C18 H12 Cu3 O15 3(H2 O), 3(H2 O)        
   1.00000000000000     
    26.1183950936029063    0.0026797984086991    0.0010188843502065
     0.0025260188286021   26.1144945794351067   -0.0030677103694991
     0.0010696546935084   -0.0030682728157593   26.1286635647435723
   Cu   O    H    C 
    48   192    96   288
Direct
  0.2170914894074996  0.5000104518247245  0.2829085357661626
  0.7828472868032174  0.4999809937044211  0.7171543026554238
  0.7829721720373892  0.4999883631515126  0.2829597064046268
  0.2169908975904896  0.4999715113784683  0.7169889791511090
  0.2828815945741616  0.2171132201436466  0.4999770833151748
  0.7171581631319937  0.7828431624001840  0.5000161991541592
  0.2828296573753915  0.7828315489072118  0.5000029955659175
  0.7171387471996482  0.2171364394003255  0.4999974282622407
  0.5000122190030326  0.2828316839513086  0.2171828638647090
  0.5000207147651020  0.7170661239961164  0.7829185858372716
  0.4999929786344459  0.2828213776191419  0.7828081332809702
  0.5000268643084506  0.7171124695151369  0.2171157484477424
  0.5000169090980199  0.2171356268658136  0.7171327640236884
  0.5000018816869068  0.7829052959778718  0.2829006054625288
  0.4999980892637927  0.7827414660280234  0.7172518121970416
  0.5000120987054789  0.2171717508228486  0.2828335290736314
  0.2170900912311190  0.2829132592106824  0.5000127355533756
  0.7828349399419000  0.7171677826142134  0.4999892192719332
  0.7829068077460217  0.2829075401150303  0.5000098286357064
  0.2171729536037299  0.7171721371955679  0.4999879294772935
  0.2827988652025678  0.4999812310224865  0.7827971880265645
  0.7172347524441275  0.4999826845800006  0.2172325627047227
  0.2828699339941082  0.4999747139050706  0.2171294310993291
  0.7171825523786906  0.5000118575448508  0.7828171408400544
  0.2170140954058189  0.0000379018435268  0.7829797739671670
  0.7827484828094399  0.0000004069116289  0.2172535053733516
  0.7828213895377514  0.0000203646200053  0.7828149457002654
  0.2172449960726057  0.0000134877281310  0.2172376579422517
  0.2828440258449553  0.7171475785034337  0.9999864906678863
  0.7171328487184301  0.2828693666875784  0.0000125347883380
  0.2828786789243217  0.2828894774827029  0.0000016206802987
  0.7171218589678984  0.7171210413480432  0.9999840266171865
  0.2171787764065776  0.7828158307699713  0.0000135916652698
  0.7827983766158229  0.2171984123125657  0.9999790529084507
  0.7828893943953846  0.7828895842385883  0.0000011137791291
  0.2171176692424752  0.2171148638744202  0.9999835721126568
  0.2829214246899061  0.0000149417643465  0.2829142164655786
  0.7171634597719617  0.0000124791958512  0.7171566566126394
  0.2827678769309963  0.9999861037109319  0.7172292678781013
  0.7169279609991293  0.0000474211443688  0.2830619116121110
  0.9999754074550302  0.2829205549488682  0.7170820403152093
  0.9999909891805669  0.7170746435406501  0.2829191665747899
  0.9999838079736114  0.2828054874718399  0.2828047657220082
 -0.0000013315372446  0.7171400852198521  0.7171369904559357
  0.0000068680203948  0.2171087292907663  0.2171200387426025
  0.9999779707268003  0.7829450043341588  0.7829324708275781
  0.9999849213356831  0.7827769014183188  0.2172248190793900
  0.9999847926587005  0.2171385789705805  0.7828514920209577
  0.2560087966383606  0.5523355822745212  0.3171818344263173
  0.7439796839809476  0.4476797165925704  0.6828034458984461
  0.7440568523988609  0.4476759066710980  0.3172488932600125
  0.2559207538335984  0.5522743581326488  0.6826971918931474
  0.7440276571772045  0.5522307341953687  0.6827519513245296
  0.2560042050758671  0.4477245320155843  0.3172026122498128
  0.2559740022160469  0.4476563734750527  0.6827167228075938
  0.7440376465821622  0.5522883288426398  0.3172616244882727
  0.3172327541761116  0.2560015114899142  0.5522231999752921
  0.6827864931316814  0.7439734952976143  0.4477603390364209
  0.3172251741782865  0.7439512230583843  0.4477300120338751
