# generated using pymatgen
data_CrNi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.37516019
_cell_length_b   22.75716204
_cell_length_c   49.77417889
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   93.51555343
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrNi2
_chemical_formula_sum   'Cr126 Ni252'
_cell_volume   9468.85135134
_cell_formula_units_Z   126
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Cr  Cr1  1  0.202399  0.567263  0.334366  1
  Cr  Cr2  1  0.869066  0.233930  0.334366  1
  Cr  Cr3  1  0.761544  0.581733  0.292364  1
  Cr  Cr4  1  0.479834  0.574698  0.311615  1
  Cr  Cr5  1  0.535732  0.900596  0.334366  1
  Cr  Cr6  1  0.428211  0.248400  0.292364  1
  Cr  Cr7  1  0.146501  0.241364  0.311615  1
  Cr  Cr8  1  0.094878  0.915066  0.292364  1
  Cr  Cr9  1  0.813168  0.908031  0.311615  1
  Cr  Cr10  1  0.005948  0.737622  0.323600  1
  Cr  Cr11  1  0.672615  0.404288  0.323600  1
  Cr  Cr12  1  0.562310  0.750023  0.282372  1
  Cr  Cr13  1  0.281437  0.744758  0.302021  1
  Cr  Cr14  1  0.339281  0.070955  0.323600  1
  Cr  Cr15  1  0.228977  0.416690  0.282372  1
  Cr  Cr16  1  0.948104  0.411425  0.302021  1
  Cr  Cr17  1  0.895644  0.083357  0.282372  1
  Cr  Cr18  1  0.614771  0.078091  0.302021  1
  Cr  Cr19  1  0.368260  0.548558  0.395968  1
  Cr  Cr20  1  0.034927  0.215225  0.395968  1
  Cr  Cr21  1  0.923908  0.561317  0.354257  1
  Cr  Cr22  1  0.646678  0.554979  0.375596  1
  Cr  Cr23  1  0.701594  0.881892  0.395968  1
  Cr  Cr24  1  0.590575  0.227984  0.354257  1
  Cr  Cr25  1  0.313344  0.221645  0.375596  1
  Cr  Cr26  1  0.257242  0.894651  0.354257  1
  Cr  Cr27  1  0.980011  0.888312  0.375596  1
  Cr  Cr28  1  0.173823  0.718556  0.385723  1
  Cr  Cr29  1  0.840490  0.385223  0.385723  1
  Cr  Cr30  1  0.727731  0.731476  0.344108  1
  Cr  Cr31  1  0.451806  0.724396  0.364932  1
  Cr  Cr32  1  0.507157  0.051889  0.385723  1
  Cr  Cr33  1  0.394398  0.398143  0.344108  1
  Cr  Cr34  1  0.118473  0.391062  0.364932  1
  Cr  Cr35  1  0.061064  0.064809  0.344108  1
  Cr  Cr36  1  0.785139  0.057729  0.364932  1
  Cr  Cr37  1  0.535306  0.529307  0.458927  1
  Cr  Cr38  1  0.201973  0.195974  0.458927  1
  Cr  Cr39  1  0.090740  0.542087  0.417236  1
  Cr  Cr40  1  0.812893  0.535725  0.437947  1
  Cr  Cr41  1  0.868640  0.862641  0.458927  1
  Cr  Cr42  1  0.757407  0.208754  0.417236  1
  Cr  Cr43  1  0.479559  0.202392  0.437947  1
  Cr  Cr44  1  0.424074  0.875420  0.417236  1
  Cr  Cr45  1  0.146226  0.869059  0.437947  1
  Cr  Cr46  1  0.340926  0.699085  0.448415  1
  Cr  Cr47  1  0.007593  0.365752  0.448415  1
