# generated using pymatgen
data_Zr95Ni252
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   19.62823613
_cell_length_b   15.55429977
_cell_length_c   17.58058490
_cell_angle_alpha   93.70174697
_cell_angle_beta   111.73606814
_cell_angle_gamma   104.67480356
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr95Ni252
_chemical_formula_sum   'Zr95 Ni252'
_cell_volume   4747.64225622
_cell_formula_units_Z   1
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  0.266165  0.453088  0.117691  1
  Zr  Zr2  1  0.272091  0.487129  0.617092  1
  Zr  Zr3  1  0.265199  0.952815  0.117867  1
  Zr  Zr4  1  0.272659  0.988178  0.618475  1
  Zr  Zr5  1  0.607480  0.481932  0.126250  1
  Zr  Zr6  1  0.601043  0.480792  0.617889  1
  Zr  Zr7  1  0.608029  0.982099  0.126542  1
  Zr  Zr8  1  0.601644  0.980622  0.618755  1
  Zr  Zr9  1  0.933791  0.511699  0.118268  1
  Zr  Zr10  1  0.942105  0.490170  0.632969  1
  Zr  Zr11  1  0.937773  0.012920  0.119454  1
  Zr  Zr12  1  0.942504  0.990327  0.633150  1
  Zr  Zr13  1  0.063553  0.011096  0.383771  1
  Zr  Zr14  1  0.068776  0.051044  0.883732  1
  Zr  Zr15  1  0.061137  0.513475  0.381664  1
  Zr  Zr16  1  0.067562  0.549776  0.881152  1
  Zr  Zr17  1  0.391537  0.011563  0.366580  1
  Zr  Zr18  1  0.399962  0.990414  0.881545  1
  Zr  Zr19  1  0.390490  0.509864  0.365035  1
  Zr  Zr20  1  0.399973  0.490484  0.880374  1
  Zr  Zr21  1  0.732811  0.020289  0.381632  1
  Zr  Zr22  1  0.727266  0.020341  0.873883  1
  Zr  Zr23  1  0.732156  0.520621  0.380931  1
  Zr  Zr24  1  0.726104  0.519987  0.872688  1
  Zr  Zr25  1  0.263888  0.212011  0.274819  1
  Zr  Zr26  1  0.291124  0.191542  0.791433  1
  Zr  Zr27  1  0.276317  0.722198  0.283576  1
  Zr  Zr28  1  0.291401  0.691888  0.791271  1
  Zr  Zr29  1  0.619134  0.224255  0.291259  1
  Zr  Zr30  1  0.609859  0.212275  0.791862  1
  Zr  Zr31  1  0.619047  0.724336  0.291680  1
  Zr  Zr32  1  0.610351  0.712450  0.791768  1
  Zr  Zr33  1  0.947710  0.214939  0.297410  1
  Zr  Zr34  1  0.951319  0.256576  0.794260  1
  Zr  Zr35  1  0.947003  0.715588  0.297617  1
  Zr  Zr36  1  0.951527  0.758184  0.794819  1
  Zr  Zr37  1  0.043616  0.310067  0.208922  1
  Zr  Zr38  1  0.057060  0.280136  0.715456  1
  Zr  Zr39  1  0.043876  0.810779  0.208833  1
  Zr  Zr40  1  0.057157  0.780029  0.715870  1
  Zr  Zr41  1  0.381917  0.245361  0.207383  1
  Zr  Zr42  1  0.386908  0.285873  0.701710  1
  Zr  Zr43  1  0.383116  0.746113  0.205937  1
  Zr  Zr44  1  0.386704  0.785564  0.701435  1
  Zr  Zr45  1  0.723472  0.289449  0.207588  1
  Zr  Zr46  1  0.714004  0.276756  0.707971  1
  Zr  Zr47  1  0.723504  0.789528  0.207890  1
  Zr  Zr48  1  0.714798  0.776411  0.708453  1
  Zr  Zr49  1  0.096457  0.315788  0.017685  1
  Zr  Zr50  1  0.097362  0.278844  0.519536  1
  Zr  Zr51  1  0.096405  0.816157  0.018471  1
  Zr  Zr52  1  0.097780  0.779329  0.521833  1
  Zr  Zr53  1  0.432821  0.255435  0.021081  1
  Zr  Zr54  1  0.426653  0.279691  0.510340  1
  Zr  Zr55  1  0.433396  0.755738  0.021279  1