  0.6827973306472461  0.2560549590191230  0.5522635314420472
  0.6828139616309079  0.7439672320948205  0.5522947160602893
  0.3172000285139582  0.2559983999539654  0.4476665009349019
  0.6828087175576791  0.2560316387559990  0.4477217991949562
  0.3172212049465035  0.7439538556782094  0.5522702666535328
  0.5523047385276046  0.3171479641151132  0.2561137281599004
  0.4477252501172538  0.6827194193727381  0.7439706395553567
  0.4477232343915892  0.3171399355165886  0.7438899173852282
  0.5523309832761129  0.6828374793832814  0.2560569192285751
  0.5523251987026764  0.6827117429078946  0.7439744094169177
  0.4477575990998799  0.3171622338752184  0.2561220749971344
  0.4477483942544304  0.6828523580473717  0.2560546235389018
  0.5522519977190687  0.3171535591827485  0.7438930835498153
  0.5523161960317913  0.2559915191759382  0.6827984968562454
  0.4477094551338757  0.7440129657786206  0.3172052750022141
  0.4477346536320404  0.7438682366935010  0.6828839933583390
  0.5523229233384653  0.2560062959095215  0.3171986888429998
  0.5523054550860141  0.7440117446500394  0.3171907148146081
  0.4477720233821197  0.2560001589819336  0.6827719995177788
  0.4477582216831380  0.2560291882605905  0.3172202835728688
  0.5522575005173304  0.7438689037496266  0.6828903269397598
  0.2560602568728119  0.3171901213426516  0.4477351461623090
  0.7439419547377063  0.6828110947771493  0.5522231302545146
  0.7439481062557118  0.3172273678167378  0.5522836848375323
  0.2560957756703701  0.6828108430085675  0.4477062392053482
  0.7439421112140793  0.6828448739681815  0.4477064032599610
  0.2560642023672778  0.3171655085455257  0.5522938276572740
  0.2560954422945672  0.6828136089419912  0.5522335730396444
  0.7439637729541573  0.3171994832648470  0.4477364701669601
  0.3170599279022450  0.5522381513802340  0.7438473586038490
  0.6829431621595711  0.4476841368301309  0.2561250125952252
  0.3171364316532544  0.4476553321217540  0.2560479689286260
  0.6828955639202441  0.5522923713314960  0.7438815759957387
  0.6829130577313893  0.5522385520700425  0.2561483210667531
  0.3171103179943436  0.4476882370184327  0.7438705155000027
  0.6828350157377429  0.4477474135960295  0.7439130653009163
  0.3171641504181449  0.5522482549938472  0.2560516396389368
  0.2559757741065601  0.0523471337481350  0.8172218531230805
  0.7439045881486027  0.9477419738273034  0.1828992663712693
  0.7439674495896541  0.9477464188420988  0.8171594400691764
  0.2561137066081546  0.0522956407222766  0.1829015910137486
  0.7439346590823824  0.0522723975582926  0.1828821732523054
  0.2559750590829077  0.9477400950846709  0.8172431317820371
  0.2561275249765232  0.9477685165879691  0.1828762754440969
  0.7439829088446909  0.0523261419399335  0.8171738881707330
  0.3172438880361964  0.7560325943549420  0.0522419509368569
  0.6827310143918980  0.2440000933075790  0.9477518843070938
  0.3172209789095580  0.2439872732976049  0.9477147898291622
  0.6827941924617801  0.7560555606468532  0.0522664892068958
  0.6827525199067738  0.2440080360352674  0.0523044073687698
  0.3172063779169028  0.7560181066361026  0.9477123656378429
  0.6828438916653793  0.7560650155435065  0.9476751829017043
  0.3172027194383437  0.2439940771625512  0.0523112111655220
  0.5522534004491954  0.8170922010581049  0.7561545890650804
  0.4477546485845790  0.1828616841791855  0.2439015620894915
  0.4476971243002478  0.8171641839001812  0.2439589187866807
  0.5523015797082439  0.1828325141964356  0.7560324920906498
  0.5522716394381325  0.1828413964890921  0.2439025499699621
  0.4477236416940648  0.8170874187234625  0.7561374431410512
  0.4477534300804649  0.1828200568903424  0.7560457636913795
  0.5522681067423405  0.8171899726230708  0.2439295935970094
  0.5523447501956944  0.7559824153451031  0.1828264957032833
  0.4477216175458979  0.2439758235312117  0.8171485547042547
  0.4477749450188152  0.2439889254629764  0.1827978330726379
  0.5523521682616301  0.7559533807434352  0.8172503465466751
