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 C    1.89456808   1.39785761   0.00000000
 C    1.35656895   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
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 C    0.78469955   2.18853841   2.02926227
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 C    1.99258506   3.27816764   4.04179738
 H    2.18232314   1.71112584  -1.02259981
 H    1.71606143   4.32253965   4.30073429
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 22
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 C    1.89624519   1.39656697   0.00000000
 C    1.35572505   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
 C    0.07510294   1.37840635   2.80466467
 C    0.77932043   2.25508989   2.00699612
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 C    1.74424289   3.11556517   2.55745876
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 C    2.05306447   3.38208088   3.96327316
 H    2.20553448   1.70284758  -1.01825674
 H    1.86809673   4.45799162   4.16766626
 H    1.50350949   2.78073529   4.69663839
 H    3.14605495   3.27876901   4.11701887
 22
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 C    1.89832549   1.39490751   0.00000000
 C    1.35486993   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
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 C    0.77442354   2.33047922   1.97897647
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 C    2.10519281   3.49924167   3.87656110
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 H    1.99454674   4.59417348   4.02505540
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 22
 Energy -350.06678706 
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 C    1.89981226   1.39371556   0.00000000
 C    1.35404234   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
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 C    0.77023970   2.40875726   1.94717006
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 C    1.80267237   3.24603468   2.41495409
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 H   -0.83887100   1.67980469  -1.04969258
 H    2.42074281   3.71791942   1.63719900
 C    2.15340115   3.61755290   3.78539986
 H    2.25681581   1.68399809  -1.00687868
 H    2.10448763   4.72295927   3.87778636
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 22
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 C    1.90128785   1.39227874   0.00000000
 C    1.35327736   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
 C   -0.04002114   1.86553353   2.83233242
 C    0.76776922   2.48998430   1.91047919
 C   -0.54587465   1.40056393  -0.02518177
 C    1.83044144   3.31365711   2.33844656
 H    0.67306461   3.23732612  -0.09856160
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 H    0.13322896   1.96236291   3.90657522
 H   -1.44925578   1.55121797   0.59236097
 H   -0.85389539   1.66840813  -1.05380041
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 C    2.19933640   3.73715295   3.68843459
 H    2.28324147   1.67384764  -0.99991669
 H    2.20329731   4.84684044   3.72499046
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 22
 Energy -350.0649623984 
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 C    1.90275169   1.39095347   0.00000000
 C    1.35247121   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
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 C    0.76659572   2.57271952   1.86881056
 C   -0.54887160   1.39915626  -0.02920417
 C    1.85716601   3.38152605   2.25855699
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 H   -0.62800730  -0.89235023  -0.05394783
 H   -0.93068515   1.42494876   2.55282964
 H    0.09083319   2.21121975   3.88772308
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 H   -0.87224622   1.65708578  -1.05552739
 H    2.50434896   3.73099966   1.44105164
 C    2.24276981   3.85553624   3.58654574
 H    2.30994098   1.66343299  -0.99225072
 H    2.29382567   4.96443672   3.56867064
 H    1.61222840   3.52830167   4.42070763
 H    3.29736470   3.56130082   3.77049732
 22
 Energy -350.0639410088 
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 C    1.90424051   1.38949246   0.00000000
 C    1.35168552   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
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 C    0.76608139   2.65732248   1.82083928
 C   -0.55212035   1.39766497  -0.03263420
 C    1.88314444   3.44909181   2.17437962