  Zr  Zr56  1  0.427300  0.779813  0.511165  1
  Zr  Zr57  1  0.763568  0.285095  0.017936  1
  Zr  Zr58  1  0.764829  0.280801  0.522596  1
  Zr  Zr59  1  0.763379  0.785338  0.018036  1
  Zr  Zr60  1  0.765584  0.780838  0.523315  1
  Zr  Zr61  1  0.234725  0.220422  0.476596  1
  Zr  Zr62  1  0.237523  0.187035  0.982230  1
  Zr  Zr63  1  0.236271  0.721468  0.478220  1
  Zr  Zr64  1  0.237970  0.686467  0.980819  1
  Zr  Zr65  1  0.567848  0.220335  0.475978  1
  Zr  Zr66  1  0.571382  0.216693  0.982141  1
  Zr  Zr67  1  0.568470  0.720456  0.476512  1
  Zr  Zr68  1  0.571413  0.716946  0.982075  1
  Zr  Zr69  1  0.906736  0.220448  0.488105  1
  Zr  Zr70  1  0.900837  0.246644  0.977469  1
  Zr  Zr71  1  0.906526  0.721236  0.488606  1
  Zr  Zr72  1  0.900757  0.746475  0.977766  1
  Zr  Zr73  1  0.129035  0.048620  0.657865  1
  Zr  Zr74  1  0.121958  0.587182  0.155103  1
  Zr  Zr75  1  0.128718  0.547996  0.656444  1
  Zr  Zr76  1  0.459702  0.019564  0.153716  1
  Zr  Zr77  1  0.455890  0.049103  0.644120  1
  Zr  Zr78  1  0.459513  0.519110  0.153416  1
  Zr  Zr79  1  0.455608  0.549198  0.643018  1
  Zr  Zr80  1  0.794989  0.055282  0.151787  1
  Zr  Zr81  1  0.792055  0.042277  0.655555  1
  Zr  Zr82  1  0.793201  0.555409  0.150545  1
  Zr  Zr83  1  0.791589  0.542159  0.654755  1
  Zr  Zr84  1  0.205112  0.454003  0.341936  1
  Zr  Zr85  1  0.212101  0.415008  0.844189  1
  Zr  Zr86  1  0.205331  0.952287  0.342915  1
  Zr  Zr87  1  0.211931  0.915478  0.844999  1
  Zr  Zr88  1  0.541294  0.458659  0.344205  1
  Zr  Zr89  1  0.540628  0.446351  0.848837  1
  Zr  Zr90  1  0.541958  0.959050  0.344388  1
  Zr  Zr91  1  0.541149  0.946411  0.849152  1
  Zr  Zr92  1  0.877697  0.452073  0.355917  1
  Zr  Zr93  1  0.874039  0.483023  0.845586  1
  Zr  Zr94  1  0.879627  0.953082  0.353287  1
  Zr  Zr95  1  0.874861  0.983498  0.847233  1
  Ni  Ni96  1  1.000212  0.034907  0.001708  1
  Ni  Ni97  1  0.002345  0.999663  0.508665  1
  Ni  Ni98  1  0.999428  0.534535  0.999222  1
  Ni  Ni99  1  0.001770  0.499814  0.508476  1
  Ni  Ni100  1  0.334051  0.968563  0.001617  1
  Ni  Ni101  1  0.331929  0.002011  0.490743  1
  Ni  Ni102  1  0.334693  0.467870  0.000552  1
  Ni  Ni103  1  0.331274  0.499639  0.489682  1
  Ni  Ni104  1  0.668070  0.001214  0.000534  1
  Ni  Ni105  1  0.667055  1.000496  0.500151  1
  Ni  Ni106  1  0.666895  0.500987  0.999545  1
  Ni  Ni107  1  0.666732  0.500770  0.499595  1
  Ni  Ni108  1  0.016402  0.404251  0.077510  1
  Ni  Ni109  1  0.023450  0.373319  0.585153  1
  Ni  Ni110  1  0.015606  0.901345  0.077655  1
  Ni  Ni111  1  0.023397  0.873630  0.585998  1
  Ni  Ni112  1  0.354144  0.344041  0.077816  1
  Ni  Ni113  1  0.351887  0.374790  0.570156  1
  Ni  Ni114  1  0.353952  0.843967  0.077972  1
  Ni  Ni115  1  0.352511  0.876023  0.571291  1
  Ni  Ni116  1  0.687414  0.375936  0.078486  1
  Ni  Ni117  1  0.685583  0.372889  0.578035  1
  Ni  Ni118  1  0.688243  0.876031  0.079247  1
  Ni  Ni119  1  0.686304  0.872552  0.578648  1
