Cr  H  C  O                             
   1.00000000000000     
    18.8554999999999993    0.0000000000000000    0.0000000000000000
    -9.4279149839999992   16.3302859749999989    0.0000000000000000
    -9.4278149869999996   -5.4406140589999996   15.3971523880000003
   Cr   H    C    O 
    12    28    73    49
Direct
  0.4366299071049156  0.4994273182252087  0.5007763647263346
  0.5747687713078022  0.5003377055530933  0.5003769402194465
  0.4500150384843664  0.9498107738551198  0.9491449867957229
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  0.5507652661891598  0.0508360334249716  0.4994982063043025
  0.9999991337445167  0.5007298779293237  0.0500884826340382
  0.0005099089200655  0.5006138701476175  0.9492729325320752
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  0.9995904918405358  0.0502542032936475  0.5000125871326802
  0.9998787709934405  0.9493356455608719  0.5000138860741643
  0.5312208021881588  0.7639448554990267  0.5259751800801595
  0.4664553544549648  0.2351063721443651  0.4713611853095827
  0.4695307604030674  0.4740852052434334  0.2350960689861807
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  0.5335122155799965  0.0054035439994706  0.7660020309464528
  0.5334846461721696  0.7667142592855143  0.0045846139741386
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  0.2381482809799991  0.0048429240722072  0.7664073006900196
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  0.4048599133269946  0.3362073438387085  0.4764043256282164
  0.4083234127067996  0.4774093431200086  0.3373058776795403
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  0.5951800036292809  0.0709646359431844  0.9290665987789311
  0.5951404588145124  0.9297032301318993  0.0702493534351873
  0.4056595172133513  0.0707675033375779  0.9291880498078484
  0.4048366714232472  0.9304483326266464  0.3340169578374912
  0.5952010126087330  0.0710258205747110  0.6647157696494972
  0.1427489089168219  0.4777657011037135  0.0722529706770345
  0.8580537782945257  0.5238456085889567  0.9281229177894943
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  0.4045470220748300  0.3345182298833649  0.9298524583778374
  0.1405698685442758  0.6660637553895228  0.0697258800164064
  0.8594443002149674  0.3354199920089513  0.9290393210077283
  0.5928202517567129  0.9278842900360971  0.5221939614149917
  0.4064929591450621  0.0721121404788718  0.4766524234520020
  0.8575608146297924  0.9283822398021826  0.5226427456983345
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  0.5936363848133368  0.5228856150447285  0.9291601225659036
  0.8595404669249973  0.9297148991335078  0.3345560185540961
  0.1401537000257420  0.0701349603222994  0.6654035591662293
  0.6420746617362951  0.7555190425189124  0.5273618001162532
  0.3563647494631397  0.2435314325168747  0.4712864961741516
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  0.6439309051522670  0.1145172422247285  0.8855488116508212
  0.6440754268915612  0.8862879616377981  0.1136463390051077
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  0.5988095982587751  0.7981186396367335  0.5273734905896319
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  0.3991480305223050  0.9298056125128937  0.1989906914468094
  0.6010852096803134  0.0715968142753525  0.7998134778218997
  0.6012407949714884  0.8005722677069613  0.0706747567717869
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  0.4846678393900703  0.3733688573475646  0.4789937654801619
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  0.5140411194343315  0.8883316708265099  0.9928309868462435
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  0.3670252513858614  0.8890986207769984  0.3736866308139071
  0.6331742071725657  0.1121641667438098  0.6250623334416545
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  0.8940783042337017  0.5199953230793994  0.8867698166474725
  0.6329124667472215  0.6256566550105163  0.1116550617073742
  0.3667301488949732  0.3742406639928930  0.8886344471503449
  0.8952528033133049  0.3751140900719889  0.0063816995197499
  0.1047937441680489  0.6262376622864778  0.9924413044005007
  0.3684476247415844  0.9945021143369246  0.4798601594511922
  0.6311117247471998  0.0054490520594612  0.5188374966156744
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