01312840   -2.58768230    0.15336150   -0.27448920   -0.16597670   -0.02981190
H   -2.75231080   -1.10414060   -0.00613640   -0.06321370   -0.05979680   -0.00243800
H    2.76044760   -0.99988490    0.19588050   -0.00243590    0.00138320   -0.00453950
H   -2.20785080   -3.01406510   -0.33088450   -0.01225710   -0.04576920   -0.01089280
H    1.91258580   -3.30105760    0.01430540   -0.02106910   -0.03519520   -0.01924580
C   -0.09311150   -3.09978180    0.06071690    0.18522880    0.08573080    0.04450630
H    1.06010910   -3.97454460   -0.29029080    0.10150410    0.00336810    0.00166270
   15
   -420.19415591
H   -0.38305320    2.18313860    0.12934060   -0.02033130   -0.01034770   -0.00248430
O   -1.06346640    1.52437880    0.24104730    0.04839240   -0.00821930   -0.00452850
O    1.62785980    1.24465510    0.48462620    0.01818100    0.01802430    0.03758670
C   -0.56552460    0.29025240    0.23424430   -0.10713410   -0.05598070    0.01506040
C    0.88480670    0.30830550    0.09808300   -0.01367560    0.05558880   -0.07412250
C   -1.30165760   -0.77772920    0.16768410    0.04398770    0.07266130    0.02962600
C    1.37052210   -1.16529810    0.12452830   -0.07158780    0.02305550    0.01246340
C   -1.20378950   -2.37241960   -0.09379080    0.08801390   -0.12559520    0.00129280
C    1.20289620   -2.62860440    0.12585460   -0.02812540   -0.14642940    0.00489800
H   -2.15234850   -0.13572950   -0.09161910    0.04272220    0.04208060   -0.00662520
H    2.41587950   -1.09099960    0.08561870   -0.04067450   -0.01605440   -0.00091200
H   -2.28253120   -2.44370100   -0.48115780   -0.03684300    0.03512140   -0.01259910
H    1.89605600   -3.56705410   -0.13735310   -0.03926040   -0.06900150   -0.01874530
C   -0.07594530   -3.02195940    0.00657180   -0.01254840    0.12587850    0.00643220
H    0.87780510   -3.88363210   -0.01635420    0.12889510    0.05922510    0.01263830
   15
   -420.16489751
H   -0.15962460    2.14028920    0.32427190    0.03877840    0.06507180    0.00905890
O   -1.03033930    1.36027300    0.18377470    0.01440070   -0.15464610   -0.00645980
O    1.55911220    1.00686460    0.34733220   -0.02128670   -0.13287900   -0.00328940
C   -0.63219180    0.20596080    0.23718980   -0.09114700    0.09041780   -0.00039440
C    0.81409990    0.05333230    0.33203920    0.08924980   -0.09250060    0.00533520
C   -1.33309400   -0.94156800    0.14302510    0.04896760    0.03513440    0.00902720
C    1.48673730   -1.00544130    0.39739110   -0.14006790    0.28592970    0.00956440
C   -1.33412200   -2.32433350   -0.05797720    0.00269700    0.07681110   -0.02284580
C    1.15453730   -2.46091320    0.04546290    0.00394120   -0.04252810   -0.03736010
H   -2.34550870   -0.89369830    0.07918220    0.06419910   -0.04367150    0.00004370
H    2.61845100   -0.89116370    0.60530780    0.03787360    0.00121000    0.01070870
H   -2.68812150   -2.90678290   -0.09062020   -0.08980060   -0.03180490    0.00074290
H    1.77532180   -3.52174930   -0.21378610   -0.05360290   -0.08552690   -0.02570620
C   -0.13634100   -3.13119750    0.06751450   -0.03276250   -0.01108660    0.05278130
H    0.84170970   -3.86576730   -0.36134660    0.12854210    0.04012220   -0.00121290
   15
   -420.20860951
H   -0.16589630    2.11607910    0.14516460    0.03329920    0.02560660   -0.01707130
O   -1.00031980    1.47070210    0.27943480    0.03389220   -0.16408650    0.00193130
O    1.55812510    1.23261140    0.59745000    0.01495840    0.00909880    0.04206730
C   -0.59736050    0.33632500    0.12823000   -0.06256810    0.16309430    0.00831170
C    0.90385500    0.26355570    0.11052350    0.00764350    0.04150870   -0.06185430
C   -1.38292320   -0.85177360    0.17070270    0.00425090    0.03457850    0.02387690
C    1.42161250   -1.11436060    0.06104920   -0.06543100    0.04357080    0.00802710
C   -1.28791200   -2.35506710    0.00713080    0.07902450   -0.06630340    0.02041130
C    1.12746510   -2.51439380    0.22832690    0.01374350   -0.13736190    0.02097410
H   -2.42543900   -0.90749630    0.04250290    0.03385200   -0.04550150   -0.00992280
H    2.47748690   -1.24906480   -0.15402080   -0.01585190   -0.03059610   -0.00338510
H   -2.23623730   -2.90615850   -0.33633020   -0.02452840   -0.02179440   -0.01667610
H    1.51591580   -3.43877350   -0.19654970   -0.13353870   -0.04976160   -0.00209770
C   -0.15847060   -2.94717220    0.01461440   -0.07823970    0.13491010   -0.02020490
H    0.78203770   -3.91132760   -0.09430190    0.15953850    0.06302360    0.00563270
   15
   -420.14482984
H   -0.20545560    1.90259430   -0.16622990   -0.04943070   -0.05404820    0.01328130
O   -0.94373990    1.47947480    0.17429720    0.13089430   -0.16442720   -0.01008030
O    1.62966420    1.14659200    0.52281450   -0.07338070   -0.10507860   -0.01317950
C   -0.63806270    0.33581970    0.27882720   -0.12411520    0.23278330    0.02395440
C    0.97717620    0.25340130    0.20614240    0.12530880    0.18162550    0.00044100
C   -1.41477030   -0.81118310    0.10189840   -0.02571730    0.04188360    0.00619440
C    1.54382060   -1.23947740    0.13645280    0.05434260   -0.09448910    0.01507680
C   -1.39211720   -2.28858470   -0.13476240   -0.13621040    0.02700740   -0.01318920
C    1.28350020   -2.49224400    0.00748480    0.12848210    0.02758250   -0.01850010
H   -2.39471710   -0.63398210    0.04538480    0.08188320   -0.03261460    0.00266230
H    2.43778650   -1.01651340    0.34792960   -0.15162420   -0.02656830   -0.02900110
H   -2.04496490   -3.04374510   -0.51066500    0.04411330   -0.01681960   -0.00222880
H    1.56820320   -3.52534080    0.24481200   -0.11761570   -0.04008400   -0.03830150
C   -0.12974940   -3.07728860   -0.06952690   -0.02408180   -0.03744310    0.02103360
H    0.94123010   -3.96308490   -0.18686060    0.13721300    0.06073200    0.04186910
   15
   -420.05086552
H   -0.09509020    2.31529530    0.40354740    0.02378720    0.09031250    0.01592270
O   -0.96962750    1.45704840    0.10458640    0.02657700   -0.07349980   -0.01556360
O    1.52491680    1.18053640    0.62415660    0.06649200    0.07976400    0.03217570
C   -0.75190180    0.20608370    0.17198530   -0.09443980    0.05609790    0.00058740
C    0.77769620   -0.05419960    0.29577580    0.07024160   -0.25649770   -0.02545960
C   -1.58779730   -0.96286180    0.14069610    0.05768120    0.00041880   -0.00714740
C    1.37007490   -1.14442590    0.35952750   -0.23294470    0.21755720   -0.02843540
C   -1.43551820   -2.47258400   -0.12996240    0.00349840   -0.08036290    0.00802000
C    1.26878140   -2.60262870    0.26795150    0.11725290   -0.17487900    0.01484790
H   -2.71207850   -0.75986970    0.39550330   -0.03842970   -0.00072230    0.01733210
H    2.58799650   -1.08615260    0.56168430    0.05240870   -0.01821660    0.00561950
H   -2.69348600   -2.68125330   -0.55935490   -0.08888630    0.01671140   -0.02802170
H    1.57613030   -3.59350890    0.28195090   -0.11962400   -0.01940010   -0.02501650
C   -0.08240280   -2.94235700   -0.07117760    0.02614290    0.09973430   -0.00188390
H    0.94459140   -4.18938760    0.14381910    0.13023910    0.06302340    0.03704470
   15
   -420.06374394
H   -0.44776730    2.05555740    0.30673830   -0.08976240   -0.10821210   -0.02436870
O   -0.97114330    1.37683520    0.14385870    0.25985590   -0.23730260    0.04824930
O    1.67850150    1.17564960    0.56062390    0.07841510    0.05910850    0.03058940
