# generated using pymatgen
data_Zr8Ni21
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.53196373
_cell_length_b   12.02606084
_cell_length_c   52.80002011
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   103.70161368
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr8Ni21
_chemical_formula_sum   'Zr96 Ni252'
_cell_volume   10198.673979
_cell_formula_units_Z   12
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
  Zr  Zr1  1  0.999034  0.937810  0.272042  1
  Zr  Zr2  1  0.619176  0.753303  0.309521  1
  Zr  Zr3  1  0.368656  0.355416  0.287782  1
  Zr  Zr4  1  0.992881  0.170095  0.328941  1
  Zr  Zr5  1  0.182592  0.984024  0.333195  1
  Zr  Zr6  1  0.561382  0.169029  0.296000  1
  Zr  Zr7  1  0.438433  0.945469  0.303251  1
  Zr  Zr8  1  0.826148  0.148080  0.268212  1
  Zr  Zr9  1  0.287056  0.699014  0.280469  1
  Zr  Zr10  1  0.907378  0.504963  0.317426  1
  Zr  Zr11  1  0.085035  0.611109  0.282247  1
  Zr  Zr12  1  0.702021  0.422889  0.320072  1
  Zr  Zr13  1  0.213612  0.026786  0.272617  1
  Zr  Zr14  1  0.831608  0.817109  0.305647  1
  Zr  Zr15  1  0.160199  0.285888  0.293144  1
  Zr  Zr16  1  0.780525  0.100898  0.332036  1
  Zr  Zr17  1  0.238854  0.571842  0.347912  1
  Zr  Zr18  1  0.855680  0.390285  0.386640  1
  Zr  Zr19  1  0.612607  0.985521  0.367099  1
  Zr  Zr20  1  0.233326  0.802472  0.405461  1
  Zr  Zr21  1  0.418387  0.612491  0.410274  1
  Zr  Zr22  1  0.798843  0.792517  0.370828  1
  Zr  Zr23  1  0.670212  0.578899  0.380929  1
  Zr  Zr24  1  0.055139  0.764378  0.341342  1
  Zr  Zr25  1  0.527688  0.322200  0.356503  1
  Zr  Zr26  1  0.147832  0.137645  0.395313  1
  Zr  Zr27  1  0.321133  0.242133  0.358766  1
  Zr  Zr28  1  0.940907  0.055881  0.396851  1
  Zr  Zr29  1  0.447715  0.638082  0.343629  1
  Zr  Zr30  1  0.065726  0.458491  0.382644  1
  Zr  Zr31  1  0.403792  0.921914  0.370198  1
  Zr  Zr32  1  0.022811  0.735543  0.409313  1
  Zr  Zr33  1  0.474445  0.206923  0.425260  1
  Zr  Zr34  1  0.093409  0.022833  0.463835  1
  Zr  Zr35  1  0.851464  0.618112  0.444283  1
  Zr  Zr36  1  0.469923  0.434311  0.483169  1
  Zr  Zr37  1  0.655527  0.244098  0.487976  1
  Zr  Zr38  1  0.037154  0.428268  0.449374  1
  Zr  Zr39  1  0.908292  0.212956  0.459185  1
  Zr  Zr40  1  0.288948  0.397291  0.420412  1
  Zr  Zr41  1  0.766594  0.952246  0.433775  1
  Zr  Zr42  1  0.385153  0.769082  0.472612  1
  Zr  Zr43  1  0.559444  0.871547  0.435524  1
  Zr  Zr44  1  0.178331  0.687934  0.474338  1
  Zr  Zr45  1  0.684305  0.272982  0.421576  1
  Zr  Zr46  1  0.303690  0.089374  0.460060  1
  Zr  Zr47  1  0.641043  0.551507  0.448193  1
  Zr  Zr48  1  0.259718  0.367811  0.487133  1
  Zr  Zr49  1  0.712191  0.838543  0.502579  1
  Zr  Zr50  1  0.330714  0.654907  0.541401  1
  Zr  Zr51  1  0.088731  0.250117  0.521943  1