  Cr  Cr48  1  0.896406  0.711950  0.406624  1
  Cr  Cr49  1  0.618638  0.705646  0.427505  1
  Cr  Cr50  1  0.674259  0.032419  0.448415  1
  Cr  Cr51  1  0.563073  0.378616  0.406624  1
  Cr  Cr52  1  0.285304  0.372313  0.427505  1
  Cr  Cr53  1  0.229740  0.045283  0.406624  1
  Cr  Cr54  1  0.951971  0.038980  0.427505  1
  Cr  Cr55  1  0.701995  0.510110  0.521609  1
  Cr  Cr56  1  0.368662  0.176777  0.521609  1
  Cr  Cr57  1  0.257496  0.522923  0.479743  1
  Cr  Cr58  1  0.979741  0.516536  0.500683  1
  Cr  Cr59  1  0.035328  0.843443  0.521609  1
  Cr  Cr60  1  0.924163  0.189590  0.479743  1
  Cr  Cr61  1  0.646407  0.183203  0.500683  1
  Cr  Cr62  1  0.590829  0.856256  0.479743  1
  Cr  Cr63  1  0.313074  0.849869  0.500683  1
  Cr  Cr64  1  0.507606  0.680009  0.511121  1
  Cr  Cr65  1  0.174273  0.346676  0.511121  1
  Cr  Cr66  1  0.063056  0.692839  0.469386  1
  Cr  Cr67  1  0.785325  0.686360  0.490231  1
  Cr  Cr68  1  0.840940  0.013343  0.511121  1
  Cr  Cr69  1  0.729722  0.359505  0.469386  1
  Cr  Cr70  1  0.451992  0.353027  0.490231  1
  Cr  Cr71  1  0.396389  0.026172  0.469386  1
  Cr  Cr72  1  0.118658  0.019693  0.490231  1
  Cr  Cr73  1  0.868657  0.491032  0.584195  1
  Cr  Cr74  1  0.535323  0.157699  0.584195  1
  Cr  Cr75  1  0.424144  0.503763  0.542402  1
  Cr  Cr76  1  0.146605  0.497331  0.563404  1
  Cr  Cr77  1  0.201990  0.824366  0.584195  1
  Cr  Cr78  1  0.090810  0.170430  0.542402  1
  Cr  Cr79  1  0.813272  0.163998  0.563404  1
  Cr  Cr80  1  0.757477  0.837097  0.542402  1
  Cr  Cr81  1  0.479938  0.830664  0.563404  1
  Cr  Cr82  1  0.674229  0.660744  0.573801  1
  Cr  Cr83  1  0.340896  0.327410  0.573801  1
  Cr  Cr84  1  0.229855  0.673555  0.531962  1
  Cr  Cr85  1  0.951969  0.667303  0.552976  1
  Cr  Cr86  1  0.007563  0.994077  0.573801  1
  Cr  Cr87  1  0.896522  0.340221  0.531962  1
  Cr  Cr88  1  0.618636  0.333970  0.552976  1
  Cr  Cr89  1  0.563188  0.006888  0.531962  1
  Cr  Cr90  1  0.285303  1.000637  0.552976  1
  Cr  Cr91  1  0.037142  0.471766  0.646994  1
  Cr  Cr92  1  0.703808  0.138433  0.646994  1
  Cr  Cr93  1  0.591475  0.484393  0.605565  1
  Cr  Cr94  1  0.313279  0.478158  0.625750  1
  Cr  Cr95  1  0.370475  0.805100  0.646994  1
  Cr  Cr96  1  0.258141  0.151059  0.605565  1
  Cr  Cr97  1  0.979946  0.144825  0.625750  1
  Cr  Cr98  1  0.924808  0.817726  0.605565  1
  Cr  Cr99  1  0.646612  0.811492  0.625750  1
  Cr  Cr100  1  0.840675  0.641997  0.636458  1
  Cr  Cr101  1  0.507342  0.308664  0.636458  1
  Cr  Cr102  1  0.396512  0.654406  0.594739  1
  Cr  Cr103  1  0.118704  0.647833  0.615543  1