C   -0.55291250    0.34731260    0.28402990   -0.07993360    0.38952420    0.01388450
C    0.79460280    0.20255420    0.26853010   -0.18553220    0.02566110   -0.04434250
C   -1.29522600   -0.92577050    0.00003170    0.09256870   -0.02043830   -0.04105670
C    1.36546930   -1.26699440    0.15024340   -0.10984660   -0.06618840    0.00188760
C   -1.24657360   -2.37194010   -0.11533460    0.01650050    0.02251430    0.02716920
C    1.26475350   -2.59976730    0.16105420   -0.00494280    0.01892810    0.00244830
H   -2.46641510   -0.82783030    0.26138300   -0.04579780   -0.01790580    0.02168110
H    2.58656610   -1.27038190   -0.00886030    0.04686320   -0.02387750   -0.00905050
H   -2.41927800   -3.03267070   -0.49640280   -0.07911030   -0.04295410   -0.03085430
H    1.78933130   -4.04738450   -0.03668910   -0.00695380   -0.07103120   -0.01013940
C   -0.03878850   -3.05109530   -0.01505630    0.04557610    0.09145530    0.01136730
H    0.80752410   -4.50191610   -0.15752710    0.06206260   -0.01926220    0.00252650
   15
   -420.12533557
H   -0.40283960    2.15589340    0.11634950   -0.12231390   -0.09263380   -0.01974840
O   -0.97874740    1.51326130    0.05650100    0.15698420    0.15392020    0.00524540
O    1.63011020    1.24058490    0.57334870    0.03240870    0.02724120    0.02762500
C   -0.65408270    0.19210670    0.23242560   -0.05176480    0.00565280    0.04611570
C    1.01159900    0.18369460    0.19939370    0.07034920   -0.10735490   -0.05889910
C   -1.51817130   -0.99997600   -0.07325230    0.07313540   -0.11478820   -0.02423130
C    1.57126830   -0.97648980   -0.01919500   -0.15112560    0.16121200    0.00137570
C   -1.25451490   -2.33674350   -0.19228220    0.02349040    0.05069190    0.02263070
C    1.19078620   -2.35601500    0.25854270   -0.01004840   -0.04375950    0.03556130
H   -2.81510930   -0.78159830   -0.05453200   -0.07949380    0.00269830    0.00709590
H    3.15295940   -0.96195340   -0.05473080    0.08753090   -0.00405130    0.00032640
H   -1.99204820   -3.08927370   -0.66513040   -0.00672750   -0.03449590   -0.01882400
H    1.99175000   -3.45655810    0.01874260   -0.01917520   -0.07004840   -0.01753610
C   -0.10743630   -2.97888850    0.07865080   -0.09292080    0.04667240   -0.01990860
H    1.15417010   -3.85654090    0.11209800    0.08961560    0.01897700    0.01319460
   15
   -420.14342236
H   -0.13154000    2.12965070    0.34307680    0.00013970    0.01310410   -0.00121320
O   -0.93112800    1.51341530    0.22637030    0.03344200   -0.09375930   -0.01374720
O    1.60439930    1.27338330    0.60009550    0.05518960    0.07731490    0.05462240
C   -0.52886470    0.34418070    0.26242470    0.03434860    0.11047660    0.05828990
C    0.83874400    0.11070840    0.14831130   -0.04439830   -0.10655530   -0.08938290
C   -1.43436350   -0.78875630   -0.09625640   -0.01328640   -0.00276990   -0.04701460
C    1.39091350   -1.11779440    0.13819800   -0.12183470    0.04757730   -0.01474470
C   -1.20416690   -2.32615290   -0.06464380    0.10248960   -0.13819510    0.03618110
C    1.14973430   -2.61132270    0.36422600   -0.02599460   -0.05627020    0.14137300
H   -2.59561250   -0.54101050   -0.17335560   -0.05196420    0.00210840   -0.00198440
H    2.51861690   -0.71580720    0.06830800    0.03288280    0.03850610   -0.00649180
H   -2.19980380   -2.17649500   -0.54654340   -0.00066570    0.08323120   -0.00340440
H    1.84467800   -3.32680160   -0.47303500    0.00473890   -0.04851880   -0.06051860
C   -0.10660500   -3.07100810   -0.14377640   -0.07464800    0.07383020   -0.07668740
H    0.73919790   -4.01346510    0.57764450    0.06952940   -0.00006870    0.02473710
   15
   -420.22934283
H   -0.28806550    1.77595450    0.40447350   -0.10547050   -0.10227880   -0.02558390
O   -1.09527070    1.46279080    0.23316390    0.09604150    0.05675160    0.01335800
O    1.56657820    1.25427850    0.57973710    0.01287110    0.01699440    0.01727970
C   -0.58073180    0.23114580    0.27417300   -0.06145150    0.05080640    0.02711000
C    0.91920360    0.22420820    0.28912660    0.01277640    0.02423960   -0.03507330
C   -1.27268270   -0.91049090    0.01061030    0.06089850   -0.00078040   -0.00576940
C    1.50683740   -1.14173540    0.19000950   -0.13618680   -0.01011590   -0.00938670
C   -1.26314370   -2.44242380   -0.06251830    0.04771980   -0.07902150   -0.00506940
C    1.27000950   -2.52122720    0.13502590    0.02286390   -0.03902990   -0.01144510
H   -2.22388860   -0.31443700   -0.07865170    0.01393890    0.04348610    0.00443130
H    2.87060200   -0.84283360    0.31516930    0.07859880    0.02217960    0.01340220
H   -2.39109680   -2.75239470   -0.17883200   -0.05338540    0.00622630   -0.00003250
H    1.88425500   -3.57811530   -0.03638680   -0.03158970   -0.08074470   -0.02513190
C   -0.09011090   -3.06826900    0.12313670   -0.07390170    0.06968640    0.04812040
H    0.93774890   -3.98333660   -0.39662780    0.11629740    0.02162480   -0.00621420
   15
   -420.02371829
H   -0.31619930    2.13450430    0.48547720   -0.15059340   -0.09688460   -0.06338710
O   -0.91208260    1.60139210    0.20429610    0.21547740    0.08939020    0.06650000
O    1.65162800    1.23817490    0.50269120    0.06897290    0.09080420    0.04440520
C   -0.78952920    0.31048770    0.27651810   -0.18952350   -0.01274610    0.00619820
C    0.86508300    0.10965340    0.14561340    0.06261600   -0.16589690   -0.08234270
C   -1.46708410   -0.79523850    0.11198130    0.15139620    0.03147430    0.03839240
C    1.40804510   -1.06907590    0.11660120   -0.16842190    0.13115270   -0.00541060
C   -1.37509230   -2.30667010   -0.08837990   -0.00547480   -0.05001780    0.03827100
C    1.29991870   -2.58744720    0.31475840    0.13187840   -0.17272850    0.00825950
H   -2.73629480   -0.34754170   -0.22615620   -0.06440750    0.03079440   -0.02549000
H    2.57969630   -0.80560740   -0.05098360    0.04527100    0.01803080   -0.00455780
H   -2.52781730   -2.45730040   -0.93700480   -0.07467350    0.01569330   -0.05586480
H    2.13523340   -2.92310090   -0.12897470   -0.06804760    0.03193810    0.03998920
C   -0.17308550   -3.06765550    0.00126610   -0.01035880    0.01882270    0.01392110
H    1.12699680   -3.70667930    0.34025470    0.05586900    0.04016140   -0.01893290
   15
   -420.12135485
H   -0.19980460    1.74717990    0.24755170   -0.14869720   -0.11606800   -0.01316820
O   -1.02391870    1.50720400    0.15710720    0.11744640    0.10430750   -0.00629220
O    1.60225430    1.24495530    0.48619290    0.03946240    0.02965250    0.01688330
C   -0.49698500    0.21261030    0.33886090    0.11238190    0.02001070    0.03814980
C    0.85537680    0.18583220    0.28263290   -0.09765970   -0.06643000   -0.03519960
C   -1.34684700   -0.89245080    0.08958750    0.06453770   -0.04179270   -0.01687940
C    1.43952930   -1.02323920    0.13007760   -0.15284750    0.17153400   -0.02414910
C   -1.25482880   -2.34297090   -0.03287290    0.14201450   -0.08118770    0.07160100
C    1.18912350   -2.54869100    0.28292920    0.04880910   -0.15887180    0.05661100
H   -2.45252840   -0.31964070    0.02731400   -0.05046250    0.04515750    0.00287660
H    2.88569610   -1.22081730    0.13785440    0.08275270   -0.03836990    0.00625710
H   -2.29854630   -2.67115690   -0.87953450   -0.05313410   -0.00836290   -0.06180940
H    1.92855400   -3.10736790   -0.27455340   -0.02838120   -0.00500640   -0.00419460
C   -0.18929040   -3.04801040   -0.10525880   -0.16054110    0.08699480   -0.03669610
