 C  N Ni Os  O  H                       
   1.00000000000000     
     9.8736660799999996    0.0000000000000000    0.0000000000000000
    -4.9368330399999980    8.5508456537647159    0.0000000000000000
     0.0000000000000006    0.0000000000000011   15.6500000000000004
   C    N    Ni   Os   O    H 
    22     6     1     1     1     1
Direct
  0.0837449526882430  0.1727919610760045  0.4609824157645396
  0.0901982203068098  0.4289071562618139  0.4598719838142460
  0.1694651417820904  0.3439522226716963  0.4593297680131584
  0.0961024425886271  0.6858045698053651  0.4635850648622063
  0.1728703416916517  0.5969127468975677  0.4607810052668451
  0.0904052165024365  0.9337453268396581  0.4653764162711154
  0.1817904913099689  0.8570483407012809  0.4660075495308839
  0.3369686097993976  0.6799218527808918  0.4629869192355071
  0.4112182619504118  0.5886797528228994  0.4653115334162182
  0.3505428314726363  0.9430961264048233  0.4696960010801099
  0.4242523490221507  0.8490564647821380  0.4678169769542697
  0.6013061099196252  0.1821642295427556  0.4771209161632105
  0.6774828236906154  0.0929017316441087  0.4694565885321837
  0.5897297692140561  0.9243979344145216  0.4685748875501110
  0.6642118167343458  0.8325485052013079  0.4713943838176280
  0.8415808202372295  0.1739753684314116  0.4661292322982674
  0.9183523762843293  0.0854138012752152  0.4649727105352890
  0.8478032677304105  0.4264614403436167  0.4716534017543778
  0.9258590436425070  0.3416524526285448  0.4638978199673385
  0.9311873864977392  0.5959956765310743  0.4680662169037371
  0.8316645159336346  0.9139678869423605  0.4695903253191351
  0.9203716739298863  0.8349957207823211  0.4702318504542488
  0.5717684357351561  0.6659386061118013  0.4794887335349243
  0.3314116204696499  0.4261080516897237  0.4606305264040675
  0.1660214098471979  0.0952146566205744  0.4605157871254023
  0.8444479055770314  0.6702902550197863  0.4749454325758539
  0.6883966100759903  0.3460907871948251  0.4866459584912196
  0.4413886979692133  0.1092133525215596  0.4759858773851389
  0.3844014065354369  0.2665589052880721  0.4659401271671620
  0.6274617753797527  0.5087828701693081  0.5170798029658019
  0.5495520171790912  0.4100754544750621  0.6254187683215063
  0.5034973193552149  0.2959439951258605  0.6259782773101767
 
  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