  Cr  Cr104  1  0.174008  0.975330  0.636458  1
  Cr  Cr105  1  0.063179  0.321072  0.594739  1
  Cr  Cr106  1  0.785371  0.314499  0.615543  1
  Cr  Cr107  1  0.729845  0.987739  0.594739  1
  Cr  Cr108  1  0.452038  0.981166  0.615543  1
  Cr  Cr109  1  0.198454  0.451793  0.708828  1
  Cr  Cr110  1  0.865120  0.118459  0.708828  1
  Cr  Cr111  1  0.758203  0.465331  0.666633  1
  Cr  Cr112  1  0.480820  0.458588  0.689569  1
  Cr  Cr113  1  0.531787  0.785126  0.708828  1
  Cr  Cr114  1  0.424869  0.131998  0.666633  1
  Cr  Cr115  1  0.147487  0.125254  0.689569  1
  Cr  Cr116  1  0.091536  0.798664  0.666633  1
  Cr  Cr117  1  0.814153  0.791921  0.689569  1
  Cr  Cr118  1  0.006298  0.621247  0.699431  1
  Cr  Cr119  1  0.672964  0.287914  0.699431  1
  Cr  Cr120  1  0.563029  0.635077  0.656907  1
  Cr  Cr121  1  0.285303  0.628954  0.678125  1
  Cr  Cr122  1  0.339631  0.954581  0.699431  1
  Cr  Cr123  1  0.229696  0.301744  0.656907  1
  Cr  Cr124  1  0.951969  0.295620  0.678125  1
  Cr  Cr125  1  0.896363  0.968410  0.656907  1
  Cr  Cr126  1  0.618636  0.962287  0.678125  1
  Ni  Ni127  1  0.023263  0.846803  0.330474  1
  Ni  Ni128  1  0.689929  0.513470  0.330474  1
  Ni  Ni129  1  0.564282  0.859217  0.289341  1
  Ni  Ni130  1  0.297879  0.852553  0.309101  1
  Ni  Ni131  1  0.356596  0.180137  0.330474  1
  Ni  Ni132  1  0.230949  0.525883  0.289341  1
  Ni  Ni133  1  0.964546  0.519220  0.309101  1
  Ni  Ni134  1  0.897616  0.192550  0.289341  1
  Ni  Ni135  1  0.631213  0.185887  0.309101  1
  Ni  Ni136  1  0.054308  0.806726  0.286405  1
  Ni  Ni137  1  0.720975  0.473392  0.286405  1
  Ni  Ni138  1  0.786304  0.799962  0.305919  1
  Ni  Ni139  1  0.512667  0.791946  0.327023  1
  Ni  Ni140  1  0.387642  0.140059  0.286405  1
  Ni  Ni141  1  0.452971  0.466628  0.305919  1
  Ni  Ni142  1  0.179334  0.458613  0.327023  1
  Ni  Ni143  1  0.119637  0.133295  0.305919  1
  Ni  Ni144  1  0.846000  0.125279  0.327023  1
  Ni  Ni145  1  0.221871  0.676481  0.340627  1
  Ni  Ni146  1  0.888537  0.343148  0.340627  1
  Ni  Ni147  1  0.773662  0.690382  0.299362  1
  Ni  Ni148  1  0.495472  0.682262  0.319319  1
  Ni  Ni149  1  0.555204  0.009814  0.340627  1
  Ni  Ni150  1  0.440329  0.357049  0.299362  1
  Ni  Ni151  1  0.162138  0.348929  0.319319  1
  Ni  Ni152  1  0.106995  0.023716  0.299362  1
  Ni  Ni153  1  0.828805  0.015596  0.319319  1
  Ni  Ni154  1  0.989615  0.628840  0.316178  1
  Ni  Ni155  1  0.656282  0.295507  0.316178  1
  Ni  Ni156  1  0.711236  0.622921  0.337053  1
  Ni  Ni157  1  0.255705  0.634749  0.295926  1
  Ni  Ni158  1  0.322948  0.962173  0.316178  1
