Cu  H  C  N  O                          
   1.00000000000000     
    10.6998999999999995    0.0000000000000000    0.0000000000000000
    -0.0091679500000000   16.5704974639999989    0.0000000000000000
    -0.5909946020000000   -8.2845678300000003   16.0366155180000014
   Cu   H    C    N    O 
     8    68    89    40     1
Direct
  0.2487651681804408  0.0378739738662901  0.9975982763971132
  0.7474262103063083  0.9604119208304098  0.0031484199358260
  0.4606512259790208  0.9956636728287620  0.1060142645492590
  0.5435320021035039  0.9987678650991825  0.8935638560340777
  0.9596088468491075  0.1122275021186070  0.1060074052465652
  0.0471412276701599  0.8648491849522273  0.8874827724107561
  0.7493364222825463  0.1698265593203132  0.9969597376737482
  0.2372158390657333  0.8209549749306362  0.9876897018714175
  0.9627227399386200  0.1348183237520715  0.2999198923614159
  0.0448541559863926  0.8681221130726868  0.7009134806146307
  0.4600637134799896  0.1696959833275500  0.3004087735714975
  0.5465563701288261  0.8229627216046609  0.7009939215280241
  0.3974270458578175  0.0089738938192028  0.2930100802582558
  0.6062917556463105  0.9882849009518253  0.7125456108350434
  0.8966671406540883  0.2871287343789248  0.2947342595259457
  0.0921342951721797  0.7292500581349941  0.6922601584816519
  0.3580712454500912  0.2305248076578721  0.6283358223990589
  0.6436783937317045  0.7701559349238636  0.3753734691240354
  0.1432542938670238  0.5958722446033491  0.3643412161027300
  0.8574584463955688  0.4007042686033060  0.6299820550452395
  0.4329807345864651  0.1604461317030186  0.6668751263629318
  0.5665003664611490  0.8403500232525261  0.3378761555964331
  0.0699701451866659  0.4868351736299985  0.3276345931036744
  0.9350214889922697  0.5080589481408921  0.6660950365749088
  0.4567246643843035  0.1420045568085726  0.5625370259625129
  0.5437861815353031  0.8572609787245824  0.4418457243703813
  0.0448783825581884  0.5743681516748680  0.4310672655486911
  0.9540393491454537  0.4209294564826749  0.5617082974826744
  0.3944594448076373  0.0001230444903157  0.6062077119132923
  0.5996702201001511  0.0009112371911044  0.4009225009343993
  0.1098061176903045  0.3907790018783643  0.3924263191903776
  0.8919315231034872  0.6093646425834720  0.6083160121317590
  0.7355541120049196  0.0555998979003363  0.4620781730211476
  0.2589202804932285  0.9465487652192621  0.5439190077363563
  0.2446510333471679  0.4030367582303498  0.4563943053810107
  0.7580795082291090  0.5989663958203195  0.5440212737037697
  0.6110451289170129  0.0243778117165334  0.5079712730442694
  0.3866851693659683  0.9755094887501627  0.4987511230797068
  0.1152832942409390  0.4764954374068111  0.4988222103985223
  0.8878680823051752  0.5261906346972864  0.5009785257358317
  0.1570603341363537  0.8157111861068884  0.1775337194312883
  0.8388132004939024  0.1861076042606484  0.8258301126653009
  0.6592754296628414  0.3586460751464813  0.1663181359561960
  0.3373144071984768  0.6410721288390704  0.8277962382461368
  0.2762563332775230  0.0744579149176161  0.8417885921657131
  0.7245428727146077  0.9390475109951950  0.1685923065852251
  0.2290538002221965  0.2243450740002615  0.1593347422423363
  0.7726270002437587  0.7713513225797399  0.8405320926270505
  0.1285224761390253  0.7829906136850013  0.4730486923182227
  0.8713575845749730  0.2166884333092298  0.5281307636573089
  0.3715310089621369  0.3121936566442471  0.5298736501141548
  0.6338793143038615  0.6828933938779045  0.4678630594827453
  0.1486044573767202  0.8729372379963038  0.4460274047208728
  0.8513473692538795  0.1271272304861952  0.5556839589998077
  0.3498778890632366  0.4290396774251306  0.5572216899488538
  0.6534954940283413  0.5655247514617443  0.4389747944071161
  0.1456337453559016  0.7596991439747782  0.3664189612455573
  0.8524317689995016  0.2405550015012921  0.6347592475840287
  0.3527562242590321  0.3950196480818136  0.6365283241056972
  0.6512897527098858  0.6011733145378457  0.3607032913838566
  0.0437885184859752  0.3326994990494754  0.6849175867358994
  0.9538781211084739  0.6686826007715254  0.3178033416265151
  0.4591493949418322  0.6449087770514197  0.3126426517099219
  0.5450610646484009  0.3527307445790910  0.6852094188868136
  0.1906837543848781  0.2929037364824083  0.6394335505824245