 H    0.67292433   3.21262539  -0.23774226
 H    2.73284527   1.51391070   0.73091337
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 H    0.05431456   2.46457144   3.85005579
 H   -1.44058906   1.54796236   0.60527425
 H   -0.89301432   1.64505899  -1.05554344
 H    2.54262876   3.73722948   1.34308287
 C    2.28359920   3.97327115   3.47863377
 H    2.33767513   1.65235299  -0.98343307
 H    2.37674036   5.07723786   3.40663749
 H    1.64220806   3.70927630   4.32675041
 H    3.32660407   3.64915438   3.67909427
 22
 Energy -350.0628889433 
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 C    1.90574291   1.38802850   0.00000000
 C    1.35085444   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
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 C    0.76621280   2.74323256   1.76594928
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 C    1.90817831   3.51601507   2.08593944
 H    0.67258381   3.19542645  -0.31255684
 H    2.71612915   1.51357711   0.75216950
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 H   -1.02812635   1.83105280   2.54881170
 H    0.02235799   2.72057102   3.79224674
 H   -1.43369056   1.54488623   0.61688841
 H   -0.91735578   1.63275260  -1.05340391
 H    2.57967863   3.74182206   1.24521293
 C    2.32111851   4.09021334   3.36473537
 H    2.36761099   1.64111951  -0.97274944
 H    2.45190213   5.18555460   3.23912173
 H    1.67009612   3.88833712   4.22245893
 H    3.35224087   3.74190354   3.58550162
 22
 Energy -350.0618372059 
 C    0.66309437   2.29772401   0.27761336
 C    1.90702533   1.38667811   0.00000000
 C    1.35007013   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
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 C    0.76660135   2.82945150   1.70408202
 C   -0.55970831   1.39431567  -0.03656878
 C    1.93161888   3.58186095   1.99366976
 H    0.67202968   3.17429613  -0.39023199
 H    2.69806040   1.51444380   0.77321602
 H    1.98206597  -0.89007723  -0.03502293
 H   -0.62749896  -0.89326726  -0.04149041
 H   -1.07366419   2.04503158   2.51795736
 H   -0.00566842   2.97666327   3.71422664
 H   -1.42429904   1.54115329   0.63301323
 H   -0.94551630   1.61983488  -1.04804802
 H    2.61457830   3.74546230   1.14799368
 C    2.35493112   4.20554899   3.24541556
 H    2.39731663   1.62937007  -0.96107049
 H    2.52051795   5.28881666   3.06676798
 H    1.69477936   4.06518969   4.10835659
 H    3.37390844   3.83731600   3.48951876
 22
 Energy -350.060822935 
 C    0.66266644   2.30628735   0.23999580
 C    1.90818275   1.38543455   0.00000000
 C    1.34920272   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
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 C    0.76735124   2.91567022   1.63497585
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 C    1.95370053   3.64646586   1.89750970
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 H   -0.62750312  -0.89351181  -0.03708051
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 H   -0.03013749   3.23068397   3.61552134
 H   -1.41149619   1.53620575   0.65516928
 H   -0.97844817   1.60748160  -1.03844741
 H    2.64832952   3.74737336   1.05170500
 C    2.38532238   4.31929086   3.12048483
 H    2.42768820   1.61776025  -0.94796765
 H    2.58362636   5.38719746   2.88986399
 H    1.71627730   4.23971114   3.98427651
 H    3.39164523   3.93505414   3.39101765
 22
 Energy -350.0598800371 
 C    0.66255932   2.31381948   0.19976930
 C    1.90942478   1.38427280   0.00000000
 C    1.34842803   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
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 C    0.76836782   3.00117875   1.55769735
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 C    1.97410107   3.70991762   1.79670981
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 H    1.98024443  -0.89047347  -0.02633232
 H   -0.62728681  -0.89379362  -0.03302203
 H   -1.15402277   2.47865982   2.39110419
 H   -0.05223771   3.48061967   3.49545033
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 H   -1.01393198   1.59496460  -1.02504072
 H    2.67988923   3.74841511   0.95523579
 C    2.41181191   4.43141722   2.98915535
 H    2.45851903   1.60579814  -0.93338407
 H    2.64356070   5.48014737   2.70713180
 H    1.73265317   4.41380819   3.84847682
 H    3.40409084   4.03343783   3.29031277
 22
 Energy -350.0590306379 
 C    0.66233613   2.32011252   0.15815633
 C    1.91034323   1.38340781   0.00000000