  Ni  Ni159  1  0.377903  0.289588  0.337053  1
  Ni  Ni160  1  0.922372  0.301416  0.295926  1
  Ni  Ni161  1  0.044569  0.956254  0.337053  1
  Ni  Ni162  1  0.589038  0.968082  0.295926  1
  Ni  Ni163  1  0.192375  0.826862  0.392648  1
  Ni  Ni164  1  0.859042  0.493528  0.392648  1
  Ni  Ni165  1  0.747887  0.839927  0.350611  1
  Ni  Ni166  1  0.468964  0.832974  0.372077  1
  Ni  Ni167  1  0.525708  0.160195  0.392648  1
  Ni  Ni168  1  0.414553  0.506594  0.350611  1
  Ni  Ni169  1  0.135631  0.499641  0.372077  1
  Ni  Ni170  1  0.081220  0.173260  0.350611  1
  Ni  Ni171  1  0.802297  0.166308  0.372077  1
  Ni  Ni172  1  0.237895  0.786245  0.347289  1
  Ni  Ni173  1  0.904562  0.452912  0.347289  1
  Ni  Ni174  1  0.960495  0.779669  0.368388  1
  Ni  Ni175  1  0.683394  0.773540  0.389218  1
  Ni  Ni176  1  0.571229  0.119579  0.347289  1
  Ni  Ni177  1  0.627162  0.446335  0.368388  1
  Ni  Ni178  1  0.350060  0.440207  0.389218  1
  Ni  Ni179  1  0.293829  0.113002  0.368388  1
  Ni  Ni180  1  0.016727  0.106874  0.389218  1
  Ni  Ni181  1  0.387289  0.656861  0.402985  1
  Ni  Ni182  1  0.053956  0.323527  0.402985  1
  Ni  Ni183  1  0.942596  0.669624  0.361217  1
  Ni  Ni184  1  0.665398  0.663463  0.382275  1
  Ni  Ni185  1  0.720623  0.990194  0.402985  1
  Ni  Ni186  1  0.609263  0.336291  0.361217  1
  Ni  Ni187  1  0.332065  0.330130  0.382275  1
  Ni  Ni188  1  0.275930  0.002958  0.361217  1
  Ni  Ni189  1  0.998732  0.996796  0.382275  1
  Ni  Ni190  1  0.155599  0.610048  0.378958  1
  Ni  Ni191  1  0.822266  0.276714  0.378958  1
  Ni  Ni192  1  0.878566  0.603426  0.399695  1
  Ni  Ni193  1  0.435252  0.615927  0.357552  1
  Ni  Ni194  1  0.488932  0.943381  0.378958  1
  Ni  Ni195  1  0.545233  0.270093  0.399695  1
  Ni  Ni196  1  0.101919  0.282593  0.357552  1
  Ni  Ni197  1  0.211899  0.936760  0.399695  1
  Ni  Ni198  1  0.768586  0.949260  0.357552  1
  Ni  Ni199  1  0.359044  0.807668  0.455406  1
  Ni  Ni200  1  0.025711  0.474335  0.455406  1
  Ni  Ni201  1  0.914352  0.820491  0.413641  1
  Ni  Ni202  1  0.637019  0.814157  0.434445  1
  Ni  Ni203  1  0.692377  0.141001  0.455406  1
  Ni  Ni204  1  0.581019  0.487158  0.413641  1
  Ni  Ni205  1  0.303685  0.480824  0.434445  1
  Ni  Ni206  1  0.247686  0.153824  0.413641  1
  Ni  Ni207  1  0.970352  0.147491  0.434445  1
  Ni  Ni208  1  0.405433  0.766717  0.410235  1
  Ni  Ni209  1  0.072099  0.433384  0.410235  1
  Ni  Ni210  1  0.127768  0.760576  0.431070  1
  Ni  Ni211  1  0.850094  0.754081  0.451959  1
  Ni  Ni212  1  0.738766  0.100050  0.410235  1
  Ni  Ni213  1  0.794435  0.427242  0.431070  1