H    0.85926620   -3.71418160    0.25871900    0.08430090    0.05840160    0.00597360
   15
   -420.16910669
H   -0.31639730    2.03830340    0.24510960   -0.03050280   -0.03890340   -0.00607870
O   -1.11907370    1.54213050    0.20605320   -0.01278640    0.09802170   -0.00167030
O    1.63691720    1.31027250    0.54691060    0.03300590    0.06946980    0.02986240
C   -0.43541110    0.23867050    0.19586930    0.04501520    0.01534770    0.03999710
C    0.95764830    0.21953420    0.21966000   -0.04195860   -0.02177590   -0.03252030
C   -1.28612130   -0.98768710    0.01897100   -0.00716600   -0.21573700   -0.03779210
C    1.46393660   -1.19977330    0.08965570   -0.12843040   -0.00875930   -0.01152550
C   -1.34230270   -2.26034930   -0.10689360   -0.00039490    0.17380960   -0.03553640
C    1.21421780   -2.67924680    0.10858070    0.05021990   -0.15134930    0.01971890
H   -2.04694030   -0.26060840    0.34659940    0.04901320    0.04149040    0.01134650
H    2.76415850   -0.87735180    0.11509950    0.07013950    0.03030960    0.00005000
H   -2.35474370   -2.84180650    0.23455590   -0.04711330   -0.02775440    0.02825960
H    1.74511180   -3.55325300    0.21703650   -0.07744120   -0.00360970   -0.00164190
C   -0.09696500   -3.09115160   -0.05635060    0.00762880    0.03225460   -0.01535210
H    0.95286200   -4.44699350    0.33618250    0.09076730    0.00716130    0.01285250
   15
   -420.00752398
H   -0.51154540    1.92339680   -0.46624660   -0.01072130   -0.01579270   -0.00085500
O   -1.22360930    1.53283450    0.04867560   -0.00751600    0.03740210   -0.02604650
O    1.60626930    1.19217830    0.62031090    0.06693220    0.09044900    0.06466620
C   -0.69239520    0.21152750    0.34772780   -0.15124230   -0.19441390    0.04411260
C    0.82551780    0.10681440    0.18864080    0.00214300   -0.11130330   -0.10991220
C   -1.45577010   -0.71007440    0.13423920    0.22003250    0.20983670    0.03963730
C    1.25324470   -1.17836820    0.49684740   -0.03614140    0.12197320    0.04695550
C   -1.27772210   -2.32051760   -0.11115830    0.02823280    0.00658600    0.02580880
C    1.32986910   -2.65738300    0.07024070    0.11670980   -0.09075570   -0.02022290
H   -2.69336620   -0.22434260    0.01418890   -0.07169720    0.04194160   -0.00654870
H    2.22520790   -1.19212870    0.50758630   -0.12675230   -0.03460000   -0.03438440
H   -2.15997540   -3.12459340   -0.48119640   -0.02936590   -0.06212310   -0.02333530
H    1.95869640   -4.18481860    0.06091890    0.00809420   -0.06809000   -0.00597620
C   -0.12573120   -3.03987000   -0.27425820   -0.09858750    0.05271690   -0.01227850
H    0.84123280   -4.06104190   -0.37734330    0.08985670    0.01614010    0.01836490
   15
   -420.11413849
H    0.35307830    2.04950760    0.50431360    0.00370790    0.04223530    0.01335800
O   -0.89030640    1.49756290    0.16680510   -0.01899050   -0.00425010   -0.05025920
O    1.54528300    1.19671580    0.56940920    0.05669430    0.01868090    0.04515940
C   -0.47547920    0.24790070    0.42460770    0.22868520   -0.02943120    0.04281120
C    0.75014480    0.10059620    0.19287840   -0.24383630    0.02012020   -0.05635910
C   -1.38496960   -0.85556840    0.17483940    0.07255500    0.05216720    0.04408500
C    1.42184350   -1.14824540    0.01196150   -0.08844340   -0.00232170   -0.00972210
C   -1.29655330   -2.37924350   -0.31237450   -0.07036310   -0.12082570   -0.07189730
C    1.24581730   -2.69204130    0.30234400    0.02533140   -0.12705180    0.10925130
H   -2.61616990   -0.64339340   -0.03743990   -0.07118870   -0.00752670   -0.02143860
H    2.46103390   -0.72751690   -0.36341660    0.02705180    0.03233190   -0.01573120
H   -2.14970370   -2.32792120   -0.85609460    0.05008800    0.04219520    0.03519910
H    1.79074800   -3.31749440   -0.48087150   -0.02624500   -0.02102030   -0.03299620
C   -0.06240170   -2.99911840   -0.25923550   -0.02565370    0.09609040   -0.06861070
H    0.62746440   -3.99073290    0.36812700    0.08058820    0.00859660    0.03714010
   15
   -420.12205787
H    0.05695590    2.17691690    0.79498250    0.05630590    0.03883660    0.04459210
O   -1.08170490    1.59478380    0.17940760   -0.10419140    0.01569520   -0.05711170
O    1.65719470    1.07279640    0.61110020    0.07271030    0.03933790    0.01986650
C   -0.52284790    0.26180430    0.21658690    0.04064090   -0.13700440    0.01303070
C    0.77909320    0.06062710    0.26879720   -0.13489520   -0.08969530   -0.03826420
C   -1.35638460   -0.69462560    0.04853830    0.12368160    0.12060610   -0.01144390
C    1.45184670   -1.11178700    0.03381740   -0.10587870    0.07853160   -0.03079350
C   -1.31683310   -2.20144930   -0.13161760   -0.05233250   -0.03463830   -0.00938460
C    1.34703880   -2.56401120    0.32827560    0.14379490   -0.12978090    0.05549580
H   -2.38954010   -0.25845950    0.31803200   -0.01807980    0.02347910    0.02364240
H    2.51049490   -0.78224250   -0.13703610    0.01252710    0.00984430    0.00182750
H   -2.32829020   -2.47317040   -0.41628340   -0.00551430    0.02173160   -0.00069930
H    2.05129020   -3.10734480   -0.15810160   -0.06299710    0.02596710    0.02918870
C   -0.11117630   -3.02696530   -0.12431250   -0.04131190    0.01568630   -0.04764240
H    1.12756140   -3.97151120    0.43215410    0.07554070    0.00139050    0.00768930
   15
   -420.15846861
H   -0.09813220    2.00367840    0.79947780    0.05195240    0.02198400    0.04757620
O   -0.99808000    1.53193770    0.21093320   -0.07551040   -0.01327310   -0.06358710
O    1.59269660    1.05319930    0.63224250    0.03500800    0.01869800    0.01621380
C   -0.51029240    0.25945460    0.22072450    0.05056570   -0.03428250    0.02918510
C    0.81287450    0.04320010    0.25155960   -0.08293730   -0.10833240   -0.04566660
C   -1.35367900   -0.74407480   -0.01259030    0.12513410    0.08420910   -0.04882160
C    1.47559610   -1.10110010    0.08639420   -0.15722270    0.10014700    0.00431820
C   -1.38695200   -2.25310770   -0.11370200   -0.11197860   -0.03993320    0.00480480
C    1.34439090   -2.52006230    0.29332000    0.10608170   -0.05077260    0.06574330
H   -2.44868350   -0.41081000    0.44027030   -0.04087320    0.01154900    0.04286230
H    2.66390700   -0.94758650   -0.19377950    0.05740360   -0.00887180   -0.01710490
H   -2.30001900   -2.55230310   -0.59177770    0.00581900    0.01923020   -0.00516220
H    2.14002100   -3.07054670   -0.17376680   -0.02236930   -0.00089470    0.01003710
C   -0.04620090   -3.06254900   -0.16317160   -0.00174550    0.00651380   -0.04064200
H    1.25363270   -3.88766270    0.55083210    0.06068210   -0.00595500    0.00022660
   15
   -420.04648251
H   -1.05202760    1.67939250   -0.93826940   -0.00079400    0.00833190   -0.03407830
O   -1.18206900    1.49313480    0.04719650    0.00735590   -0.01578210    0.00271980
O    1.61468150    1.12282660    0.64490040    0.06309520    0.03511130    0.03486300
C   -0.61299160    0.27496750    0.39907980    0.10888500   -0.01461930    0.07607350
C    0.71551620    0.18066050    0.35689430   -0.11318780   -0.06368570   -0.05393910
C   -1.46418390   -0.81023750    0.17537200    0.10273200    0.03014320    0.00435250
C    1.21205570   -1.11422070    0.53806710   -0.11083170    0.10699400    0.03988870
C   -1.36560500   -2.19636740   -0.24216050   -0.11093860    0.03256390    0.00050200
C    1.33483800   -2.52087310   -0.01005180    0.12637930   -0.05816930   -0.03664580
