 C  N Co Ru  O  H                       
   1.00000000000000     
     9.8736660799999996    0.0000000000000000    0.0000000000000000
    -4.9368330399999980    8.5508456537647159    0.0000000000000000
     0.0000000000000006    0.0000000000000011   15.6500000000000004
   C    N    Co   Ru   O    H 
    22     6     1     1     1     1
Direct
  0.0883596928922592  0.1734555281148011  0.4745364335966636
  0.1697298432729114  0.0875661792006489  0.4747629747313378
  0.0849362225642770  0.4152220008459864  0.4726154111120499
  0.0895707293796717  0.6692482484035360  0.4716579934958633
  0.1692814391177746  0.5839575972404074  0.4726064673295157
  0.0876419698778289  0.9192184399680489  0.4738252017851360
  0.1722045627942642  0.8367861045613364  0.4733407443286322
  0.3380048286042999  0.1725231298362807  0.4776013363168577
  0.4246348833565082  0.0886760248069155  0.4765225460057243
  0.3389877796973602  0.9193993040698450  0.4747364379114077
  0.4144562169175765  0.8257258796394300  0.4745549335382487
  0.5924565010041225  0.1724720719306037  0.4748979060495849
  0.6680209270634976  0.0799326761271759  0.4739834540337791
  0.5816959987895947  0.9116052381442888  0.4748209240012833
  0.6649882158981532  0.8266125662889052  0.4776247198407363
  0.8350339236163512  0.1623502927522379  0.4735035069057438
  0.9191892938908939  0.0797370863950041  0.4747991788852082
  0.8397238411062563  0.4145855972786003  0.4715160174036879
  0.9199277930358848  0.3298913707321819  0.4717859921291974
  0.9246688895393483  0.5845204364037201  0.4713701323838900
  0.8355334994528264  0.9104525239434956  0.4764945706096957
  0.9195008073582526  0.8266428619819667  0.4746728516428675
  0.3293243020767064  0.6618928605862021  0.4744931157785804
  0.1670482708935505  0.3372776154936930  0.4744404947578589
  0.5839243245796435  0.6708682200646212  0.4812027481204562
  0.4126705225954861  0.3282994392482722  0.4812324341972462
  0.6802451172141205  0.3343078971181421  0.4734499512529258
  0.8454552897120858  0.6648052117987010  0.4730858637513888
  0.3843208111354648  0.4995697209088865  0.4787648543619206
  0.6147264443168654  0.4995797790641161  0.4899800928861169
  0.6733165312005696  0.5001286919071481  0.6108219199466567
  0.5934595507834698  0.5063475448166584  0.6446757877147874
 
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