  Ni  Ni214  1  0.516760  0.420747  0.451959  1
  Ni  Ni215  1  0.461101  0.093909  0.431070  1
  Ni  Ni216  1  0.183427  0.087414  0.451959  1
  Ni  Ni217  1  0.553816  0.637888  0.465832  1
  Ni  Ni218  1  0.220482  0.304554  0.465832  1
  Ni  Ni219  1  0.109490  0.650764  0.424094  1
  Ni  Ni220  1  0.831529  0.644231  0.444905  1
  Ni  Ni221  1  0.887149  0.971221  0.465832  1
  Ni  Ni222  1  0.776157  0.317431  0.424094  1
  Ni  Ni223  1  0.498196  0.310897  0.444905  1
  Ni  Ni224  1  0.442824  0.984098  0.424094  1
  Ni  Ni225  1  0.164863  0.977564  0.444905  1
  Ni  Ni226  1  0.322646  0.590620  0.441431  1
  Ni  Ni227  1  0.989313  0.257286  0.441431  1
  Ni  Ni228  1  0.044564  0.584313  0.462432  1
  Ni  Ni229  1  0.600025  0.597108  0.420663  1
  Ni  Ni230  1  0.655979  0.923953  0.441431  1
  Ni  Ni231  1  0.711231  0.250980  0.462432  1
  Ni  Ni232  1  0.266691  0.263774  0.420663  1
  Ni  Ni233  1  0.377897  0.917647  0.462432  1
  Ni  Ni234  1  0.933358  0.930441  0.420663  1
  Ni  Ni235  1  0.525925  0.788517  0.518055  1
  Ni  Ni236  1  0.192592  0.455184  0.518055  1
  Ni  Ni237  1  0.081437  0.801329  0.476291  1
  Ni  Ni238  1  0.803691  0.794896  0.497160  1
  Ni  Ni239  1  0.859259  0.121850  0.518055  1
  Ni  Ni240  1  0.748104  0.467996  0.476291  1
  Ni  Ni241  1  0.470357  0.461563  0.497160  1
  Ni  Ni242  1  0.414770  0.134662  0.476291  1
  Ni  Ni243  1  0.137024  0.128229  0.497160  1
  Ni  Ni244  1  0.572407  0.747758  0.472825  1
  Ni  Ni245  1  0.239073  0.414425  0.472825  1
  Ni  Ni246  1  0.294669  0.741306  0.493729  1
  Ni  Ni247  1  0.016853  0.735000  0.514694  1
  Ni  Ni248  1  0.905740  0.081092  0.472825  1
  Ni  Ni249  1  0.961336  0.407973  0.493729  1
  Ni  Ni250  1  0.683519  0.401666  0.514694  1
  Ni  Ni251  1  0.628002  0.074639  0.493729  1
  Ni  Ni252  1  0.350186  0.068333  0.514694  1
  Ni  Ni253  1  0.720439  0.618590  0.528534  1
  Ni  Ni254  1  0.387105  0.285257  0.528534  1
  Ni  Ni255  1  0.276024  0.631394  0.486678  1
  Ni  Ni256  1  0.998145  0.625099  0.507650  1
  Ni  Ni257  1  0.053772  0.951923  0.528534  1
  Ni  Ni258  1  0.942691  0.298061  0.486678  1
  Ni  Ni259  1  0.664811  0.291766  0.507650  1
  Ni  Ni260  1  0.609357  0.964727  0.486678  1
  Ni  Ni261  1  0.331478  0.958433  0.507650  1
  Ni  Ni262  1  0.489188  0.571495  0.504178  1
  Ni  Ni263  1  0.155855  0.238162  0.504178  1
  Ni  Ni264  1  0.211372  0.565051  0.525054  1
  Ni  Ni265  1  0.766942  0.577857  0.483291  1
  Ni  Ni266  1  0.822521  0.904829  0.504178  1
  Ni  Ni267  1  0.878039  0.231717  0.525054  1
  Ni  Ni268  1  0.433609  0.244524  0.483291  1