H   -2.76363260   -0.55450390    0.21453180   -0.08125640    0.00580830   -0.00067820
H    2.22344300   -0.78530960    0.62563090   -0.02868350    0.01070440   -0.03303930
H   -1.90296670   -3.10121720   -0.10794310    0.05562030   -0.00650620   -0.00010410
H    1.78441150   -4.21973780    1.36509800    0.00195100   -0.04166920    0.03325310
C   -0.09817290   -2.97284660   -0.48847330   -0.09352990    0.03388300   -0.04200490
H    0.48502550   -4.30286220   -0.59243350    0.07320820   -0.06310640    0.00883450
   15
   -420.35794599
H   -0.46075490    1.86726450    0.38838700   -0.07040200   -0.05120740   -0.03558510
O   -1.00096550    1.27063850   -0.00641050    0.10948740    0.06941480    0.03922150
O    1.48528870    1.06783060    0.03459550    0.01838530    0.00338940   -0.00817530
C   -0.62266070   -0.09244520    0.03567440   -0.06408510   -0.20671710   -0.00529880
C    0.78958460    0.03703540    0.05290300   -0.04127100    0.07449370    0.01960140
C   -1.57583650   -0.92776770    0.05255890    0.02961180    0.01096910   -0.00853450
C    1.43422860   -1.27402320    0.02585070   -0.03275640    0.03931450   -0.00848720
C   -1.37783970   -2.26172680    0.07466850    0.04506350    0.01131160    0.01400830
C    1.07922590   -2.64302470    0.03634630    0.04188620   -0.01910160   -0.02279760
H   -2.55271330   -0.52385780    0.20859400    0.01299810   -0.00333580    0.00638550
H    2.46097460   -1.06359420    0.12777540   -0.03341690    0.00316240   -0.00151490
H   -2.36026930   -2.44915280   -0.09335310    0.05921590    0.07043960   -0.00571820
H    1.55904050   -3.64417580    0.40093950   -0.02317630   -0.05688430    0.02465540
C   -0.33081160   -3.03418910   -0.00454260   -0.11883650    0.11102950   -0.04534110
H    0.00048200   -4.27550580    0.44953820    0.06732030   -0.05631370    0.03754530
   15
   -420.34593639
H   -0.14797400    1.72716820    0.40117560   -0.00414710   -0.01733320    0.00890660
O   -1.03281510    1.35040850    0.17832510   -0.01011300    0.06995900   -0.00361470
O    1.34869550    1.11505250   -0.05322580   -0.05829960   -0.00587640    0.01351860
C   -0.59320950    0.01637790    0.01523400   -0.01050010   -0.04643480    0.02837170
C    0.95470270   -0.04290860   -0.23746080    0.11222320   -0.05636730   -0.05236430
C   -1.46020540   -1.01780540    0.00485760    0.12814400   -0.05870420   -0.01282080
C    1.47641570   -1.28194490   -0.02648610   -0.19264650   -0.05038970    0.00436990
C   -1.32724010   -2.35718840    0.07916530    0.01078930    0.06560070    0.03788700
C    1.16250880   -2.50469250   -0.18398230    0.03175520    0.18802690   -0.03379900
H   -2.72382990   -0.67100100    0.16844020   -0.07553450    0.01255880    0.00806890
H    2.76068170   -1.32943830    0.17068310    0.06681390   -0.02160500    0.01080280
H   -2.31077900   -3.02244310    0.20667780   -0.04316360   -0.03213650   -0.00236710
H    1.88330300   -3.48122910    0.06683750    0.01622020   -0.06307180    0.01634040
C   -0.12393930   -3.11338030   -0.07276430    0.05674750   -0.04595760   -0.02428340
H   -0.40218410   -3.59297630    0.85157590   -0.02828090    0.06175150    0.00096820
   15
   -420.32004495
H   -0.31491280    1.85916350    0.23234050   -0.09766500   -0.06232760   -0.01301660
O   -1.07204070    1.40982750    0.10037740    0.07314240    0.13681110    0.01553520
O    1.40019140    1.23277500    0.04829250    0.01228670    0.08293150    0.03219150
C   -0.51747700   -0.03631060    0.00403700    0.09216990   -0.10859820    0.00611130
C    0.87152470    0.01293870   -0.20134960   -0.03619900   -0.06050600   -0.06368590
C   -1.56122360   -0.92983590    0.05128470    0.06734510    0.01270360    0.02274320
C    1.57372300   -1.22304720   -0.10405420   -0.02582810    0.07256840    0.04785230
C   -1.40539290   -2.34775840    0.01936770   -0.01585030   -0.04145810    0.02181840
C    1.18668520   -2.64816650   -0.20383840   -0.03112580   -0.02116550   -0.01371840
H   -2.84240350   -0.52350680    0.06228790   -0.08782840    0.01762620   -0.00409310
H    2.64451710   -1.12472870   -0.22544380   -0.00664080   -0.00598240   -0.00646260
H   -2.35062250   -2.89147390    0.05632340   -0.00689050    0.00687240   -0.01208760
H    2.24475420   -3.63259850   -0.29283370    0.06973180   -0.06553300   -0.01183010
C   -0.17760290   -3.08808240    0.01801550   -0.01284960   -0.07851580    0.06375280
H   -0.39524840   -3.51077590    0.86223590    0.00622100    0.11457140   -0.08510920
   15
   -420.37782020
H    0.00472850    1.55068540    0.25208120    0.01052710   -0.05557590    0.01403450
O   -0.99484350    1.32457630    0.01316060   -0.03125180    0.02060190   -0.02114310
O    1.35638450    1.05277700    0.02803860   -0.08031260   -0.08250010    0.00019180
C   -0.56128120    0.07219200    0.07336050    0.00703510    0.03030090    0.01907340
C    0.89010590   -0.04221990   -0.02814020    0.03116140    0.10984140   -0.03470310
C   -1.38368970   -0.98647010    0.04457580    0.14043840   -0.03854860    0.03936010
C    1.58393900   -1.40100410    0.07647610    0.07247450   -0.10766540    0.02769160
C   -1.42479180   -2.35259880    0.05323890   -0.05846530    0.00717940    0.04619090
C    1.10278720   -2.60980880   -0.11497390   -0.06017430    0.02670840   -0.00423250
H   -2.50047640   -0.50260520   -0.24282220   -0.04716310    0.02375730   -0.02610000
H    2.54500280   -1.29229470   -0.09171290   -0.10128270   -0.01323560    0.00286050
H   -2.42861540   -2.80677020   -0.12945780   -0.02190560    0.00322610   -0.01718330
H    1.96783920   -3.32391760   -0.09760730    0.02095310    0.00178720   -0.00025410
C   -0.14505250   -3.09066750   -0.09353940    0.12772610    0.01222580   -0.05863790
H   -0.31396330   -3.65881600    0.80954810   -0.00975760    0.06191750    0.01282690
   15
   -420.28327644
H    0.16046080    1.88735970    0.27383780   -0.00034680    0.04124450    0.02463550
O   -1.10391810    1.24844090    0.04708210   -0.03556110   -0.04994250   -0.01607260
O    1.43183180    1.09903260    0.00179540    0.03146530    0.01406240   -0.00290710
C   -0.63046960    0.08972860    0.06156260   -0.06017800    0.03843410    0.00394330
C    0.85353700   -0.09533280   -0.06087200   -0.00143290   -0.03529560   -0.03720270
C   -1.47150270   -0.99182490    0.18245220   -0.02559100    0.08959020    0.04308810
C    1.57049210   -1.33798970    0.09996400    0.02213030   -0.00605730    0.05181650
C   -1.45369700   -2.39621270   -0.15363970   -0.02381490   -0.03202370   -0.05574010
C    1.04028580   -2.69345890   -0.11720650   -0.25318700   -0.06350730    0.00383010
H   -2.29869110   -0.59032670   -0.13848650    0.11730380   -0.03596560    0.00672680
H    2.62200930   -1.07367680    0.05277570   -0.00707140    0.01643960   -0.00323880
H   -2.57643970   -2.87044470    0.01137180   -0.06576660   -0.01140240    0.01575770
H    2.10745690   -3.74440570   -0.24290570    0.05524390   -0.06111900   -0.01902140
C   -0.10688450   -3.13647240   -0.03332700    0.26241960    0.06645270   -0.05855140
H   -0.36480060   -3.76809880    0.88642950   -0.01561850    0.02910260    0.04291750
   15
   -420.36504022
H   -0.15681380    1.90692750    0.10034380    0.04169640    0.03442470    0.00893290
O   -1.12986200    1.32228110    0.05743600   -0.06073330   -0.06500680   -0.00669670
O    1.35211300    1.15529390   -0.15445170   -0.03292590    0.04040980   -0.00960400
C   -0.72790790    0.10765170    0.03673330   -0.05916960    0.03776260    0.00319460