  Zr  Zr52  1  0.707764  0.066044  0.560469  1
  Zr  Zr53  1  0.893109  0.875432  0.565307  1
  Zr  Zr54  1  0.273748  0.060163  0.526597  1
  Zr  Zr55  1  0.144986  0.844748  0.536329  1
  Zr  Zr56  1  0.526566  0.028851  0.497824  1
  Zr  Zr57  1  1.003734  0.584955  0.511350  1
  Zr  Zr58  1  0.622580  0.401193  0.550217  1
  Zr  Zr59  1  0.796982  0.503795  0.513141  1
  Zr  Zr60  1  0.415315  0.320883  0.552032  1
  Zr  Zr61  1  0.922410  0.905149  0.498629  1
  Zr  Zr62  1  0.541127  0.721249  0.537549  1
  Zr  Zr63  1  0.878551  0.183463  0.525711  1
  Zr  Zr64  1  0.497720  1.000330  0.564178  1
  Zr  Zr65  1  0.949003  0.470464  0.580256  1
  Zr  Zr66  1  0.569326  0.287093  0.618592  1
  Zr  Zr67  1  0.326371  0.882529  0.599102  1
  Zr  Zr68  1  0.943169  0.700805  0.637636  1
  Zr  Zr69  1  0.128633  0.510037  0.645295  1
  Zr  Zr70  1  0.511911  0.694019  0.604627  1
  Zr  Zr71  1  0.382453  0.481792  0.615335  1
  Zr  Zr72  1  0.763475  0.660076  0.575426  1
  Zr  Zr73  1  0.241083  0.217451  0.589055  1
  Zr  Zr74  1  0.861113  0.030674  0.626938  1
  Zr  Zr75  1  0.034580  0.135174  0.590475  1
  Zr  Zr76  1  0.654145  0.950904  0.629256  1
  Zr  Zr77  1  0.159170  0.537459  0.576224  1
  Zr  Zr78  1  0.778452  0.350512  0.615472  1
  Zr  Zr79  1  0.116490  0.813681  0.602999  1
  Zr  Zr80  1  0.734468  0.635116  0.641929  1
  Zr  Zr81  1  0.189635  0.102980  0.656935  1
  Zr  Zr82  1  0.813821  0.917775  0.697842  1
  Zr  Zr83  1  0.563783  0.520140  0.675760  1
  Zr  Zr84  1  0.181052  0.329223  0.713401  1
  Zr  Zr85  1  0.356763  0.126719  0.717648  1
  Zr  Zr86  1  0.742286  0.327162  0.682674  1
  Zr  Zr87  1  0.620742  0.102425  0.689540  1
  Zr  Zr88  1  1.000392  0.290580  0.652645  1
  Zr  Zr89  1  0.479552  0.849815  0.665833  1
  Zr  Zr90  1  0.096192  0.659911  0.703090  1
  Zr  Zr91  1  0.274853  0.766177  0.668142  1
  Zr  Zr92  1  0.893876  0.573842  0.705121  1
  Zr  Zr93  1  0.401394  0.172432  0.653744  1
  Zr  Zr94  1  0.021724  0.986290  0.692470  1
  Zr  Zr95  1  0.351990  0.454772  0.680350  1
  Zr  Zr96  1  0.967749  0.247026  0.713104  1
  Ni  Ni97  1  0.492156  0.548407  0.296847  1
  Ni  Ni98  1  0.877894  0.734345  0.259400  1
  Ni  Ni99  1  0.453009  0.735310  0.294367  1
  Ni  Ni100  1  0.068924  0.553278  0.332764  1
  Ni  Ni101  1  0.927198  0.551341  0.267073  1
  Ni  Ni102  1  0.540925  0.377560  0.304206  1
  Ni  Ni103  1  0.512671  0.851779  0.336287  1
  Ni  Ni104  1  0.891669  0.031930  0.300226  1
  Ni  Ni105  1  0.094159  0.070271  0.303108  1
  Ni  Ni106  1  0.482643  0.264224  0.265835  1
  Ni  Ni107  1  0.186618  0.714354  0.318319  1
  Ni  Ni108  1  0.572193  0.891881  0.277946  1
  Ni  Ni109  1  0.427868  0.219713  0.319508  1
  Ni  Ni110  1  0.811418  0.386134  0.279580  1
  Ni  Ni111  1  0.115370  0.841990  0.293104  1