  Ni  Ni120  1  0.309736  0.128066  0.413223  1
  Ni  Ni121  1  0.317126  0.097679  0.922593  1
  Ni  Ni122  1  0.310106  0.627137  0.413497  1
  Ni  Ni123  1  0.317856  0.597780  0.921635  1
  Ni  Ni124  1  0.648077  0.128177  0.421387  1
  Ni  Ni125  1  0.647215  0.126025  0.921244  1
  Ni  Ni126  1  0.647740  0.628523  0.421210  1
  Ni  Ni127  1  0.646885  0.626334  0.920921  1
  Ni  Ni128  1  0.982177  0.124740  0.427463  1
  Ni  Ni129  1  0.981150  0.157206  0.922432  1
  Ni  Ni130  1  0.981346  0.625721  0.428395  1
  Ni  Ni131  1  0.980125  0.657207  0.921107  1
  Ni  Ni132  1  0.051868  0.477287  0.232427  1
  Ni  Ni133  1  0.065957  0.446526  0.741588  1
  Ni  Ni134  1  0.056079  0.980643  0.232161  1
  Ni  Ni135  1  0.066094  0.946697  0.742271  1
  Ni  Ni136  1  0.388055  0.412040  0.230690  1
  Ni  Ni137  1  0.395233  0.453650  0.729874  1
  Ni  Ni138  1  0.387843  0.913214  0.231360  1
  Ni  Ni139  1  0.395180  0.953581  0.730994  1
  Ni  Ni140  1  0.736655  0.457148  0.239865  1
  Ni  Ni141  1  0.720115  0.441430  0.733210  1
  Ni  Ni142  1  0.736683  0.957253  0.240233  1
  Ni  Ni143  1  0.720999  0.941288  0.733973  1
  Ni  Ni144  1  0.271103  0.054359  0.259809  1
  Ni  Ni145  1  0.281112  0.024551  0.767383  1
  Ni  Ni146  1  0.267957  0.556125  0.256914  1
  Ni  Ni147  1  0.280600  0.524156  0.766043  1
  Ni  Ni148  1  0.614010  0.059684  0.266257  1
  Ni  Ni149  1  0.597400  0.044603  0.759858  1
  Ni  Ni150  1  0.613178  0.559792  0.265947  1
  Ni  Ni151  1  0.596415  0.544129  0.759046  1
  Ni  Ni152  1  0.950590  0.051040  0.269156  1
  Ni  Ni153  1  0.945381  0.089364  0.768594  1
  Ni  Ni154  1  0.938369  0.547455  0.268980  1
  Ni  Ni155  1  0.944541  0.590338  0.767443  1
  Ni  Ni156  1  0.247601  0.281819  0.120620  1
  Ni  Ni157  1  0.247987  0.311893  0.619220  1
  Ni  Ni158  1  0.246290  0.779321  0.120887  1
  Ni  Ni159  1  0.248244  0.812828  0.620121  1
  Ni  Ni160  1  0.580687  0.303749  0.126331  1
  Ni  Ni161  1  0.577946  0.307106  0.620431  1
  Ni  Ni162  1  0.580893  0.803777  0.126697  1
  Ni  Ni163  1  0.578867  0.807357  0.621529  1
  Ni  Ni164  1  0.911026  0.334971  0.121538  1
  Ni  Ni165  1  0.915826  0.315740  0.632943  1
  Ni  Ni166  1  0.910535  0.837227  0.121185  1
  Ni  Ni167  1  0.916149  0.816659  0.634040  1
  Ni  Ni168  1  0.083499  0.184462  0.374190  1
  Ni  Ni169  1  0.087960  0.223168  0.878381  1
  Ni  Ni170  1  0.085575  0.688191  0.379608  1
  Ni  Ni171  1  0.087754  0.722774  0.878204  1
  Ni  Ni172  1  0.414873  0.184826  0.364131  1
  Ni  Ni173  1  0.424052  0.165595  0.878804  1
  Ni  Ni174  1  0.417425  0.684976  0.365975  1
  Ni  Ni175  1  0.424502  0.666118  0.878512  1
  Ni  Ni176  1  0.755118  0.193974  0.378166  1
  Ni  Ni177  1  0.753111  0.198693  0.872424  1
  Ni  Ni178  1  0.755174  0.694432  0.378308  1
  Ni  Ni179  1  0.753466  0.698436  0.872880  1
  Ni  Ni180  1  0.238139  0.111418  0.122309  1
  Ni  Ni181  1  0.247598  0.149206  0.624667  1
  Ni  Ni182  1  0.242020  0.612670  0.119608  1