C    1.03016920   -0.06964290   -0.04224830    0.13521590   -0.10682830    0.00435420
C   -1.69195940   -0.84218860    0.19141070   -0.03565800    0.04662600    0.02045730
C    1.58684390   -1.29603340    0.04156470   -0.14754870    0.03282810    0.03743020
C   -1.36329840   -2.29951350    0.03423310   -0.02685430   -0.07656520   -0.00860850
C    1.28250100   -2.61441840   -0.15733720    0.12254350   -0.03549250   -0.01259450
H   -2.58073620   -0.26590230    0.47618560    0.01690580    0.03131380    0.00515910
H    2.82092610   -1.20688800   -0.11696180    0.05518150   -0.00494280   -0.01470600
H   -2.24979580   -2.77285520    0.25913010    0.03223620    0.04157950   -0.01156400
H    1.99663400   -3.34861720   -0.26738880   -0.03407240    0.02809130   -0.00117750
C   -0.16130470   -3.09788750   -0.11440320   -0.00319060   -0.01308610   -0.08276560
H   -0.25599890   -3.68694930    0.98391250   -0.00363790    0.00883370    0.06814170
   15
   -420.12868960
H   -0.40580030    2.56215150   -0.16690720    0.03599740    0.10015160   -0.03011150
O   -1.10120650    1.48506460    0.21696160   -0.04998340   -0.02509710    0.04045360
O    1.54218590    1.24938820    0.08766580   -0.02846130    0.07379760   -0.00208620
C   -0.57120320    0.21553990   -0.02297980   -0.01545260   -0.00406920   -0.03042900
C    1.13845720    0.03793010    0.05771930    0.10221630   -0.06565110    0.01025490
C   -1.44325210   -0.89396850    0.08854730    0.09664470   -0.02438540    0.03641500
C    1.48860120   -1.34419020   -0.03617350   -0.16432860   -0.03782800    0.01170280
C   -1.42264290   -2.29728870   -0.09508280   -0.05298690    0.04550290   -0.00849870
C    1.22555790   -2.65507090   -0.14641910    0.02394570    0.04687940    0.05197730
H   -3.05045110   -0.41417060    0.07182030   -0.07869550    0.01900100   -0.00268860
H    3.05714650   -1.39273790   -0.03161200    0.07563180   -0.01269290    0.00329700
H   -2.32982810   -3.10054320   -0.22586530   -0.03623670   -0.05518400   -0.01623900
H    1.83086270   -3.56559360   -0.76414800    0.00604540   -0.05523410   -0.05083900
C   -0.09905250   -3.15465660   -0.03298470    0.09117430   -0.03336990   -0.06011020
H   -0.28123810   -3.63214540    1.01499780   -0.00546300    0.02818900    0.04691830
   15
   -420.19973007
H   -0.12289780    1.53213370   -0.28879000   -0.01406100   -0.08026610    0.00879900
O   -1.04903740    1.32919160   -0.06625440   -0.00485090   -0.03890320   -0.00641890
O    1.56500140    1.08661490    0.10588600    0.00831750   -0.01562830    0.02439800
C   -0.59451590    0.16072330    0.18307490    0.00539400    0.09005480    0.03870600
C    0.92046830    0.03984650   -0.07024060    0.01491950    0.02727070   -0.05955660
C   -1.48981250   -0.88832040    0.05398660   -0.11712830   -0.04869630   -0.03329870
C    1.57422230   -1.23831790   -0.03924890   -0.09169660    0.04803890    0.01656450
C   -1.40155910   -2.21177870    0.05368820    0.05094180    0.05098900    0.08870310
C    1.16385700   -2.61875340   -0.07980340    0.02814830    0.02374490   -0.00627360
H   -2.43096610   -0.94142270   -0.04486920    0.13975170   -0.08041650    0.00353070
H    2.97936610   -0.90186580   -0.03887860    0.08573640    0.02760530   -0.00013630
H   -2.51947080   -2.31930430   -0.54503550   -0.04734890    0.05317950   -0.04447840
H    2.00217220   -3.85109470    0.02803640    0.04471380   -0.08660690    0.00707130
C   -0.40736790   -3.12876740   -0.15886750   -0.10968000   -0.03083510   -0.04056900
H   -0.41612140   -3.74961190    0.69600380    0.00676740    0.06048020    0.00302400
   15
   -420.18966975
H   -0.36657620    2.21408950   -0.32275600    0.02253970    0.06317620   -0.05247330
O   -0.93940470    1.34482470    0.25117540    0.06895630   -0.34256080   -0.01925130
O    1.50032960    1.26591310    0.05432790    0.01244670    0.08726620    0.02095180
C   -0.61018330    0.31032020   -0.09332100   -0.09398310    0.30003060    0.04697100
C    0.94413850    0.08825030   -0.12244700   -0.01931090   -0.02189340   -0.02472060
C   -1.48686340   -0.78157120    0.05184910    0.07701550    0.02849550    0.03406100
C    1.58438000   -1.37218050   -0.08515050   -0.05020800   -0.01190290   -0.00002570
C   -1.29434180   -2.22287300   -0.09943050    0.08534690   -0.00846200   -0.00400690
C    1.09863190   -2.72601390   -0.30654720   -0.03689100   -0.04792250    0.00317400
H   -2.95004900   -0.56711350    0.10268140   -0.09465060    0.00064510   -0.00142910
H    2.88534340   -1.42062290    0.24801450    0.07941350   -0.01349240    0.03070190
H   -2.45455930   -2.76681700   -0.06910580   -0.06772820   -0.02833100   -0.00595160
H    1.95688530   -3.36942500   -0.73927610    0.02898850   -0.00762520   -0.03202940
C   -0.27037490   -3.17445340   -0.19428160    0.02454480   -0.00785350   -0.06989150
H   -0.76207230   -3.59768590    1.07844990   -0.03645950    0.01042360    0.07389580
   15
   -420.25871168
H    0.07218990    1.70798820    0.00805070    0.01070300   -0.02745550    0.00973240
O   -1.03895340    1.27774260   -0.16367240   -0.01299630   -0.17811040   -0.00525070
O    1.43195300    1.20550880    0.09989280    0.03297990    0.02810170    0.01820070
C   -0.57215760    0.20070040    0.01902800    0.07082070    0.18856380    0.00889310
C    0.85083230    0.03988660   -0.08002090   -0.03562740   -0.00162870   -0.02844460
C   -1.56078100   -0.86929510    0.08106250   -0.16942630    0.04075200    0.00479650
C    1.49082490   -1.22103960   -0.15551020   -0.01325580    0.04225890   -0.02828900
C   -1.28016700   -2.35197320   -0.04517410    0.20670340   -0.22836210    0.02524310
C    1.10420320   -2.60141560    0.01190090    0.06756410   -0.03390030    0.03808940
H   -2.53826060   -1.02065590    0.01289570    0.08955540   -0.07455530   -0.01004090
H    2.53961570   -1.19191390    0.08477960   -0.01468640   -0.01285250    0.01302910
H   -2.37349790   -2.16731510   -0.35760860   -0.01379320    0.11494350   -0.00431240
H    1.89068840   -3.33943680   -0.05309800   -0.00544880    0.00165930   -0.01134890
C   -0.33887340   -3.14674000   -0.10811710   -0.20880290    0.11289490   -0.07944480
H   -0.48372060   -3.77354420    0.86682690   -0.00429230    0.02775690    0.04921650
   15
   -420.31604269
H   -0.05847930    1.94711010    0.00228660    0.03926330    0.02399290    0.01336170
O   -1.01218140    1.41601250   -0.15291780   -0.06886620    0.00661270   -0.02025370
O    1.50255030    1.06485280    0.03177520   -0.01298910   -0.01229490    0.01032930
C   -0.56197760    0.14081200   -0.05274990    0.05210090    0.01184890    0.01015040
C    0.92795460   -0.04847230   -0.11697990    0.09225780   -0.11918060   -0.02063400
C   -1.53699320   -0.88894120    0.15074700    0.03609530   -0.05265000    0.06322110
C    1.52036020   -1.19244630    0.04049060   -0.09395690    0.21567610    0.00250900
C   -1.37651980   -2.29462340    0.01200450    0.04851360   -0.08309360    0.00244700
C    1.22514040   -2.69037390   -0.11810780    0.07728660   -0.07076970   -0.01168290
H   -2.82051310   -0.53359840   -0.10987290   -0.08154660    0.01199070   -0.02862110
H    2.57763180   -1.09897010    0.30052470   -0.00134410   -0.00575940    0.00502800
H   -2.45350700   -2.47313810    0.07359260   -0.00909450    0.05102170   -0.00580750
H    2.00628620   -3.52912030    0.00060150    0.02498100   -0.03390250    0.00277570
C   -0.31882680   -3.09902260   -0.20228290   -0.09274160    0.05823990   -0.10258160