  Ni  Ni269  1  0.544706  0.898384  0.525054  1
  Ni  Ni270  1  0.100276  0.911191  0.483291  1
  Ni  Ni271  1  0.693070  0.769370  0.580668  1
  Ni  Ni272  1  0.359737  0.436037  0.580668  1
  Ni  Ni273  1  0.248319  0.782120  0.538945  1
  Ni  Ni274  1  0.970250  0.775789  0.559965  1
  Ni  Ni275  1  0.026404  0.102703  0.580668  1
  Ni  Ni276  1  0.914986  0.448787  0.538945  1
  Ni  Ni277  1  0.636917  0.442456  0.559965  1
  Ni  Ni278  1  0.581652  0.115453  0.538945  1
  Ni  Ni279  1  0.303583  0.109122  0.559965  1
  Ni  Ni280  1  0.739182  0.728512  0.535506  1
  Ni  Ni281  1  0.405848  0.395178  0.535506  1
  Ni  Ni282  1  0.461494  0.722151  0.556432  1
  Ni  Ni283  1  0.183582  0.715625  0.577213  1
  Ni  Ni284  1  0.072515  0.061845  0.535506  1
  Ni  Ni285  1  0.128160  0.388817  0.556432  1
  Ni  Ni286  1  0.850248  0.382291  0.577213  1
  Ni  Ni287  1  0.794827  0.055484  0.556432  1
  Ni  Ni288  1  0.516915  0.048958  0.577213  1
  Ni  Ni289  1  0.887151  0.599661  0.591140  1
  Ni  Ni290  1  0.553818  0.266328  0.591140  1
  Ni  Ni291  1  0.442712  0.612285  0.549394  1
  Ni  Ni292  1  0.165119  0.605786  0.570267  1
  Ni  Ni293  1  0.220484  0.932995  0.591140  1
  Ni  Ni294  1  0.109379  0.278952  0.549394  1
  Ni  Ni295  1  0.831786  0.272452  0.570267  1
  Ni  Ni296  1  0.776045  0.945619  0.549394  1
  Ni  Ni297  1  0.498453  0.939119  0.570267  1
  Ni  Ni298  1  0.655628  0.552127  0.566921  1
  Ni  Ni299  1  0.322294  0.218793  0.566921  1
  Ni  Ni300  1  0.378433  0.545884  0.587747  1
  Ni  Ni301  1  0.933729  0.558723  0.545973  1
  Ni  Ni302  1  0.988961  0.885460  0.566921  1
  Ni  Ni303  1  0.045099  0.212550  0.587747  1
  Ni  Ni304  1  0.600395  0.225390  0.545973  1
  Ni  Ni305  1  0.711766  0.879217  0.587747  1
  Ni  Ni306  1  0.267062  0.892056  0.545973  1
  Ni  Ni307  1  0.857402  0.749965  0.643981  1
  Ni  Ni308  1  0.524069  0.416631  0.643981  1
  Ni  Ni309  1  0.414466  0.762951  0.601613  1
  Ni  Ni310  1  0.137550  0.756270  0.622325  1
  Ni  Ni311  1  0.190736  0.083298  0.643981  1
  Ni  Ni312  1  0.081133  0.429618  0.601613  1
  Ni  Ni313  1  0.804217  0.422937  0.622325  1
  Ni  Ni314  1  0.747799  0.096285  0.601613  1
  Ni  Ni315  1  0.470884  0.089603  0.622325  1
  Ni  Ni316  1  0.905539  0.709544  0.598389  1
  Ni  Ni317  1  0.572205  0.376211  0.598389  1
  Ni  Ni318  1  0.627581  0.703012  0.618962  1
  Ni  Ni319  1  0.349935  0.696804  0.640079  1
  Ni  Ni320  1  0.238872  0.042878  0.598389  1
  Ni  Ni321  1  0.294248  0.369679  0.618962  1
  Ni  Ni322  1  0.016602  0.363471  0.640079  1
  Ni  Ni323  1  0.960915  0.036345  0.618962  1