  Ni  Ni112  1  0.730235  0.652957  0.330236  1
  Ni  Ni113  1  0.582933  0.537550  0.335066  1
  Ni  Ni114  1  0.965554  0.718992  0.296491  1
  Ni  Ni115  1  0.025124  0.393370  0.298548  1
  Ni  Ni116  1  0.401908  0.583248  0.262053  1
  Ni  Ni117  1  0.345288  0.039423  0.335000  1
  Ni  Ni118  1  0.727141  0.223835  0.300181  1
  Ni  Ni119  1  0.273707  0.893334  0.302760  1
  Ni  Ni120  1  0.659971  0.081185  0.269649  1
  Ni  Ni121  1  0.269067  0.172897  0.311021  1
  Ni  Ni122  1  0.654238  0.347807  0.273123  1
  Ni  Ni123  1  0.347063  0.768199  0.328289  1
  Ni  Ni124  1  0.731565  0.950107  0.290708  1
  Ni  Ni125  1  0.368015  0.100191  0.285858  1
  Ni  Ni126  1  0.985427  0.909984  0.321932  1
  Ni  Ni127  1  0.996169  0.184071  0.278578  1
  Ni  Ni128  1  0.621203  0.009358  0.315871  1
  Ni  Ni129  1  0.268741  0.380159  0.328357  1
  Ni  Ni130  1  0.647491  0.560106  0.288939  1
  Ni  Ni131  1  0.341013  0.551733  0.306451  1
  Ni  Ni132  1  0.721948  0.741620  0.269918  1
  Ni  Ni133  1  0.183073  0.505820  0.303837  1
  Ni  Ni134  1  0.562050  0.683180  0.263876  1
  Ni  Ni135  1  0.424813  0.425323  0.333761  1
  Ni  Ni136  1  0.804128  0.598826  0.291677  1
  Ni  Ni137  1  0.255391  0.469935  0.267592  1
  Ni  Ni138  1  0.886309  0.268368  0.306060  1
  Ni  Ni139  1  0.734698  0.187091  0.377270  1
  Ni  Ni140  1  0.113097  0.371408  0.336880  1
  Ni  Ni141  1  0.688726  0.368038  0.372328  1
  Ni  Ni142  1  0.308083  0.185882  0.410444  1
  Ni  Ni143  1  0.159485  0.194076  0.342898  1
  Ni  Ni144  1  0.780025  0.005415  0.381770  1
  Ni  Ni145  1  0.749907  0.488408  0.413413  1
  Ni  Ni146  1  0.132252  0.672860  0.374435  1
  Ni  Ni147  1  0.339430  0.706565  0.378241  1
  Ni  Ni148  1  0.719321  0.887410  0.339623  1
  Ni  Ni149  1  0.422042  0.350032  0.394997  1
  Ni  Ni150  1  0.803994  0.531734  0.356420  1
  Ni  Ni151  1  0.666870  0.842248  0.397328  1
  Ni  Ni152  1  0.048012  0.026356  0.358748  1
  Ni  Ni153  1  0.346736  0.474735  0.370726  1
  Ni  Ni154  1  0.964783  0.293492  0.409561  1
  Ni  Ni155  1  0.823487  0.166635  0.414128  1
  Ni  Ni156  1  0.203134  0.353490  0.374833  1
  Ni  Ni157  1  0.266178  0.025962  0.378023  1
  Ni  Ni158  1  0.646370  0.208481  0.340099  1
  Ni  Ni159  1  0.581702  0.666694  0.413768  1
  Ni  Ni160  1  0.962951  0.848518  0.374580  1
  Ni  Ni161  1  0.507855  0.525135  0.378179  1
  Ni  Ni162  1  0.891712  0.705075  0.339445  1
  Ni  Ni163  1  0.506202  0.792784  0.386504  1
  Ni  Ni164  1  0.886722  0.975780  0.348333  1
  Ni  Ni165  1  0.581855  0.401245  0.405971  1
  Ni  Ni166  1  0.964645  0.585624  0.367159  1
  Ni  Ni167  1  0.605826  0.729302  0.360357  1
  Ni  Ni168  1  0.226274  0.548378  0.398666  1
  Ni  Ni169  1  0.244798  0.830899  0.354410  1
  Ni  Ni170  1  0.863007  0.645359  0.393428  1
  Ni  Ni171  1  0.507731  0.013433  0.407352  1