H   -0.49184460   -3.79011620    1.01898840   -0.00992820   -0.00174270    0.07976120
   15
   -420.19697837
H   -0.08685650    1.74885920    0.10145140    0.05837580   -0.01850540    0.02500660
O   -1.09919190    1.37666980   -0.16597370   -0.09520750    0.00951190   -0.05078600
O    1.54598630    1.10126570   -0.03620300    0.05436630    0.04037070   -0.00157210
C   -0.61263640    0.06159860    0.10647690    0.00279920   -0.09610690    0.03907100
C    0.82114770    0.04149950   -0.02353570   -0.10008700    0.03900320   -0.00632010
C   -1.57173180   -0.82788680    0.15022270   -0.00816470    0.07145340    0.00629160
C    1.64540640   -1.36621900    0.00730670   -0.08606110   -0.13009300    0.00695690
C   -1.36665170   -2.28969490   -0.11626390   -0.06406860   -0.10288260   -0.01292110
C    1.26058110   -2.56416550   -0.11708760    0.07244930    0.17462890   -0.04065760
H   -2.57045400   -0.43230310    0.40840990   -0.00617750    0.01038240    0.01285800
H    2.89132180   -1.33737130    0.00880420    0.06738250   -0.02012320   -0.00283350
H   -2.33076290   -2.31625410   -0.32582790    0.09598760    0.07707170    0.00796760
H    2.36628570   -3.76859580    0.27224560    0.05737830   -0.06023800    0.02567950
C   -0.24720470   -3.13759260   -0.08657780   -0.11422000   -0.19478600    0.19647790
H   -0.53731470   -3.55884340    0.62628340    0.06526420    0.20025990   -0.20517120
   15
   -420.28528381
H   -0.06239550    1.62624120    0.23710150    0.03511190   -0.00123170    0.02561250
O   -0.95136600    1.17558720   -0.10876980   -0.03635050   -0.01712520   -0.03244110
O    1.52764740    1.03809290   -0.01747440    0.04145730    0.07835780   -0.00382730
C   -0.56428270   -0.13760680    0.04331680   -0.00560580   -0.10827650    0.02172910
C    0.91252960   -0.12409180   -0.02082320   -0.01884910   -0.04331340   -0.00848570
C   -1.60354990   -0.93400770    0.05701850   -0.01121490    0.14380540    0.01012680
C    1.54284110   -1.39010610   -0.03980080   -0.18525250   -0.23858160    0.00462200
C   -1.42185740   -2.43254730    0.11796020    0.11444180   -0.01530390   -0.03342710
C    1.16167570   -2.52512590   -0.16211630    0.05582200    0.25190820   -0.00158830
H   -2.61622440   -0.73998400   -0.05222390    0.03116420   -0.03146500   -0.00118220
H    2.90065780   -1.08949410   -0.14087850    0.07634580    0.02196780   -0.01208660
H   -2.61086270   -3.08392650    0.50169550   -0.07286840   -0.03872110    0.02175000
H    2.13850690   -3.35545460    0.10232480    0.06499390   -0.03612140    0.02762130
C   -0.35046510   -3.17360540   -0.00467390   -0.13637090   -0.02090140   -0.01180280
H    0.26249840   -3.75642050    0.66642410    0.04717720    0.05501820   -0.00662400
   15
   -420.14764822
H    0.04985140    2.17561920   -0.07500370    0.00933890    0.04550340    0.00516160
O   -1.12079510    1.26384860   -0.27930970    0.04983460   -0.28595150    0.03902070
O    1.44756910    1.08573170    0.16744540   -0.02991260   -0.11282400    0.00188960
C   -0.67774130    0.28396710    0.02216700   -0.08131430    0.32860900   -0.02506140
C    0.92201710    0.03370460   -0.05923900    0.03424340    0.03746940   -0.02172840
C   -1.60533070   -0.91217660    0.11034590   -0.14804180    0.01445580    0.01825210
C    1.67958150   -1.15675490   -0.05653580   -0.03648330    0.13369160   -0.00195850
C   -1.21680360   -2.24943680   -0.06657070    0.17614130   -0.05545800    0.01324110
C    1.12578820   -2.51831660   -0.09677650    0.05267750   -0.02610270    0.00694550
H   -2.49897520   -0.54094920    0.23996080    0.10304700   -0.01896350   -0.00760200
H    2.99323350   -1.49273850    0.11868620    0.07754260   -0.05139330    0.01240300
H   -2.75049660   -2.77469270   -0.41652380   -0.06019160   -0.01223900   -0.02376350
H    1.69066220   -3.40584830    0.00068850   -0.03869030    0.00395620   -0.00466540
C   -0.31600870   -3.20530090   -0.17720400   -0.12018540   -0.01519740   -0.06872260
H   -0.23863530   -3.65876690    0.94997710    0.01198520    0.01443180    0.05661480
   15
   -420.27759391
H   -0.15028920    2.09912470   -0.29403840    0.03073870    0.04864340   -0.02394710
O   -0.94404710    1.41774900    0.00350380   -0.02420910   -0.05077220    0.03123610
O    1.52974050    1.14217400   -0.10503900    0.00977920    0.08470720   -0.02068000
C   -0.53401720    0.18084730   -0.09711170    0.03503070    0.05483020   -0.04568350
C    0.93694900   -0.04435350    0.05042260    0.00935610   -0.06199990    0.04991700
C   -1.61611320   -0.82212220    0.11975720    0.00325920   -0.00621040    0.05774950
C    1.56179490   -1.41800840   -0.03161340   -0.10045160   -0.33348530   -0.08472220
C   -1.54627970   -2.21940580   -0.00094090   -0.06599080    0.11109760   -0.00586710
C    1.14393710   -2.50045230   -0.24870330    0.08457420    0.33009310    0.09796670
H   -2.67114750   -0.47467960   -0.10839530   -0.02476810   -0.00470570   -0.01730000
H    2.51673200   -1.15891900    0.41125280   -0.02380820    0.01488620    0.01910950
H   -2.35527070   -3.09127640   -0.03466860   -0.01283890   -0.05972530   -0.00897910
H    2.12038620   -3.37716940   -0.64690680    0.05688200   -0.04303370   -0.03560420
C   -0.23679020   -3.21505260   -0.17959030   -0.01860540   -0.11622460   -0.01975660
H    0.24044960   -3.80636310    0.63187450    0.04105520    0.03186140    0.00654820
   15
   -420.17125067
H    0.01074350    2.47560840   -0.21983030    0.02492470    0.08453010   -0.01895810
O   -1.05380550    1.40396510    0.07341540    0.01612140   -0.06121180    0.01459160
O    1.40986050    1.36268810   -0.06306070    0.01718100    0.06353420    0.00327800
C   -0.65649730    0.18230340   -0.06051200    0.00718390    0.01889870   -0.02047750
C    0.83708010    0.20130100   -0.05869460   -0.02212840    0.04059160    0.00020500
C   -1.61643300   -0.93766230    0.07255790    0.00207290    0.00805300    0.00134740
C    1.61551140   -1.30263160   -0.00894630   -0.04577130   -0.09420820    0.03334130
C   -1.41646370   -2.52907900   -0.04445840    0.12763130   -0.09279030    0.04001820
C    1.16696650   -2.62839750   -0.11028990    0.00291840   -0.00345010    0.02654010
H   -2.74225350   -0.57447500    0.41614650   -0.05845860    0.02080470    0.02760330
H    2.79673260   -0.71197950   -0.18698130    0.05808160    0.05987460   -0.01337820
H   -2.55553240   -3.02118150   -0.60369630   -0.06316410   -0.02144830   -0.05549900
H    1.85325530   -3.64131510   -0.41041570    0.02322030   -0.06766460   -0.02250810
C   -0.30328240   -3.22027190   -0.03516880   -0.15909220    0.02438860   -0.05685170
H    0.34587620   -3.81859170    0.83569190    0.06929880    0.02011230    0.04074640
   15
   -420.17449176
H    0.06630540    1.88315850   -0.47299330    0.03965410   -0.00210650   -0.02844290
O   -1.02575570    1.49649840   -0.16899410   -0.07412830   -0.05939010    0.02692450
O    1.45989990    0.99523110   -0.04946470   -0.06943170   -0.11550820    0.01397180
C   -0.58282210    0.32357630   -0.09437040    0.09135130    0.17183110   -0.01506360
C    0.83681880   -0.01771670   -0.12571450    0.00724550    0.09469340   -0.02580900
C   -1.60306870   -0.80318280    0.12125330   -0.00195080    0.05105620    0.05465580
C    1.58027180   -1.35099850    0.00044730    0.07172390   -0.06116890    0.02933450
C   -1.54296650   -2.28377570   -0.15551430   -0.05684540    0.00865500   -0.07640220
C    1.06207480   -2.58121490   -0.16836480   -0.22728180   -0.05887390    0.03735640
