 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 
    21     7     1     1     1     1
Direct
  0.0819225171398405  0.1670060074145800  0.4613232452154297
  0.1604977625329611  0.0785910058183324  0.4660429938306666
  0.0786007781764976  0.4125930338382301  0.4654303596034202
  0.1661518779179022  0.3314373851873286  0.4655199004188636
  0.0731831882591514  0.6503660906224775  0.4767955597035105
  0.0725699101566240  0.9098851831817107  0.4722463078643482
  0.1569614037361908  0.8222965260143557  0.4752103166538602
  0.3276778397501126  0.1634415818251874  0.4668068154305579
  0.4097956936248537  0.0786193673938716  0.4656181560850133
  0.4111375011213982  0.3348049233168537  0.4709057241338446
  0.3289123197742881  0.9092902926472316  0.4702857441272119
  0.5774261878296691  0.1664373691597701  0.4597020459371544
  0.6643867774468141  0.0885884888901288  0.4550503854891374
  0.6586230590847501  0.3294566029350949  0.4648016969357668
  0.5819861958733098  0.9264132578992736  0.4626526689302614
  0.6696031303557276  0.8497690852792975  0.4699784048059556
  0.8302597260669807  0.1679727867569791  0.4527944888803935
  0.9170735865088734  0.0895708532981062  0.4558242349265700
  0.8276972101183354  0.4109669107825341  0.4657810410788548
  0.9127622161880777  0.3306899783334999  0.4582706776490372
  0.8357195307222940  0.9282603663323625  0.4647871071832826
  0.3296059408080328  0.4140509811585592  0.4722447175158908
  0.5779618468687420  0.4128272817509712  0.4780846811799668
  0.1562251977431511  0.5726261529518104  0.4736195383639856
  0.9099498290957986  0.5689565402581638  0.4791136656470858
  0.4211026896581477  0.8385360885570933  0.4704084993169276
  0.5921006105531332  0.6949029270218953  0.4906002617942859
  0.9094345919332991  0.8427072419862023  0.4766879514393984
  0.3776996513659764  0.6291544007645008  0.4790932014209993
  0.7389797021647679  0.6269022741789110  0.5144868866192277
  0.8509677818491059  0.6917645391505044  0.6238430728395002
  0.7733303825353154  0.6640093896355349  0.6690142449590609
 
  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