  Ni  Ni183  1  0.247559  0.648863  0.624240  1
  Ni  Ni184  1  0.582606  0.140846  0.131431  1
  Ni  Ni185  1  0.577252  0.141837  0.625730  1
  Ni  Ni186  1  0.582598  0.640971  0.131560  1
  Ni  Ni187  1  0.576846  0.642559  0.624990  1
  Ni  Ni188  1  0.911519  0.172829  0.126996  1
  Ni  Ni189  1  0.914669  0.151652  0.633189  1
  Ni  Ni190  1  0.910578  0.674444  0.126475  1
  Ni  Ni191  1  0.914367  0.652616  0.633122  1
  Ni  Ni192  1  0.013129  0.182975  0.075963  1
  Ni  Ni193  1  0.021782  0.149864  0.585188  1
  Ni  Ni194  1  0.014108  0.680963  0.077133  1
  Ni  Ni195  1  0.021625  0.649576  0.585843  1
  Ni  Ni196  1  0.348718  0.117276  0.076036  1
  Ni  Ni197  1  0.350195  0.150839  0.572354  1
  Ni  Ni198  1  0.350221  0.616526  0.074704  1
  Ni  Ni199  1  0.349971  0.649343  0.571476  1
  Ni  Ni200  1  0.686045  0.151044  0.078900  1
  Ni  Ni201  1  0.681763  0.148552  0.576351  1
  Ni  Ni202  1  0.685675  0.651384  0.078865  1
  Ni  Ni203  1  0.681908  0.648533  0.576456  1
  Ni  Ni204  1  0.311157  0.347817  0.411377  1
  Ni  Ni205  1  0.319917  0.321842  0.921849  1
  Ni  Ni206  1  0.312193  0.851436  0.413866  1
  Ni  Ni207  1  0.319979  0.822330  0.922453  1
  Ni  Ni208  1  0.651147  0.352731  0.422830  1
  Ni  Ni209  1  0.648488  0.350368  0.920646  1
  Ni  Ni210  1  0.652439  0.852933  0.423382  1
  Ni  Ni211  1  0.649030  0.850882  0.921337  1
  Ni  Ni212  1  0.983394  0.350728  0.427211  1
  Ni  Ni213  1  0.983773  0.387052  0.924092  1
  Ni  Ni214  1  0.983863  0.850052  0.428055  1
  Ni  Ni215  1  0.984760  0.888291  0.926311  1
  Ni  Ni216  1  0.170567  0.277836  0.324162  1
  Ni  Ni217  1  0.185090  0.237047  0.826285  1
  Ni  Ni218  1  0.169756  0.773546  0.321229  1
  Ni  Ni219  1  0.185225  0.737001  0.826583  1
  Ni  Ni220  1  0.514915  0.285114  0.323107  1
  Ni  Ni221  1  0.507594  0.265463  0.824663  1
  Ni  Ni222  1  0.515012  0.784915  0.323614  1
  Ni  Ni223  1  0.507934  0.765921  0.824656  1
  Ni  Ni224  1  0.845498  0.275909  0.330162  1
  Ni  Ni225  1  0.845907  0.306840  0.824510  1
  Ni  Ni226  1  0.845796  0.776763  0.330619  1
  Ni  Ni227  1  0.846485  0.807374  0.825614  1
  Ni  Ni228  1  0.147904  0.261604  0.171634  1
  Ni  Ni229  1  0.163809  0.226892  0.677534  1
  Ni  Ni230  1  0.148252  0.768066  0.171840  1
  Ni  Ni231  1  0.164015  0.726688  0.678012  1
  Ni  Ni232  1  0.487922  0.196278  0.174016  1
  Ni  Ni233  1  0.488137  0.225034  0.668531  1
  Ni  Ni234  1  0.487931  0.695886  0.174303  1
  Ni  Ni235  1  0.488366  0.725187  0.669191  1
  Ni  Ni236  1  0.826171  0.235960  0.175033  1
  Ni  Ni237  1  0.819026  0.216224  0.676351  1
  Ni  Ni238  1  0.826208  0.736732  0.175501  1
  Ni  Ni239  1  0.819169  0.715822  0.676997  1
  Ni  Ni240  1  0.169270  0.108717  0.328080  1
  Ni  Ni241  1  0.182203  0.073477  0.827374  1
  Ni  Ni242  1  0.168428  0.610689  0.326595  1
  Ni  Ni243  1  0.182610  0.572839  0.825544  1
  Ni  Ni244  1  0.509047  0.117721  0.319158  1
  Ni  Ni245  1  0.505967  0.097629  0.826597  1