H   -2.71002630   -0.69798840    0.05783920   -0.01589810   -0.02975940   -0.00937410
H    2.58578360   -1.43619850    0.12897030   -0.05698780   -0.02862130   -0.00309480
H   -2.54531610   -2.96212770    0.19573210   -0.05868970   -0.03852700    0.02535130
H    2.63021990   -3.46606810   -0.53983230    0.05512480   -0.01714340   -0.01925940
C    0.00026770   -3.12593180   -0.00426000    0.27233480    0.12456400   -0.07005490
H    0.11039220   -4.09904870    0.81001050    0.02377390   -0.03974010    0.05989980
   15
   -420.11602910
H   -0.40979650    2.35630200   -0.41005210    0.02968200    0.09481380   -0.04214140
O   -0.96725490    1.43854090    0.12254300    0.00894580   -0.07888280    0.02886380
O    1.56661640    1.11142560    0.00876110    0.01616690   -0.03437020   -0.00277820
C   -0.62306630    0.12057550   -0.01419090    0.00570120   -0.02379560   -0.00463280
C    0.83830020    0.13452260    0.04068030   -0.08250720    0.08234990    0.02053760
C   -1.65666940   -0.81429050    0.02921450    0.01673320    0.02703850   -0.00033460
C    1.70792840   -1.16972480    0.03173830   -0.02104220    0.14253440    0.07387150
C   -1.47232550   -2.53488500   -0.10056300    0.01957500   -0.03148570    0.04249690
C    1.24808880   -2.59436740   -0.24083000    0.03532380   -0.01738040   -0.04294540
H   -2.72723430   -0.22054000    0.36923730   -0.05530040    0.04616740    0.02971230
H    2.99962670   -1.54449060   -0.47348440    0.06538800   -0.05674810   -0.03870100
H   -2.60233270   -3.35296530   -0.98436760   -0.04890000   -0.04324420   -0.06178900
H    1.87958950   -3.70208940   -0.27260240    0.01499030   -0.07719800    0.00208140
C   -0.21892490   -3.22074700   -0.10842460   -0.03976180   -0.04012020   -0.06037750
H    0.08842150   -3.88253510    0.84060900    0.03505330    0.01035370    0.05614660
   15
   -420.07103935
H   -0.35647250    2.23874630    0.21293030    0.01480000    0.07348850    0.00313190
O   -1.01557640    1.38684850    0.20514400    0.04609630   -0.08346470   -0.00511670
O    1.49113780    1.23695670    0.08741090    0.07401560    0.10271420    0.00227830
C   -0.67448350    0.15282210    0.06673800    0.00598530    0.06970160    0.00028460
C    0.75670280    0.06526210    0.03834170   -0.14919310   -0.03804140    0.01491180
C   -1.67517570   -0.98932580   -0.06271110   -0.21819460   -0.04398190    0.00373070
C    1.70521290   -1.27020930   -0.20721010   -0.03936590   -0.16010950    0.08697620
C   -1.47996100   -2.35244870    0.02621110    0.02120200    0.08484470    0.08095350
C    1.31640110   -2.45578170   -0.17731850    0.12542990    0.23531840   -0.03130990
H   -2.52463860   -0.66911140    0.10397990    0.17688550   -0.06109270   -0.01367130
H    2.63613260   -1.02767050   -1.18020170    0.04241290    0.00471110   -0.07241510
H   -2.10295280   -3.00263270   -0.85651220    0.00966700   -0.02604230   -0.06210370
H    1.43343710   -3.81669010   -0.27944370   -0.03789800   -0.08940510    0.01109750
C   -0.37683330   -3.16807670    0.02999200   -0.11729500   -0.02181350   -0.07704600
H    0.18818930   -4.39406440    1.07139330    0.04543980   -0.04677180    0.05826170
   15
   -420.18521219
H   -0.75840100    2.24269640   -0.21188090   -0.03683900   -0.01452260    0.02032390
O   -1.00418170    1.40133180    0.11304540    0.07911920    0.01850930   -0.03330300
O    1.44524960    1.24155190   -0.10053400    0.02494010    0.04230360   -0.00504220
C   -0.62397590    0.12323340   -0.00296090    0.09300980   -0.00231020   -0.01696090
C    0.80730140    0.15185050   -0.05600890   -0.09132760    0.04401910    0.02919830
C   -1.77579350   -0.86518080    0.15305950   -0.07703580   -0.00545650    0.03361120
C    1.61281860   -1.20430550   -0.23773710   -0.07984990   -0.02599260   -0.00559460
C   -1.25549480   -2.42857510   -0.00043370    0.08983810   -0.04049500    0.04610260
C    1.41869560   -2.51186610   -0.21403430    0.13209440    0.07753740   -0.02451930
H   -3.01316340   -0.38272060    0.18547130   -0.08372660    0.03888060    0.00428170
H    2.78480450   -1.31894800   -0.27602370    0.03100600   -0.05007060   -0.00138500
H   -1.73089510   -3.01959360   -0.87182710    0.04057920   -0.00269620   -0.04389380
H    1.96409530   -3.52874250   -0.11556620   -0.01555690   -0.05340240    0.01446930
C   -0.11674990   -3.11534410   -0.12370640   -0.17646240    0.00230780   -0.07161670
H    0.49788750   -4.20566030    0.63325050    0.07018050   -0.02859070    0.05433930
   15
   -420.29273885
H   -0.49038880    2.26732340   -0.25086570    0.03535190    0.09287930   -0.03593380
O   -1.13653140    1.31029320    0.15552850   -0.04126630   -0.07044530    0.03099050
O    1.56577530    1.10730420   -0.09283240    0.03632910    0.02236870    0.00313670
C   -0.63585060    0.03916630   -0.01320440    0.02412410   -0.02920280   -0.01951870
C    0.90840180    0.02574060   -0.09063700   -0.03025320    0.01083140    0.00149110
C   -1.72575460   -0.89562540    0.08114500   -0.08225020    0.02897580    0.01172250
C    1.67821460   -1.25404560   -0.01660060   -0.06609950    0.03952910    0.06789560
C   -1.37965350   -2.34450530   -0.28852860    0.00242650   -0.01291090    0.02045810
C    1.31525880   -2.59914690   -0.12753610    0.11538270   -0.01818350   -0.06582760
H   -2.66564120   -0.58478570    0.62855680   -0.01430080    0.00719070    0.03232790
H    2.91543570   -1.43491150   -0.43103420    0.06194160   -0.04456330   -0.03466200
H   -1.88833310   -2.76219590   -1.24547000    0.01863980    0.00281240   -0.05173770
H    1.96445520   -3.37340180    0.24359870   -0.01441080    0.00397160    0.01269580
C   -0.17021860   -3.12118920   -0.01063900   -0.05915940   -0.08675320    0.02043240
H   -0.18916120   -3.87261450    0.71638380    0.01355800    0.05349540    0.00650580
   15
   -420.08124034
H   -0.27553250    2.76603190   -0.30880280    0.00787220    0.08270420   -0.01224380
O   -0.99820840    1.39448380    0.04344070    0.05420410   -0.12158800   -0.00621860
O    1.52866340    1.25785640   -0.07053870    0.04305590    0.05342910   -0.00664380
C   -0.63490270    0.22468800   -0.08706100   -0.03267220    0.05995600    0.00809500
C    0.86011430    0.14513880   -0.06270450   -0.11345680    0.00042670    0.03012600
C   -1.57065870   -0.87096070   -0.14517540    0.02772990    0.01617140   -0.05116960
C    1.77610330   -1.17342880   -0.21956350   -0.00159700    0.05901490   -0.05383250
C   -1.27197820   -2.36751810    0.00523180    0.11282090   -0.04342170    0.08016390
C    1.26458870   -2.59808220   -0.06097680   -0.03060380   -0.02786410    0.02264070
H   -2.83004580   -0.50086350    0.33907870   -0.07835190    0.02564180    0.04422300
H    3.12886090   -1.24758920    0.13773070    0.08684830   -0.02288010    0.02924580
H   -2.32934490   -2.91187010   -0.68996600   -0.04484140   -0.02339650   -0.06439120
H    2.22021520   -3.49834420   -0.01202880    0.06024280   -0.05559300    0.00285880
C   -0.22585640   -3.24346640   -0.05870460   -0.14876460   -0.02062100   -0.06967180
H    0.35394550   -3.67348400    0.98605180    0.05747460    0.01796800    0.04675850
   15
   -420.19605181
H   -1.11141520    2.14086920   -0.64398810   -0.01762440    0.06089170   -0.05291730
O   -1.03605190    1.43328670    0.19451680   -0.00873670   -0.00985530    0.04954990
O    1.42621830    1.05233050   -0.01613970   -0.03425300   -0.01143990    0.00368320
C   -0.51070070    0.06265080   -0.04765150    0.14336850   -0.00338950   -0.02073320
C    0.92960500   -0.08815390   -0.05277700    0.05795070   -0.13309060   -0.00037520