 C    1.34758242   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
 C   -0.21490194   3.16740848   2.42689058
 C    0.76950151   3.08449981   1.47372625
 C   -0.57267012   1.38935412  -0.03018443
 C    1.99283551   3.77066410   1.69344979
 H    0.66790584   3.08206264  -0.63873154
 H    2.63203806   1.52371355   0.83936958
 H    1.97926117  -0.89070109  -0.02159952
 H   -0.62733885  -0.89396045  -0.02870950
 H   -1.18817498   2.69054269   2.29487308
 H   -0.07223450   3.72284197   3.35592104
 H   -1.37364759   1.52666853   0.71503288
 H   -1.05372447   1.58383707  -1.00567842
 H    2.71042860   3.74676393   0.86164202
 C    2.43460954   4.54004626   2.85389816
 H    2.48853314   1.59438134  -0.91790205
 H    2.69775040   5.56687896   2.52283549
 H    1.74543245   4.58247320   3.70430322
 H    3.41234403   4.13231152   3.18776454
 22
 Energy -350.058320374 
 C    0.66217596   2.32497985   0.11474636
 C    1.91089676   1.38270411   0.00000000
 C    1.34679230   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
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 C    0.77008940   3.16520375   1.38262467
 C   -0.57678905   1.38807968  -0.02404638
 C    2.00870770   3.82960083   1.58731603
 H    0.66534491   3.04029526  -0.72451402
 H    2.60649256   1.53006672   0.86068996
 H    1.97846470  -0.89075121  -0.01657131
 H   -0.62718160  -0.89415056  -0.02502949
 H   -1.21959608   2.89557772   2.17589283
 H   -0.09222267   3.95556995   3.19698394
 H   -1.34733346   1.52248212   0.75289198
 H   -1.09613633   1.57343001  -0.98102784
 H    2.73854609   3.74432324   0.77055744
 C    2.45174979   4.64670066   2.71397552
 H    2.51752939   1.58330435  -0.90135030
 H    2.74513900   5.64852463   2.33493763
 H    1.75180662   4.74858607   3.55039992
 H    3.41439267   4.23367050   3.08353634
 22
 Energy -350.0577335176 
 C    0.66207697   2.32810866   0.06864249
 C    1.91129450   1.38243356   0.00000000
 C    1.34599039   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
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 C    0.76943897   3.24324307   1.28266882
 C   -0.58036491   1.38722971  -0.01653877
 C    2.02084670   3.88778668   1.47625769
 H    0.66243441   2.99202298  -0.81215269
 H    2.57900854   1.53702422   0.88189454
 H    1.97761131  -0.89084674  -0.01089694
 H   -0.62747926  -0.89410023  -0.02027692
 H   -1.24788825   3.08910764   2.03503399
 H   -0.11379263   4.17947491   3.01625545
 H   -1.31508113   1.52023628   0.79469208
 H   -1.14062959   1.56415099  -0.95140455
 H    2.76324661   3.74247722   0.67971006
 C    2.46246031   4.75176715   2.56773248
 H    2.54674461   1.57279807  -0.88329838
 H    2.78400287   5.72663171   2.14359163
 H    1.75145990   4.91022945   3.38581862
 H    3.40983439   4.33845297   2.97436376
 22
 Energy -350.0573238092 
 C    0.66187563   2.32922038   0.02209868
 C    1.91127442   1.38251175   0.00000000
 C    1.34526059   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
 C   -0.26729334   3.67237946   2.00578448
 C    0.76811541   3.31591049   1.17770066
 C   -0.58323932   1.38679288  -0.00699492
 C    2.03015571   3.94202586   1.36488884
 H    0.65845893   2.93813906  -0.89789697
 H    2.55052359   1.54640032   0.90149748
 H    1.97692097  -0.89079751  -0.00598734
 H   -0.62750358  -0.89411186  -0.01730186
 H   -1.27349284   3.26834897   1.87522555
 H   -0.13682409   4.38888878   2.81896539
 H   -1.27777997   1.51978944   0.83906417
 H   -1.18523704   1.55639201  -0.91645095
 H    2.78554354   3.73944744   0.59360532
 C    2.46768217   4.85172776   2.41999836
 H    2.57356412   1.56300802  -0.86519119
 H    2.81351166   5.79865062   1.95338989
 H    1.74543387   5.06237633   3.21618213
 H    3.40075458   4.44410331   2.86374597
 22
 Energy -350.0570970203 
 C    0.66196305   2.32837168  -0.02669457
 C    1.91099543   1.38294080   0.00000000
 C    1.34463759   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
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 C    0.76519674   3.38374446   1.06554466
 C   -0.58479349   1.38707299   0.00231716
 C    2.03554325   3.99358784   1.25150952
 H    0.65471388   2.87824300  -0.98348326
 H    2.51996875   1.55693764   0.92067424
 H    1.97639084  -0.89071030  -0.00020394
 H   -0.62799870  -0.89380884  -0.01328184
 H   -1.29874724   3.43383776   1.69161700
 H   -0.16369622   4.58306934   2.60410010
 H   -1.23585637   1.52307952   0.88219377
 H   -1.22796385   1.54987276  -0.87939217
