Ni  H  C  O                             
   1.00000000000000     
     6.7343700000000002    0.0000000000000000    0.0000000000000000
    -2.2462816700000001   14.9376494139999991    0.0000000000000000
    -2.2460209579999999   -7.4671988000000002   12.9373677110000003
   Ni   H    C    O 
     6    10    25    19
Direct
  0.1125436673618054  0.2905924202669112  0.7218446757186712
  0.8319793213563713  0.4152737331601557  0.6965628713125156
  0.4117101340685068  0.2848242615146290  0.5893501808344794
  0.8260170943365708  0.6961802743886238  0.4158944941655420
  0.4124729371568492  0.5861665741265725  0.2828558391278122
  0.1304245532930040  0.7191645827973190  0.3064935687519039
  0.7357408493342632  0.4768616640188981  0.4780122307833850
  0.2574708000870416  0.0007180579788084  0.5203338229519687
  0.2619525504461109  0.5286397610440119  0.0028947155894912
  0.0984082839062452  0.5730598458171485  0.5754416328191851
  0.5215451867157057  0.0008528792680806  0.4274548056091803
  0.5267128737737607  0.4277032678583552  0.9992504108087061
  0.7272073131715118  0.0891605550529633  0.7207694956425712
  0.6023718015837645  0.9547283916424973  0.6367686367139100
  0.4503333491217418  0.0480370367237271  0.6770759087686855
  0.5824527233592036  0.0188101572034967  0.7679800266906085
  0.5082139336432050  0.4626738430025910  0.5596006978950143
  0.0429885260867593  0.0959186358123603  0.5348081738541879
  0.9533141030508219  0.4481589463268278  0.9061619227249906
  0.0463551355752685  0.5412990465371834  0.0974000297547875
  0.9472007331752224  0.9050940876378064  0.4421347624785028
  0.5065751512305710  0.5574401463503449  0.4632534325281839
  0.5976820582934224  0.4998388408854240  0.5010965247967647
  0.0962077195467685  0.0006557733224142  0.4979451882257777
  0.1004504749020825  0.5054567071762506  0.0022183801713851
  0.3234704889749196  0.4913805514882341  0.5882139373320641
  0.8286035393418558  0.0955859767571994  0.5073682797481993
  0.7402025709025821  0.4184445778719592  0.9061240479415815
  0.8317742670231425  0.5114876941027688  0.0955557596889562
  0.7337850899291709  0.9063202165734907  0.4150450168804056
  0.3211108995251877  0.5852956699313125  0.4924177887116414
  0.2038862950847360  0.4549818587889547  0.6437955684693293
  0.7461308662037851  0.1875232798421536  0.5442652753862021
  0.5660008309215243  0.3620671427335012  0.8140860053815331
  0.7453964935851261  0.5477942604074286  0.1863052866581683
  0.5582456731795702  0.8152251730939355  0.3627515353072752
  0.1982534252310728  0.6386620520251753  0.4548653274341490
  0.2394856252745043  0.5524858788496019  0.5546190044439427
  0.6836868142783032  0.0009756087310038  0.4472524959679589
  0.6886385333427327  0.4498959732299568  0.0001886009623036
  0.5905290238426701  0.0275716489251607  0.7004508337731679
  0.5915195362131271  0.3977384843945941  0.5811560873860984
  0.1917764227442191  0.1826122242139192  0.5986163625399001
  0.0189739830245799  0.4296865130974794  0.8213061758278428
  0.1942550186901499  0.6051357719532149  0.1842546376704775
  0.0087662564408433  0.8189861938235765  0.4220804511382283
  0.5895241294908047  0.5786939846605819  0.3979588518321577
  0.2519521852036561  0.3844415703020019  0.6625072573853217
  0.8745765426406606  0.2758667175218150  0.6124197887073564
  0.6034897669425519  0.3426358169633801  0.7257264545412099
  0.8662289199965940  0.6207802150781276  0.2742845437548240
  0.5927277431028131  0.7280908305646534  0.3496097584174152
  0.2457442132770140  0.6523421842956409  0.3810597418366939
  0.0497735840179274  0.4918410600251804  0.6697088769173050
  0.5563592020204737  0.1802330764765401  0.5111325694466871
  0.3864717731908769  0.3353466286343547  0.8231628131698869
  0.5564364837584179  0.5112868491768552  0.1779079061069737
  0.3772097913072727  0.8229824686479645  0.3343601338873654
  0.0460114828801679  0.6674924029803577  0.4912119792805072
  0.9858740870608003  0.2205438550277492  0.7672712271724365
 
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
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  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
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  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
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  0.00000000E+00  0.00000000E+00  0.00000000E+00
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  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
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  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
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  0.00000000E+00  0.00000000E+00  0.00000000E+00
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  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
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  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
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  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