  Ni  Ni172  1  0.888656  0.197536  0.368439  1
  Ni  Ni173  1  0.579429  0.178248  0.384697  1
  Ni  Ni174  1  0.961794  0.364459  0.345694  1
  Ni  Ni175  1  0.422106  0.136788  0.379593  1
  Ni  Ni176  1  0.803572  0.318885  0.341557  1
  Ni  Ni177  1  0.666370  0.056339  0.412743  1
  Ni  Ni178  1  0.047581  0.242816  0.374160  1
  Ni  Ni179  1  0.502458  0.085538  0.342722  1
  Ni  Ni180  1  0.123882  0.899426  0.382397  1
  Ni  Ni181  1  0.972087  0.820569  0.453786  1
  Ni  Ni182  1  0.353822  0.004774  0.415321  1
  Ni  Ni183  1  0.926762  1.001600  0.448853  1
  Ni  Ni184  1  0.545620  0.817605  0.487725  1
  Ni  Ni185  1  0.399066  0.823483  0.420302  1
  Ni  Ni186  1  0.017950  0.639364  0.459085  1
  Ni  Ni187  1  0.987572  0.119867  0.490904  1
  Ni  Ni188  1  0.368400  0.304233  0.452265  1
  Ni  Ni189  1  0.575546  0.336841  0.456301  1
  Ni  Ni190  1  0.957035  0.520348  0.417562  1
  Ni  Ni191  1  0.659256  0.981445  0.472036  1
  Ni  Ni192  1  0.040653  0.166354  0.433366  1
  Ni  Ni193  1  0.904087  0.475133  0.474797  1
  Ni  Ni194  1  0.285479  0.659485  0.436126  1
  Ni  Ni195  1  0.583522  0.108903  0.448253  1
  Ni  Ni196  1  0.202599  0.924731  0.486745  1
  Ni  Ni197  1  0.060352  0.799635  0.491200  1
  Ni  Ni198  1  0.441805  0.983482  0.452736  1
  Ni  Ni199  1  0.502854  0.657420  0.455509  1
  Ni  Ni200  1  0.883748  0.841386  0.416221  1
  Ni  Ni201  1  0.818771  0.299525  0.491378  1
  Ni  Ni202  1  0.200124  0.483780  0.452807  1
  Ni  Ni203  1  0.744813  0.156948  0.455687  1
  Ni  Ni204  1  0.126035  0.342724  0.416915  1
  Ni  Ni205  1  0.743806  0.424850  0.464066  1
  Ni  Ni206  1  0.125353  0.608257  0.425146  1
  Ni  Ni207  1  0.819522  0.031884  0.482871  1
  Ni  Ni208  1  0.200716  0.217122  0.444414  1
  Ni  Ni209  1  0.843716  0.362343  0.437541  1
  Ni  Ni210  1  0.462785  0.179168  0.476279  1
  Ni  Ni211  1  0.480996  0.461979  0.432347  1
  Ni  Ni212  1  0.100241  0.277766  0.471021  1
  Ni  Ni213  1  0.745463  0.645525  0.484700  1
  Ni  Ni214  1  0.126754  0.829563  0.445812  1
  Ni  Ni215  1  0.817994  0.810932  0.462037  1
  Ni  Ni216  1  0.199414  0.995134  0.423445  1
  Ni  Ni217  1  0.659579  0.767276  0.456883  1
  Ni  Ni218  1  0.040754  0.951578  0.418070  1
  Ni  Ni219  1  0.903972  0.689271  0.489787  1
  Ni  Ni220  1  0.285379  0.873352  0.451140  1
  Ni  Ni221  1  0.742418  0.714789  0.421037  1
  Ni  Ni222  1  0.360768  0.532452  0.460150  1
  Ni  Ni223  1  0.210087  0.452292  0.531957  1
  Ni  Ni224  1  0.591051  0.636451  0.492849  1
  Ni  Ni225  1  0.164150  0.633577  0.526600  1
  Ni  Ni226  1  0.783198  0.449168  0.565420  1
  Ni  Ni227  1  0.636490  0.455304  0.498004  1
  Ni  Ni228  1  0.255260  0.271397  0.536986  1
  Ni  Ni229  1  0.225229  0.752740  0.568107  1
  Ni  Ni230  1  0.606529  0.935976  0.529464  1