 H    2.80559367   3.73435940   0.51249775
 C    2.46505864   4.94992279   2.26768034
 H    2.60022897   1.55417160  -0.84559012
 H    2.84027465   5.86421285   1.76029651
 H    1.72821113   5.21528800   3.03355640
 H    3.37942633   4.54996670   2.75516886
 22
 Energy -350.0570267985 
 C    0.66197980   2.32516851  -0.07766145
 C    1.91026350   1.38383748   0.00000000
 C    1.34411655   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
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 C    0.76040992   3.44712089   0.94514027
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 H    2.62597390   1.54601044  -0.82489594
 H    2.86121245   5.92620646   1.56008029
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 22
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 C    1.90901198   1.38512948   0.00000000
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 C    0.00000000   0.00000000   0.00000000
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 H   -1.30564735   1.53973557  -0.79977900
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 H    2.64957757   1.53910372  -0.80413065
 H    2.87734033   5.97977110   1.36869356
 H    1.66864547   5.50926973   2.63364210
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 22
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 C    1.90729620   1.38679764   0.00000000
 C    1.34363846   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
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 C    0.74496717   3.55045012   0.69818672
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 C    2.02470268   4.13061581   0.90888205
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 H   -0.26692531   5.06970009   1.85949136
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 H   -1.33604743   1.53572278  -0.76553713
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 C    2.41013059   5.22058068   1.79978784
 H    2.67263709   1.53363617  -0.78174629
 H    2.88353694   6.02422900   1.19620065
 H    1.62055015   5.63504163   2.43609200
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 22
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 C    1.90511699   1.38864174   0.00000000
 C    1.34371328   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
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 C   -0.57932986   1.39286128   0.02973366
 C    2.01289745   4.16357989   0.81211395
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 H   -0.30698384   5.19171561   1.59298036
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 H   -1.36138500   1.53194095  -0.73504124
 H    2.85107030   3.71178541   0.26533856
 C    2.37576676   5.29283964   1.66264930
 H    2.69390092   1.52951831  -0.75913130
 H    2.88513558   6.05896796   1.03982502
 H    1.56604239   5.74825264   2.24327888
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 22
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 C    1.90263100   1.39050538   0.00000000
 C    1.34398189   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
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 C    0.72558187   3.61995682   0.46534617
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 C    1.99855644   4.18908163   0.73313881
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 H   -0.34302534   5.29215800   1.33145493
 H   -1.01332677   1.58798594   1.02811586
 H   -1.38137484   1.52906753  -0.70886193
 H    2.85527195   3.70111220   0.25023335
 C    2.33591496   5.35367495   1.54600769
 H    2.71233321   1.52674539  -0.73755077
 H    2.88690168   6.08252287   0.91414441
 H    1.50518576   5.84604463   2.06347727
 H    3.10372346   5.04687082   2.28784803
 22
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 C    1.90016662   1.39227652   0.00000000
 C    1.34444944   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
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 C    0.71582619   3.64234872   0.36606020
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 C    1.98002601   4.20743798   0.67746369
 H    0.64425185   2.46392722  -1.40170706
 H    2.31694705   1.63808925   1.00761539
 H    1.97875107  -0.88802167   0.03024101
 H   -0.63285692  -0.89011908   0.00639945
 H   -1.40256205   4.02942846   0.30860969
 H   -0.37514460   5.37115086   1.08189522
 H   -0.98048507   1.60397955   1.03730244
 H   -1.39600916   1.52640914  -0.68964407
 H    2.85459300   3.68990397   0.26231891