  0.5522648016385627  0.2439925462124604  0.8171355098546268
  0.4477824586983429  0.7560147750144462  0.1827935086358292
  0.4477510060606098  0.7559868872166140  0.8172799588961889
  0.5522909872858890  0.2440018878752807  0.1828243228687454
  0.2560689651892240  0.8171755330214053  0.9477691382950106
  0.7438820123491202  0.1828437951552292  0.0522080355062143
  0.7439435604996828  0.8172094362224454  0.0522766702999858
  0.2560749356096532  0.1828295806547222  0.9476756484577048
  0.7438938620816409  0.1828666260221360  0.9477002377031735
  0.2560965485035794  0.8171724214626754  0.0522877342604179
  0.2560825640382986  0.1828169052266964  0.0522710592504284
  0.7439988532673257  0.8172166201129316  0.9476989066695352
  0.3172582683062292  0.0523271231091000  0.2439943296718327
  0.6828465733262362  0.9477289744213768  0.7560524603038242
  0.3170779470089607  0.9476855561939842  0.7561022362144536
  0.6827728639519517  0.0523564915190494  0.2439803352480160
  0.6828519210812674  0.0523040382356344  0.7560680501957159
  0.3172663972932722  0.9477280637472388  0.2439774099073805
  0.6827389429253973  0.9477515859287755  0.2439885352712827
  0.3171010788751352  0.0522339593575485  0.7561038493215194
  0.7560570751487772  0.5523046620450478  0.8171468774459337
  0.2439547839284885  0.4476452635237199  0.1828572478451629
  0.2439217209222690  0.4476710634277576  0.8170952372458258
  0.7560708147881572  0.5522286917251340  0.1828724932674846
  0.2439879949411138  0.5522500470919701  0.1828093779923057
  0.7560367178179408  0.4477672117332558  0.8171751680023692
  0.7561146671783546  0.4477032270025950  0.1829136537146678
  0.2438871476462950  0.5522576390136378  0.8170994603923801
  0.8171693828689696  0.2560982080706584  0.0522050492722676
  0.1828156912482545  0.7439151616092553  0.9477512404812937
  0.8171985965072248  0.7439559816587306  0.9477064618945016
  0.1827800967263418  0.2560350407543737  0.0522570704395503
  0.1828042880972857  0.7439492823132026  0.0522897652854652
  0.8171556668642067  0.2560771102411515  0.9476946461737241
  0.1827869259117448  0.2559963767694457  0.9476513405418568
  0.8171983370119463  0.7439549705058636  0.0522991641721880
  0.0522427146344674  0.3171933668931256  0.7560555750998502
  0.9476910933663047  0.6827896736248892  0.2439614260784706
  0.9477047373294237  0.3170769217376466  0.2438883688918903
  0.0522736052273359  0.6828759851749403  0.7560890093522802
  0.0522717964902518  0.6827591740150597  0.2439514826016810
  0.9476573628534745  0.3171731806702957  0.7560404415636705
  0.9477141277705829  0.6828692525938980  0.7560514922464536
  0.0522171550496123  0.3171423298021812  0.2438894665357303
  0.0522927291324987  0.2559665475020567  0.1828033050578727
  0.9476920299740660  0.7440217320076611  0.8172102638110473
  0.9477221864089631  0.7439189326316459  0.1828587728919629
  0.0522699795109866  0.2560025336221031  0.8171450836341679
  0.0522853139758232  0.7440582680382839  0.8172197590976680
  0.9477583736212488  0.2559511744856116  0.1827464360373000
  0.9476979472224779  0.2560269417626195  0.8171799192074278
  0.0522463094604284  0.7439146053126949  0.1828773786150252
  0.7560397334802980  0.3172524415080368  0.9477523864682650
  0.2439271402450801  0.6827842292135429  0.0522337256703483
  0.2439279555101704  0.3171921474919828  0.0522970460590361
  0.7560443233955471  0.6828049246412025  0.9476706724478727
  0.2439641422118918  0.6827717300100145  0.9476869485966014
  0.7560289110433827  0.3172476793415352  0.0522989079947533
  0.7560602040775461  0.6827970246528863  0.0522621033188586
  0.2439049604462840  0.3171781414406672  0.9477092281618684
  0.8172107318003042  0.5522782824503930  0.2439619874562888
  0.1827470675049973  0.4476457027992932  0.7559743461375577
  0.8171563644480871  0.4476883910657499  0.7560414161680855
  0.1828434424863392  0.5523319940688166  0.2439578084056439
  0.1827157592575846  0.5522922144471265  0.7559735290663501