C   -1.66426280   -0.82464750    0.05591300   -0.08624430    0.02637440    0.04047090
C    1.68275260   -1.16858080   -0.03014650   -0.09687770    0.14313460    0.05208620
C   -1.34935600   -2.40711350   -0.29062480    0.08729570   -0.05285530    0.05174800
C    1.24718790   -2.47784900   -0.14206850    0.00861260    0.06625130   -0.09190150
H   -2.72690000   -0.44947340    0.22429060   -0.03196210    0.01287740    0.01014850
H    2.80166140   -1.11034050   -0.37493220    0.03888800   -0.01139570   -0.02664930
H   -1.99064330   -2.88072810   -1.24586970   -0.00634470   -0.01428160   -0.06933200
H    2.31011030   -3.52346110    0.30892510    0.06188910   -0.05962610    0.03751880
C   -0.25971870   -3.07565450    0.02511830   -0.13727850    0.05469750   -0.04105410
H   -0.06413560   -4.45950900    0.68382490    0.02132690   -0.06830540    0.05773280
   15
   -420.03855668
H   -0.54062070    2.55623470   -0.33080910    0.02486680    0.08112300   -0.02738260
O   -1.17560830    1.34145230    0.18407140    0.02410160   -0.15277590    0.00857450
O    1.46316020    1.26311580   -0.03148400   -0.01178190   -0.05284570   -0.00011180
C   -0.70468520    0.21962540   -0.08417400    0.03862300    0.10135550   -0.00790300
C    0.81552780    0.28507330   -0.04659570   -0.02581550    0.13693630    0.01071180
C   -1.77596950   -0.91010760   -0.03126170   -0.24748420    0.03417550    0.02725960
C    1.81594150   -1.31933080   -0.08391060   -0.02454400   -0.02357610    0.03193840
C   -1.45224680   -2.44774580    0.01736650    0.03240630   -0.02070540    0.08787150
C    1.27924310   -2.57150920   -0.19907030   -0.00817970    0.05279590   -0.01775550
H   -2.71915660   -0.97192240    0.08589320    0.13892220   -0.03492650   -0.01125240
H    3.25325550   -1.21487820   -0.32855440    0.09226410   -0.00234670   -0.01992700
H   -2.19086180   -2.99383290   -0.90464630   -0.01126360   -0.01779580   -0.07366980
H    2.33156820   -3.71514420   -0.28646270    0.06299910   -0.06370850   -0.00380120
C   -0.30690390   -3.20466130   -0.09465770   -0.12437070    0.01118210   -0.07592300
H    0.05662250   -4.28935860    0.80920190    0.03918950   -0.04887190    0.07137160
   15
   -420.28692696
H   -0.21089490    2.13408320   -0.37079360    0.05786760    0.05199660   -0.04352730
O   -1.07642720    1.49152430    0.11946490   -0.07485130    0.00646440    0.04684510
O    1.70021900    1.06948490   -0.27989760    0.05890130    0.03093020   -0.00913620
C   -0.64500520    0.13777290    0.00582150    0.06168300   -0.00705370   -0.00732390
C    0.93477240    0.05624120   -0.13878690   -0.01159080    0.02387130    0.01207800
C   -1.84050960   -0.97342470    0.00411680   -0.20952130    0.00340400    0.00623200
C    1.63021090   -1.30681410   -0.20296250    0.00464450   -0.03112690    0.01580050
C   -1.38776660   -2.42354820   -0.04975890    0.11155520   -0.02997310    0.07490720
C    1.23659660   -2.58852910   -0.20118950    0.07818620    0.08257950   -0.06425360
H   -2.83188060   -0.75354400    0.01031380    0.05347860   -0.02018020    0.00371880
H    2.65407850   -1.15895900   -0.44481900   -0.02252990   -0.00847610   -0.00345240
H   -2.05964920   -2.99006290   -0.91183240    0.00681210   -0.01291420   -0.06256460
H    1.76741360   -3.67595890    0.07251120   -0.00535540   -0.07121510    0.03073090
C   -0.30608060   -3.18875680   -0.00551840   -0.14190130   -0.08194290    0.00235600
H    0.09429800   -4.00323520    0.48540640    0.03265490    0.06363320   -0.00235920
   15
   -420.00020502
H   -0.17305210    3.48919070   -0.88631920   -0.00228090    0.01206400   -0.00386140
O   -0.91886360    1.24095310    0.20810170    0.05005080   -0.15666840   -0.02634320
O    1.61723790    1.12526050   -0.06702830    0.01226040    0.09325390   -0.01462580
C   -0.65222630    0.19842190   -0.10183910   -0.05701450    0.18349920    0.00364810
C    1.18866510   -0.10572770   -0.01260240   -0.00590710   -0.12188770    0.04560190
C   -1.57705790   -1.00265970   -0.08166200    0.02027720   -0.01919140   -0.02873010
C    1.91671050   -1.29412700   -0.33044710   -0.00150280    0.04098460   -0.06757720
C   -1.21595630   -2.35287520    0.11296660    0.03765130    0.03470280    0.09084710
C    1.31513020   -2.59756450   -0.15538130   -0.06988440    0.03991160    0.10009880
H   -3.00827140   -0.10887270    0.36924240   -0.05732190    0.05159310    0.02188130
H    2.98147570   -1.44420170    0.09690470    0.02447070   -0.02446570    0.02584380
H   -2.38828160   -3.31226160   -0.51068980   -0.05189370   -0.04851300   -0.04640680
H    2.23918270   -3.45760430   -0.81238230    0.04939320   -0.04041640   -0.05454640
C    0.05960530   -3.16244100   -0.26802330    0.05032600   -0.07387540   -0.05733130
H   -0.06855590   -4.17506020   -0.01361600    0.00148620    0.02887180    0.01135770
   15
   -420.11753539
H     0.4920045     0.6850073     0.3688812     0.0542843    -0.3404357     0.0079742
O    -0.7121196     1.3451806     0.5068226     0.0072780     0.0599802     0.0027712
O     1.7982450     0.9764327     0.6602841     0.0312352     0.0449171     0.0098930
C    -0.3368341     0.0344464     0.3547883     0.2643463     0.0228213     0.0079640
C     1.0022685    -0.0787474     0.3692354    -0.3575094     0.2787377     0.0000631
C    -1.3461586    -1.0127323     0.0325889    -0.1698598     0.0464723    -0.0153452
C     1.7677847    -1.3515231    -0.0550956     0.2051296    -0.0281179    -0.0320210
C    -1.0843436    -2.4057792    -0.2558111     0.1671534    -0.0986051    -0.0177166
C     1.2996572    -2.6249745    -0.2749359    -0.0994682     0.0033857     0.0200505
H    -2.2487300    -0.7456981    -0.1611879     0.1161802    -0.0488437     0.0091701
H     2.6898955    -1.3811080    -0.1415820    -0.1786009    -0.0294521     0.0038291
H    -2.2111547    -2.9122166    -0.3753171    -0.0663506    -0.0130368    -0.0010899
H     2.2546585    -3.3408223    -0.4840788     0.0541582    -0.0227172    -0.0085471
C     0.0370115    -2.9943343    -0.4934320     0.0034746     0.1390836     0.0062418
H    -0.2790220    -4.0749699    -0.6415947    -0.0314656    -0.0142132     0.0067614
   15
   -420.00827187
H     0.1582304     0.7738700     0.4754657    -0.0584988    -0.1850768    -0.0562922
O    -0.4823695     1.4638265     0.6067172     0.1301197    -0.0260655     0.0204400
O     1.9110579     1.0081412     0.6394825     0.1061273     0.1081118     0.0285439
C    -0.4946410    -0.0338882     0.1766674    -0.0480436    -0.0950629    -0.0356799
C     0.9640636     0.0040979     0.3832348    -0.2676785     0.1419523     0.0089961
C    -1.3371377    -0.8824293    -0.0922650     0.1675243     0.2029281     0.0976330
C     1.7848581    -1.4871569     0.0647139    -0.0861824    -0.1713631    -0.0059513
C    -1.0292377    -2.4673900    -0.1838889     0.0627068    -0.0368644     0.0650271
C     1.4077255    -2.6818157    -0.2016951     0.0374763     0.0611226     0.0158914
H    -2.4580440    -0.7705762    -0.7932410    -0.0654493    -0.0088464    -0.0589271
H     3.0465382    -1.0620787    -0.1785488     0.0783423     0.0323399    -0.0231557
H    -1.6073367    -3.1716096    -0.9596611     0.0304914    -0.0574829    -0.0452969
H     1.9967535    -3.4513458    -0.5500117    -0.0534630     0.0231652     0.0099157
C     0.0938234    -3.1597711    -0.3790928     0.0004271    -0.0354033    -0.0262873
H    -0.2388397    -3.9380822    -0.9972520    -0.0339071     0.0464883     0.0051486