 C    2.28834389   5.40194208   1.45831954
 H    2.72870682   1.52545738  -0.71686970
 H    2.88297719   6.09730561   0.82845619
 H    1.43693435   5.92456258   1.90816031
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 22
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 C    1.34498337   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
 C   -0.42371139   4.42861063   0.42063232
 C    0.70657490   3.65784416   0.28205496
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 C    1.95783136   4.21893605   0.64587557
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 H    2.28770381   1.64822784   1.01631620
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 H   -0.63365773  -0.88944777   0.01014607
 H   -1.39583645   4.07372166   0.06615445
 H   -0.39937333   5.43132214   0.85274542
 H   -0.95412000   1.61849902   1.04110138
 H   -1.40695690   1.52405474  -0.67628279
 H    2.84793714   3.67889379   0.29843700
 C    2.23543965   5.43592852   1.40384581
 H    2.74270046   1.52557054  -0.69751412
 H    2.87404607   6.10419512   0.78818711
 H    1.36552904   5.98123311   1.78653100
 H    2.90461934   5.17067789   2.24990186
 22
 Energy -350.0583550213 
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 C    1.89548175   1.39521115   0.00000000
 C    1.34561242   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
 C   -0.42671559   4.45938123   0.24489017
 C    0.69784382   3.66838987   0.20997946
 C   -0.56473609   1.39923448   0.02693959
 C    1.93168968   4.22679533   0.63045280
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 H    2.26169630   1.65668313   1.02351440
 H    1.98087077  -0.88696077   0.03849105
 H   -0.63439230  -0.88884985   0.01370254
 H   -1.37709264   4.10662302  -0.16640463
 H   -0.41578142   5.47618600   0.64330654
 H   -0.92910045   1.63184024   1.04474090
 H   -1.41590459   1.52357101  -0.66298040
 H    2.83470011   3.67119892   0.34695007
 C    2.17678463   5.46013682   1.37375124
 H    2.75496643   1.52604991  -0.67996456
 H    2.85628573   6.10856026   0.78137901
 H    1.29078088   6.02058813   1.69240861
 H    2.79208481   5.20966647   2.26399901
 22
 Energy -350.0585828591 
 C    0.67100426   2.25839959  -0.40071558
 C    1.89312096   1.39679253   0.00000000
 C    1.34621650   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
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 C    0.68814356   3.67620108   0.14204337
 C   -0.56105740   1.40009538   0.02548426
 C    1.89973886   4.23515630   0.62008991
 H    0.65101971   2.32341495  -1.50432386
 H    2.23656599   1.66443778   1.02983775
 H    1.98197398  -0.88637964   0.04168260
 H   -0.63501423  -0.88830862   0.01735197
 H   -1.34883607   4.12729103  -0.39236036
 H   -0.42734840   5.51050649   0.44072156
 H   -0.90514415   1.64372308   1.04811264
 H   -1.42460822   1.52363895  -0.64918298
 H    2.81335247   3.66834591   0.40039407
 C    2.10974590   5.48267866   1.35100321
 H    2.76545844   1.52762168  -0.66330395
 H    2.82782446   6.11530704   0.78819997
 H    1.20983407   6.05375240   1.60575915
 H    2.66807746   5.24627160   2.28179478
 22
 Energy -350.0588108333 
 C    0.67286085   2.25055465  -0.42484479
 C    1.89123192   1.39812909   0.00000000
 C    1.34683812   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
 C   -0.41887817   4.49558260  -0.08531188
 C    0.67762841   3.68142312   0.08175375
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 C    1.86141343   4.24332136   0.62000111
 H    0.65386314   2.28517899  -1.52980115
 H    2.21354648   1.67068890   1.03532704
 H    1.98309930  -0.88587577   0.04494931
 H   -0.63559990  -0.88776904   0.02115437
 H   -1.31009076   4.13794325  -0.60968766
 H   -0.43442088   5.53497025   0.24984964
 H   -0.88465131   1.65513982   1.04878397
 H   -1.43106490   1.52460902  -0.63912112
 H    2.78345029   3.66883336   0.46496715
 C    2.03298949   5.50341235   1.33987673
 H    2.77508990   1.52959853  -0.64770666
 H    2.78779937   6.12334877   0.81246721
 H    1.12141786   6.08163788   1.52873136
 H    2.53021657   5.28096358   2.30801088
 22
 Energy -350.0590180986 
 C    0.67478742   2.24309554  -0.44673637
 C    1.88967253   1.39938881   0.00000000
 C    1.34737921   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
 C   -0.40837507   4.50288703  -0.23546100
 C    0.66630929   3.68448302   0.02757547
 C   -0.55419756   1.40182520   0.01894604
 C    1.81640825   4.25137746   0.62800067