  Ni  Ni231  1  0.813682  0.968585  0.533508  1
  Ni  Ni232  1  0.194613  0.153128  0.494849  1
  Ni  Ni233  1  0.896679  0.613265  0.549614  1
  Ni  Ni234  1  0.278002  0.797868  0.510916  1
  Ni  Ni235  1  0.141513  0.106702  0.552452  1
  Ni  Ni236  1  0.522768  0.291568  0.513738  1
  Ni  Ni237  1  0.821336  0.740314  0.525576  1
  Ni  Ni238  1  0.439522  0.558118  0.564720  1
  Ni  Ni239  1  0.298362  0.431568  0.569657  1
  Ni  Ni240  1  0.679156  0.615413  0.530211  1
  Ni  Ni241  1  0.740457  0.289331  0.533063  1
  Ni  Ni242  1  0.121791  0.473263  0.494534  1
  Ni  Ni243  1  0.056129  0.929960  0.568809  1
  Ni  Ni244  1  0.437223  0.116348  0.530107  1
  Ni  Ni245  1  0.981972  0.789054  0.532900  1
  Ni  Ni246  1  0.363403  0.973484  0.494425  1
  Ni  Ni247  1  0.981518  0.055774  0.541367  1
  Ni  Ni248  1  0.362558  0.241236  0.502936  1
  Ni  Ni249  1  0.056781  0.664642  0.560512  1
  Ni  Ni250  1  0.438361  0.847961  0.521675  1
  Ni  Ni251  1  0.081931  0.995259  0.514743  1
  Ni  Ni252  1  0.700918  0.810758  0.553454  1
  Ni  Ni253  1  0.719289  0.093737  0.509498  1
  Ni  Ni254  1  0.338509  0.910924  0.548158  1
  Ni  Ni255  1  0.982964  0.277813  0.562390  1
  Ni  Ni256  1  0.364073  0.462000  0.523742  1
  Ni  Ni257  1  0.055300  0.443304  0.539888  1
  Ni  Ni258  1  0.436641  0.627301  0.501023  1
  Ni  Ni259  1  0.896827  0.399424  0.534612  1
  Ni  Ni260  1  0.278122  0.583640  0.495930  1
  Ni  Ni261  1  0.141313  0.321668  0.567783  1
  Ni  Ni262  1  0.522457  0.505577  0.528851  1
  Ni  Ni263  1  0.979549  0.348233  0.498980  1
  Ni  Ni264  1  0.598589  0.164047  0.537511  1
  Ni  Ni265  1  0.447109  0.085814  0.608455  1
  Ni  Ni266  1  0.828672  0.268046  0.570498  1
  Ni  Ni267  1  0.401668  0.267908  0.604054  1
  Ni  Ni268  1  0.022715  0.079320  0.642743  1
  Ni  Ni269  1  0.874343  0.087098  0.575345  1
  Ni  Ni270  1  0.493090  0.904591  0.613464  1
  Ni  Ni271  1  0.462883  0.385854  0.646019  1
  Ni  Ni272  1  0.842442  0.565950  0.607407  1
  Ni  Ni273  1  0.050656  0.598636  0.611513  1
  Ni  Ni274  1  0.432281  0.785033  0.572224  1
  Ni  Ni275  1  0.134631  0.247207  0.627145  1
  Ni  Ni276  1  0.514561  0.430706  0.588486  1
  Ni  Ni277  1  0.377884  0.740439  0.629232  1
  Ni  Ni278  1  0.760109  0.923127  0.590713  1
  Ni  Ni279  1  0.058618  0.374397  0.603620  1
  Ni  Ni280  1  0.679640  0.187406  0.642986  1
  Ni  Ni281  1  0.535390  0.064321  0.645577  1
  Ni  Ni282  1  0.916416  0.246809  0.607855  1
  Ni  Ni283  1  0.979083  0.919303  0.610849  1
  Ni  Ni284  1  0.358395  0.106598  0.571646  1
  Ni  Ni285  1  0.290550  0.567133  0.647212  1
  Ni  Ni286  1  0.674161  0.748283  0.607449  1
  Ni  Ni287  1  0.218990  0.426406  0.611383  1
  Ni  Ni288  1  0.600318  0.605672  0.571941  1
  Ni  Ni289  1  0.217726  0.685452  0.618531  1