  0.8172625250433941  0.4476878678084882  0.2440026048812085
  0.1827779248080910  0.4477140026930971  0.2439722760358752
  0.8172109640077765  0.5522364587190036  0.7560529912663612
  0.7559389438401790  0.0523590225669067  0.3172716426671587
  0.2439340782960172  0.9476954166233365  0.6828778183976743
  0.2440278453750430  0.9477032018957575  0.3172636954359030
  0.7560152435486439  0.0523065193958734  0.6828024414211000
  0.2439062132566200  0.0522497025713737  0.6828747300557787
  0.7559458179191977  0.9477555773895265  0.3172730517899242
  0.7560231613715512  0.9477510619977043  0.6827877255696527
  0.2440312307886455  0.0523285009243780  0.3172770687508032
  0.8172172874649707  0.7560557825651654  0.5522407485339210
  0.1827408057810802  0.2440458996361681  0.4477355638101333
  0.8172825795620418  0.2440128733369760  0.4477316402580092
  0.1827678931809407  0.7560596864280761  0.5522415857963932
  0.1827967476462553  0.2439988059976171  0.5523194165226238
  0.8171726081816578  0.7560500042045903  0.4477118181343838
  0.1828039294792215  0.7560313663135145  0.4477045905373480
  0.8172315591587179  0.2439873606722847  0.5522971369352733
  0.0522280210818338  0.8171084158720908  0.2561481053853621
  0.9476824950821613  0.1828662641510895  0.7439182650296412
  0.9476602073456266  0.8172009359817509  0.7439783825902261
  0.0522791432913393  0.1828044310788427  0.2560604360150388
  0.0522488813722520  0.1828587444699577  0.7438656649326258
  0.9476868215562250  0.8170945933785174  0.2561199749663360
  0.9477243282620740  0.1828096844320802  0.2560358850077351
  0.0522535686591122  0.8172009072849973  0.7439505661707662
  0.0522987287681650  0.7560001597951695  0.6828415877163722
  0.9477091261979859  0.2439628588910414  0.3171443708612072
  0.9476840407344778  0.2440087896126186  0.6827780800272046
  0.0523016041894765  0.7559685811707710  0.3172345653618506
  0.0522385312442835  0.2439699237797156  0.3171540051386074
  0.9477270620679326  0.7560422112847275  0.6828261179721119
  0.9477032851117994  0.7559949640406104  0.3172542160490977
  0.0522747762865513  0.2440355645987614  0.6827613821559931
  0.7560417199522421  0.8172023368735208  0.4477679708867821
  0.2439445992460326  0.1828157915412411  0.5522531763304033
  0.2439048659532669  0.8171905907607122  0.5522725705705495
  0.7561178037402638  0.1828566837276914  0.4477203598450219
  0.2439095997102198  0.1828804340343086  0.4476919306711955
  0.7560712620848299  0.8171884890188417  0.5522901123117278
  0.7560825335868057  0.1828175477607079  0.5522573203897547
  0.2439224597467468  0.8171859167008414  0.4477443727688997
  0.8171295267076507  0.0523218966228556  0.7439125004180465
  0.1829123365478797  0.9477510729203579  0.2561392865736091
  0.8170654476085538  0.9477427158695046  0.2561421731068761
  0.1827722622616678  0.0523619197631271  0.7439867592693620
  0.1829203730966752  0.0523015365080318  0.2561419283700134
  0.8171502512147890  0.9477725275450589  0.7438891147090773
  0.1827746966298963  0.9477505441207654  0.7439663738866051
  0.8170561213478582  0.0522681583504526  0.2561375060308820
  0.3816177419677591  0.6184146797612181  0.2656570813488293
  0.6184044585230573  0.3815941046176193  0.7342779116368700
  0.6184768922437995  0.3815574548108679  0.2657629776512527
  0.3815041567867373  0.6183384852350090  0.7342735842507911
  0.6185121282830324  0.6183622535208643  0.7342324696689854
  0.3815673639001419  0.3815545991540367  0.2657307122445640
  0.3815831480218584  0.3815674231990888  0.7342306524445311
  0.6184667345007474  0.6184195692500195  0.2657294347843498
  0.2657348618965196  0.3815558122242120  0.6183422476824710
  0.7343134661480251  0.6184306172654350  0.3816268441136542
  0.2657266440498976  0.6184188296459590  0.3815689793125894
  0.7342803959336638  0.3816110966417857  0.6183947750405291
  0.7343599681082651  0.6183738787530189  0.6183253877829541
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