  Ni  Ni324  1  0.683269  0.030137  0.640079  1
  Ni  Ni325  1  0.055056  0.580206  0.654120  1
  Ni  Ni326  1  0.721723  0.246873  0.654120  1
  Ni  Ni327  1  0.609456  0.592766  0.612065  1
  Ni  Ni328  1  0.331629  0.586787  0.632986  1
  Ni  Ni329  1  0.388390  0.913540  0.654120  1
  Ni  Ni330  1  0.276123  0.259433  0.612065  1
  Ni  Ni331  1  0.998296  0.253454  0.632986  1
  Ni  Ni332  1  0.942789  0.926099  0.612065  1
  Ni  Ni333  1  0.664962  0.920121  0.632986  1
  Ni  Ni334  1  0.823946  0.533638  0.629498  1
  Ni  Ni335  1  0.490613  0.200305  0.629498  1
  Ni  Ni336  1  0.544935  0.526490  0.650787  1
  Ni  Ni337  1  0.100191  0.539537  0.608704  1
  Ni  Ni338  1  0.157280  0.866972  0.629498  1
  Ni  Ni339  1  0.211602  0.193156  0.650787  1
  Ni  Ni340  1  0.766858  0.206204  0.608704  1
  Ni  Ni341  1  0.878269  0.859823  0.650787  1
  Ni  Ni342  1  0.433524  0.872871  0.608704  1
  Ni  Ni343  1  0.040462  0.731987  0.705099  1
  Ni  Ni344  1  0.707128  0.398654  0.705099  1
  Ni  Ni345  1  0.582532  0.743691  0.664173  1
  Ni  Ni346  1  0.306320  0.737044  0.685116  1
  Ni  Ni347  1  0.373795  0.065320  0.705099  1
  Ni  Ni348  1  0.249198  0.410357  0.664173  1
  Ni  Ni349  1  0.972987  0.403711  0.685116  1
  Ni  Ni350  1  0.915865  0.077024  0.664173  1
  Ni  Ni351  1  0.639653  0.070377  0.685116  1
  Ni  Ni352  1  0.071344  0.689650  0.660729  1
  Ni  Ni353  1  0.738010  0.356317  0.660729  1
  Ni  Ni354  1  0.797182  0.683614  0.682432  1
  Ni  Ni355  1  0.524843  0.675754  0.701886  1
  Ni  Ni356  1  0.404677  0.022984  0.660729  1
  Ni  Ni357  1  0.463849  0.350280  0.682432  1
  Ni  Ni358  1  0.191509  0.342421  0.701886  1
  Ni  Ni359  1  0.130515  0.016947  0.682432  1
  Ni  Ni360  1  0.858176  0.009087  0.701886  1
  Ni  Ni361  1  0.234534  0.560072  0.714923  1
  Ni  Ni362  1  0.901200  0.226738  0.714923  1
  Ni  Ni363  1  0.778594  0.574656  0.674579  1
  Ni  Ni364  1  0.509602  0.567336  0.696009  1
  Ni  Ni365  1  0.567867  0.893405  0.714923  1
  Ni  Ni366  1  0.445261  0.241322  0.674579  1
  Ni  Ni367  1  0.176269  0.234002  0.696009  1
  Ni  Ni368  1  0.111928  0.907989  0.674579  1
  Ni  Ni369  1  0.842935  0.900669  0.696009  1
  Ni  Ni370  1  0.995484  0.513369  0.691775  1
  Ni  Ni371  1  0.662151  0.180035  0.691775  1
  Ni  Ni372  1  0.730792  0.506732  0.711484  1
  Ni  Ni373  1  0.271931  0.520184  0.671025  1
  Ni  Ni374  1  0.328817  0.846702  0.691775  1
  Ni  Ni375  1  0.397458  0.173399  0.711484  1
  Ni  Ni376  1  0.938597  0.186851  0.671025  1
  Ni  Ni377  1  0.064125  0.840066  0.711484  1
  Ni  Ni378  1  0.605264  0.853518  0.671025  1