  Ni  Ni290  1  0.600149  0.872259  0.579757  1
  Ni  Ni291  1  0.295485  0.298305  0.637627  1
  Ni  Ni292  1  0.675760  0.479322  0.599116  1
  Ni  Ni293  1  0.319413  0.628038  0.592069  1
  Ni  Ni294  1  0.937249  0.441892  0.631227  1
  Ni  Ni295  1  0.955974  0.724337  0.587000  1
  Ni  Ni296  1  0.576585  0.543996  0.625114  1
  Ni  Ni297  1  0.220407  0.908144  0.640144  1
  Ni  Ni298  1  0.602526  0.094566  0.601019  1
  Ni  Ni299  1  0.293358  0.075194  0.617300  1
  Ni  Ni300  1  0.674431  0.259271  0.578379  1
  Ni  Ni301  1  0.134668  0.029762  0.611610  1
  Ni  Ni302  1  0.515509  0.216848  0.573022  1
  Ni  Ni303  1  0.378379  0.953943  0.644260  1
  Ni  Ni304  1  0.760111  0.135998  0.606162  1
  Ni  Ni305  1  0.217285  0.979440  0.576191  1
  Ni  Ni306  1  0.835404  0.798103  0.614897  1
  Ni  Ni307  1  0.690286  0.724845  0.688649  1
  Ni  Ni308  1  0.069061  0.902006  0.648807  1
  Ni  Ni309  1  0.641159  0.894730  0.681466  1
  Ni  Ni310  1  0.251210  0.734092  0.717922  1
  Ni  Ni311  1  0.112862  0.720279  0.652737  1
  Ni  Ni312  1  0.729188  0.537859  0.691178  1
  Ni  Ni313  1  0.699372  0.008033  0.719893  1
  Ni  Ni314  1  0.087313  0.201453  0.682489  1
  Ni  Ni315  1  0.290606  0.240715  0.685653  1
  Ni  Ni316  1  0.669936  0.421266  0.649132  1
  Ni  Ni317  1  0.372541  0.887154  0.706045  1
  Ni  Ni318  1  0.754465  0.052995  0.666123  1
  Ni  Ni319  1  0.608716  0.382768  0.707911  1
  Ni  Ni320  1  0.994964  0.558105  0.667281  1
  Ni  Ni321  1  0.296097  1.002905  0.679983  1
  Ni  Ni322  1  0.927079  0.802778  0.718091  1
  Ni  Ni323  1  0.781046  0.690910  0.723548  1
  Ni  Ni324  1  0.157108  0.877748  0.687264  1
  Ni  Ni325  1  0.219742  0.552381  0.691200  1
  Ni  Ni326  1  0.598623  0.735427  0.650517  1
  Ni  Ni327  1  0.524062  0.191868  0.716184  1
  Ni  Ni328  1  0.908038  0.379825  0.683057  1
  Ni  Ni329  1  0.455559  0.050299  0.685657  1
  Ni  Ni330  1  0.836884  0.233848  0.650845  1
  Ni  Ni331  1  0.451013  0.320313  0.694657  1
  Ni  Ni332  1  0.834685  0.503848  0.657308  1
  Ni  Ni333  1  0.528545  0.923959  0.712682  1
  Ni  Ni334  1  0.913443  0.100645  0.674652  1
  Ni  Ni335  1  0.561716  0.263622  0.669826  1
  Ni  Ni336  1  0.186074  0.087203  0.707185  1
  Ni  Ni337  1  0.197470  0.363520  0.664283  1
  Ni  Ni338  1  0.813601  0.172391  0.699846  1
  Ni  Ni339  1  0.467710  0.525058  0.715569  1
  Ni  Ni340  1  0.841281  0.721668  0.679106  1
  Ni  Ni341  1  0.534169  0.711699  0.696840  1
  Ni  Ni342  1  0.913390  0.892777  0.657225  1
  Ni  Ni343  1  0.377270  0.672616  0.695587  1
  Ni  Ni344  1  0.757149  0.847568  0.651801  1
  Ni  Ni345  1  0.622908  0.591978  0.721880  1
  Ni  Ni346  1  0.998996  0.766742  0.681764  1
  Ni  Ni347  1  0.450857  0.621097  0.655986  1
  Ni  Ni348  1  0.067496  0.430817  0.692902  1