  0.8078280680132579  0.7084305454733695  0.3646305539617529
  0.3129368792233933  0.6501517782849149  0.3588911883271138
  0.6916244573400334  0.3485255484903718  0.6398320137115618
  0.0722312017850228  0.3184167145527681  0.5824882432028886
  0.9277848588175033  0.6825768337556468  0.4203885784025303
  0.5739682105933852  0.2654328917353439  0.5824570645542835
  0.4319164360813446  0.7321542153511444  0.4157573019392018
  0.0226747246233430  0.6533385167607548  0.8699360525505639
  0.8974534363857813  0.5775718630619195  0.8095960139112464
  0.9024669531590845  0.6236869719095210  0.9205976150908697
  0.0138444331999992  0.5407328559426858  0.8605774693862074
  0.2509497451337808  0.0439177626207581  0.2260165180072846
  0.7555968357171494  0.9526798588469205  0.7768877408089025
  0.7497540195526753  0.1856524521577683  0.2273472227296196
  0.2421366954100250  0.8269967434446883  0.7615578228643045
  0.1281793017914836  0.0780696131727296  0.2266856118062819
  0.8792953852976950  0.9196044230357572  0.7758307846212986
  0.6262914246802751  0.1528514842710536  0.2278604232856054
  0.3712911724974148  0.8512029741533809  0.7668507102509707
  0.0557886573477475  0.1070959839563770  0.2966037312961163
  0.9507353386208237  0.8940416280298606  0.7059058058287704
  0.5533409620962644  0.1940221353465290  0.2973532660085070
  0.4487634113743582  0.8045157662686933  0.7005611618854317
  0.1097720577609778  0.1028151681065523  0.3668348844179121
  0.8943639056729609  0.8986886357682096  0.6365121112084253
  0.6076897631954807  0.2680453884706608  0.3677060158598451
  0.3935180293673355  0.7324422131485662  0.6287342855281892
  0.2329672272990422  0.0656854354414449  0.3651705681555413
  0.7702593992091664  0.9343727734164347  0.6388929128156704
  0.7313496248031726  0.3030399223463860  0.3662293950620636
  0.2650008299644568  0.7035470086601947  0.6268454829958827
  0.3043423053616578  0.0358944358109667  0.2935613187655406
  0.7002624587749082  0.9622633827059914  0.7107447320917899
  0.8031714779343062  0.2610995231572701  0.2948770577365423
  0.1882973750478598  0.7518291845821068  0.6942032118625221
  0.2176135361454783  0.0951331123899593  0.5026964692738005
  0.7826611596330224  0.9059304393398548  0.5016638324321008
  0.2839941534387904  0.5907397291579457  0.4920233942843879
  0.7164220583761107  0.4103668858017215  0.5038999651098308
  0.0990165621231895  0.1379727524939014  0.5058292998853204
  0.9018317042426673  0.8633895937793525  0.4975401443680099
  0.5977778272596836  0.3706014459819968  0.5069679441322634
  0.4058293489562530  0.6272281600087624  0.4904326596327166
  0.0351497701425103  0.1918410017540992  0.5879245523731242
  0.9639245730826858  0.8092311106036902  0.4149404213458325
  0.4692882410751338  0.5992256269372405  0.4083854222637626
  0.5348072872467284  0.3977641365286644  0.5891218124794335
  0.0676067652025125  0.1555705625945407  0.6492772735190329
  0.9303564936354860  0.8463501331840177  0.3544569609229455
  0.4351948567787645  0.5021309025179477  0.3464802154646236
  0.5670479572349976  0.4953529978352975  0.6506067310954151
  0.1870647103086753  0.1148651070871765  0.6486025675632803
  0.8116845078003863  0.8887349562523994  0.3568140667572521
  0.3160587256991931  0.4620658801247401  0.3479736727326568
  0.6859271535266060  0.5359813221084266  0.6495797064104707
  0.2783863203918671  0.0914789448819988  0.5789513373054831
  0.7204844809569479  0.9102137635400851  0.4261242025993397
  0.2241079634848901  0.5094324616960932  0.4168267295862478
  0.7774976444651287  0.4899099926118708  0.5800993351470112
  0.3884909099788985  0.1612999806574607  0.6116047359862904
  0.6118301301367239  0.8392044124735989  0.3927911093790186
  0.1135270385955778  0.5441740994725066  0.3823537449730381
  0.8879112351064293  0.4522164009446783  0.6119607961533191
  0.3330453044914847  0.9969063910405538  0.5551520512546588
  0.6631278361233583  0.0042112367553244  0.4511089008700111
  0.1701034898184872  0.4403543662178109  0.4431228018171183
  0.8322884897892351  0.5608310976488298  0.5565058281769524
  0.1427545986157597  0.1141132648236081  0.7724160990264153
  0.8560786734863512  0.8933750777627267  0.2347496574806911
  0.3601898441462410  0.3363579509911645  0.2251316679599640
  0.6404430332262905  0.6609338157527560  0.7726923418530234