 H    0.65769906   2.25051698  -1.55217330
 H    2.19347704   1.67555362   1.03980164
 H    1.98398040  -0.88542627   0.04779048
 H   -0.63605881  -0.88730167   0.02544499
 H   -1.26207608   4.13968549  -0.81563160
 H   -0.43773750   5.55047549   0.07218898
 H   -0.86662145   1.66607919   1.04748517
 H   -1.43609028   1.52594584  -0.63173388
 H    2.74451449   3.67286381   0.53803815
 C    1.94591107   5.52163732   1.33927661
 H    2.78335562   1.53183621  -0.63375615
 H    2.73507193   6.13294356   0.85423971
 H    1.02524452   6.10346579   1.46166423
 H    2.37768719   5.31098277   2.34098618
 22
 Energy -350.0591971976 
 C    0.67651072   2.23613415  -0.46643138
 C    1.88834144   1.40064183   0.00000000
 C    1.34786652   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
 C   -0.39292390   4.50585329  -0.37431685
 C    0.65458995   3.68596279  -0.02046921
 C   -0.55126948   1.40237962   0.01484590
 C    1.76633161   4.25873218   0.64168208
 H    0.66167851   2.22004431  -1.57170701
 H    2.17494129   1.67979352   1.04354475
 H    1.98478653  -0.88507599   0.05045892
 H   -0.63640085  -0.88690492   0.02942471
 H   -1.20506759   4.13622078  -1.00771831
 H   -0.43488265   5.56020646  -0.09224987
 H   -0.85129523   1.67632964   1.04505460
 H   -1.44012107   1.52766378  -0.62630303
 H    2.69794558   3.67937628   0.61409826
 C    1.85118217   5.53555493   1.34827424
 H    2.79068261   1.53362053  -0.62112811
 H    2.67312132   6.14169944   0.91448545
 H    0.92493063   6.11885520   1.40386752
 H    2.21160278   5.33131119   2.37928405
 22
 Energy -350.0593422569 
 C    0.67839792   2.22989930  -0.48398051
 C    1.88740433   1.40174882   0.00000000
 C    1.34831238   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
 C   -0.37394383   4.50518065  -0.50078248
 C    0.64223616   3.68621434  -0.06244307
 C   -0.54851460   1.40284434   0.00977879
 C    1.70989042   4.26487654   0.66269531
 H    0.66660304   2.19359079  -1.58866153
 H    2.15937867   1.68299271   1.04649878
 H    1.98553487  -0.88469501   0.05265489
 H   -0.63680447  -0.88644059   0.03352374
 H   -1.14087044   4.12888291  -1.18471563
 H   -0.42816563   5.56474302  -0.24112208
 H   -0.83878642   1.68588968   1.04086038
 H   -1.44265233   1.52909749  -0.62401077
 H    2.64226984   3.68704201   0.69693964
 C    1.74652787   5.54571347   1.36642334
 H    2.79677072   1.53560619  -0.61036386
 H    2.59528827   6.15139321   0.98772132
 H    0.81724405   6.12685855   1.35742449
 H    2.03532555   5.34593099   2.42077185
 22
 Energy -350.0594389378 
 C    0.68015082   2.22494431  -0.49776016
 C    1.88699476   1.40265210   0.00000000
 C    1.34864019   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
 C   -0.35194984   4.50306378  -0.60894275
 C    0.62977581   3.68568324  -0.09487830
 C   -0.54623080   1.40310784   0.00513033
 C    1.64853448   4.26855479   0.69335346
 H    0.67116300   2.17299937  -1.60166024
 H    2.14810595   1.68416904   1.04868799
 H    1.98617251  -0.88442157   0.05412220
 H   -0.63703715  -0.88610405   0.03714186
 H   -1.07208850   4.12082697  -1.33893614
 H   -0.41830777   5.56613698  -0.36702092
 H   -0.82920127   1.69396869   1.03663260
 H   -1.44427381   1.53071538  -0.62302951
 H    2.57848806   3.69332658   0.78762443
 C    1.63452842   5.54939965   1.39793869
 H    2.80155823   1.53725919  -0.60219105
 H    2.50928920   6.15558988   1.08593721
 H    0.70762758   6.12961081   1.32208390
 H    1.84244844   5.34671127   2.47089140
 22
 Energy -350.0594777743 
 C    0.68178632   2.22040459  -0.51012529
 C    1.88688093   1.40348058   0.00000000
 C    1.34887841   0.00000000   0.00000000
 C    0.00000000   0.00000000   0.00000000
 C   -0.32533969   4.50066250  -0.71004294
 C    0.61698672   3.68473057  -0.12428061
 C   -0.54434570   1.40320146  -0.00016433
 C    1.58191800   4.27163603   0.72533324
 H    0.67626565   2.15474718  -1.61313701
 H    2.13948201   1.68489469   1.05015326
 H    1.98658029  -0.88419895   0.05564065
 H   -0.63722173  -0.88578207   0.04096821
 H   -0.99488700   4.11423945  -1.48467689
 H   -0.40260731   5.56647427  -0.48383510
 H   -0.82211986   1.70155031   1.03118652
 H   -1.44499188   1.53181924  -0.62459950
 H    2.50555714   3.69914679   0.88003122
 C    1.51696201   5.55224985   1.42745534
 H    2.80535189   1.53849425  -0.59585885
 H    2.41115318   6.15985713   1.18100443
 H    0.59648801   6.13069449   1.28680584
 H    1.64619827   5.34745809   2.51252979
