Fe  H  C  O                             
   1.00000000000000     
     0.0000267020000000    0.0000000000000000   -6.8695000000000004
   -10.9937632870000002  -19.0416268220000013    0.0000000000000000
   -10.9938483120000008   19.0416759040000017   -0.0000580720000000
   Fe   H    C    O 
     6    18    42    18
Direct
  0.8320811317140837  0.3753293439612193  0.6658232902909731
  0.1654172391008686  0.2904944155841065  0.6246727607063676
  0.4987479143255626  0.3341777891747739  0.7095078616913639
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  0.7094214377769035  0.9644678120245587  0.5068396399066515
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  0.9072508954964889  0.9530548588851886  0.5161418046045583
  0.5739187172102476  0.4838547433436631  0.4369080484694621
  0.2405789757463523  0.5630860993108016  0.0469436291342475
  0.0132338698307777  0.4017598507681015  0.5154153027216921
  0.3465674734072977  0.1136559885957098  0.5982474955648200
  0.6798935189239401  0.4845820039150581  0.8863437109368135
  0.9867693222691969  0.8863434841948887  0.4845824447737783
  0.6534371743773093  0.5154115971121982  0.4017532558851329
  0.3200994832043165  0.5982402114286742  0.1136542217633547
  0.1325358075247181  0.3939446975442706  0.7795531230539154
  0.4658744894178923  0.3856089391604627  0.6060570286408833
  0.7992072670159160  0.2204485611148357  0.6143965107471416
  0.8674586502899331  0.6143961312087427  0.2204476051646083
  0.5341272469486711  0.7795528351533889  0.3939434854810884
  0.2007944693431938  0.6060539562883704  0.3856048861800758
  0.0406006460599073  0.3460296110999721  0.5831018645577899
  0.3739343507225925  0.2370729460165819  0.6539762902394486
  0.7072619106520079  0.4169000231283420  0.7629283649051786
  0.9594025460226590  0.7629282757807658  0.4168979431953090
  0.6260688413531739  0.5830994947382564  0.3460243211848066
  0.2927325471803428  0.6539738086153903  0.2370702682775985
  0.0811672510758896  0.3769668884533317  0.7158137173900556
  0.4145067063313803  0.3388471022915454  0.6230344498752629
  0.7478363207567185  0.2841873214138388  0.6611544585348952
  0.9188272067444814  0.6611569578328584  0.2841863336559172
  0.5854950300402777  0.7158135319828673  0.3769654617768055
  0.2521625041969742  0.6230345095540812  0.3388452077792792
  0.6359857150495358  0.4122009947126344  0.6221667450230299
  0.9693203093316285  0.2099654415968928  0.5878055923666494
  0.3026470807278798  0.3778358561014343  0.7900354699711230
  0.3640160213067318  0.7900360366630963  0.3778349879675886
  0.0306828827338066  0.6221625566139792  0.4121962407739588
  0.6973473770847818  0.5878050740236702  0.2099654927325432
 
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