  0.0184841456922484  0.1474289416226071  0.7689696112099540
  0.9789482015778503  0.8569363981809062  0.2359437997221434
  0.4826071474870304  0.3746008510036773  0.2262353921204721
  0.5171954643561918  0.6230497075981063  0.7700876775488226
  0.0651872740404329  0.8423159426080531  0.1742063340524851
  0.9318342368819614  0.1617712168520455  0.8304645069934864
  0.5676685938398904  0.3284148165173661  0.1633624000687348
  0.4306160934355461  0.6694091660740611  0.8319230441750847
  0.0251449121118483  0.8619383747669005  0.1104846591858006
  0.9724219008409136  0.1446909895166328  0.8957282778200266
  0.5275685831367056  0.2450919423286706  0.0994156153591490
  0.4712316255227620  0.7518311173522960  0.8969261614993087
  0.0958790993937768  0.1138631498657290  0.8999623383001634
  0.9027999749827913  0.8956530756227821  0.1083227316917430
  0.4063640925998513  0.2080967366157438  0.0980674505935966
  0.5933314586881480  0.7883939504279169  0.9000409084946455
  0.1822784440123471  0.0983498259180138  0.8393130074667141
  0.8172437901153842  0.9124048574255710  0.1695987533620951
  0.3214120754164256  0.2522282190264349  0.1599078058036412
  0.6792962714028192  0.7443728038112454  0.8388702706565709
  0.1059571058761293  0.8056873335583958  0.4260680810318576
  0.8933273271527753  0.1945630521077533  0.5755709482240619
  0.3930258018499160  0.3819274142983033  0.5771884965135285
  0.6112083962438035  0.6136531811087380  0.4199408530086046
  0.0896185434215440  0.2904157128421900  0.6262780315913261
  0.9090775076726132  0.7108052497238688  0.3768931164568912
  0.4141882415222966  0.6605923576932611  0.3714187693353637
  0.5906439944017663  0.3371976889071746  0.6266559168123820
  0.9593424164376145  0.5988274607552739  0.8651650957414958
  0.2971476038215926  0.0235876601386806  0.1495502587380813
  0.7087972252870927  0.9698317454662586  0.8523226103823589
  0.7966753210424500  0.1285872147368252  0.1513336774381102
  0.1918039084112095  0.8883107553071312  0.8343200586796016
  0.2086964757739125  0.0425464409236369  0.1058577477332747
  0.7973367931933808  0.9497307975097584  0.8949774959616903
  0.7077408985894422  0.0660414634744555  0.1081082225893653
  0.2838404451193526  0.9423921747740138  0.8834675860437997
  0.1058354474786327  0.0761527071354848  0.1503914586773618
  0.9010919659056640  0.9181053569894004  0.8510006356816362
  0.6042151860623264  0.0779357356513160  0.1520277141559916
  0.3934173548811017  0.9237648290466396  0.8446732407343589
  0.2813905211544849  0.0608332581601800  0.4340017999551051
  0.7198931591557738  0.9395954273921205  0.5707338926799608
  0.2164464859985955  0.6294264216604688  0.5586602727953505
  0.7800549024285530  0.3763339733886468  0.4351803528722584
  0.0464691292661357  0.1385439656785721  0.4391662313095281
  0.9566720570015264  0.8635898430130027  0.5638596242362084
  0.5445505175669894  0.3041376715451349  0.4400679178271005
  0.4600271974180004  0.6924745473321963  0.5578670879749126
  0.0112776358874882  0.8333763364970892  0.2970233959063009
  0.9858385630541022  0.1685651634451659  0.7063154932714042
  0.5155756295481453  0.4585882916179003  0.2883501194382134
  0.4852532164266279  0.5389607978508906  0.7077048138531055
  0.2228900483937366  0.0966941035235962  0.7096422550772274
  0.7764755693464096  0.9099717306290458  0.2975634101000821
  0.2806829887509181  0.3819661833295456  0.2881381046277198
  0.7206285932600096  0.6159197456517873  0.7099509236983863
  0.0823077925230251  0.8558909137817849  0.0414189639487503
  0.9140738846487082  0.1512156334252452  0.9648020795057164
  0.5848663085086230  0.1828054699855954  0.0297550315067667
  0.4129636835126718  0.8131836617724986  0.9667345321460630
  0.9971846992626396  0.1253273646904560  0.0075932480805179
  0.9995699509357934  0.8833574302728238  0.0002706306698670
  0.4944613495886898  0.8829531039456384  0.0086838772086111
  0.5033824827766225  0.1125305319611911  0.9892654707717625
  0.1057368396252585  0.1028299065243274  0.9706025552916202
  0.8926891406095123  0.9074624742910942  0.0380628942132404
  0.3967308535670497  0.1257199060883707  0.0283046007738079
  0.6024638649536413  0.8701776631820053  0.9707116805617204
  0.1489923816472896  0.7706535637634389  0.8838460948378284
 
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