  Ni  Ni246  1  0.508420  0.616701  0.319033  1
  Ni  Ni247  1  0.505791  0.598020  0.825723  1
  Ni  Ni248  1  0.842788  0.107738  0.333668  1
  Ni  Ni249  1  0.841029  0.138836  0.818887  1
  Ni  Ni250  1  0.842642  0.607763  0.333063  1
  Ni  Ni251  1  0.840832  0.639004  0.818561  1
  Ni  Ni252  1  0.151587  0.427739  0.173288  1
  Ni  Ni253  1  0.164956  0.389878  0.671912  1
  Ni  Ni254  1  0.151127  0.937833  0.174921  1
  Ni  Ni255  1  0.165175  0.890582  0.673250  1
  Ni  Ni256  1  0.492996  0.363541  0.180271  1
  Ni  Ni257  1  0.490506  0.393557  0.665110  1
  Ni  Ni258  1  0.493303  0.864000  0.180464  1
  Ni  Ni259  1  0.491381  0.893867  0.666864  1
  Ni  Ni260  1  0.828332  0.403741  0.173069  1
  Ni  Ni261  1  0.824538  0.383653  0.680514  1
  Ni  Ni262  1  0.830446  0.905368  0.174592  1
  Ni  Ni263  1  0.825341  0.883878  0.681676  1
  Ni  Ni264  1  0.056975  0.147253  0.227687  1
  Ni  Ni265  1  0.063586  0.122721  0.741760  1
  Ni  Ni266  1  0.044697  0.645754  0.232309  1
  Ni  Ni267  1  0.063910  0.622427  0.742140  1
  Ni  Ni268  1  0.379956  0.087516  0.225055  1
  Ni  Ni269  1  0.390200  0.125277  0.729349  1
  Ni  Ni270  1  0.380126  0.588708  0.225179  1
  Ni  Ni271  1  0.389669  0.624772  0.728606  1
  Ni  Ni272  1  0.728550  0.129866  0.233347  1
  Ni  Ni273  1  0.711496  0.115875  0.728450  1
  Ni  Ni274  1  0.728041  0.629874  0.233511  1
  Ni  Ni275  1  0.711020  0.615302  0.728501  1
  Ni  Ni276  1  0.268804  0.375455  0.256673  1
  Ni  Ni277  1  0.288574  0.355167  0.766642  1
  Ni  Ni278  1  0.268463  0.880142  0.256327  1
  Ni  Ni279  1  0.288404  0.855525  0.767445  1
  Ni  Ni280  1  0.621994  0.385398  0.270907  1
  Ni  Ni281  1  0.605135  0.371594  0.765559  1
  Ni  Ni282  1  0.622489  0.885499  0.271175  1
  Ni  Ni283  1  0.606344  0.872074  0.766501  1
  Ni  Ni284  1  0.943440  0.376351  0.270751  1
  Ni  Ni285  1  0.953739  0.414083  0.773302  1
  Ni  Ni286  1  0.947217  0.877274  0.270519  1
  Ni  Ni287  1  0.954802  0.915904  0.775216  1
  Ni  Ni288  1  0.212848  0.050332  0.478587  1
  Ni  Ni289  1  0.212494  0.013518  0.973580  1
  Ni  Ni290  1  0.211963  0.549986  0.477585  1
  Ni  Ni291  1  0.213726  0.513209  0.971994  1
  Ni  Ni292  1  0.545611  0.049610  0.478776  1
  Ni  Ni293  1  0.549119  0.045953  0.985013  1
  Ni  Ni294  1  0.545320  0.549876  0.478469  1
  Ni  Ni295  1  0.549152  0.546200  0.984601  1
  Ni  Ni296  1  0.883378  0.050026  0.488772  1
  Ni  Ni297  1  0.879099  0.075406  0.982733  1
  Ni  Ni298  1  0.883005  0.550745  0.489525  1
  Ni  Ni299  1  0.877569  0.575265  0.980716  1
  Ni  Ni300  1  0.120249  0.489569  0.026916  1
  Ni  Ni301  1  0.121417  0.450153  0.521054  1
  Ni  Ni302  1  0.119703  0.991146  0.030804  1
  Ni  Ni303  1  0.122294  0.950052  0.523484  1
  Ni  Ni304  1  0.456459  0.427004  0.018194  1
  Ni  Ni305  1  0.449676  0.449477  0.508363  1
  Ni  Ni306  1  0.456431  0.927204  0.019199  1
  Ni  Ni307  1  0.450613  0.950729  0.510087  1
  Ni  Ni308  1  0.784705  0.455895  0.014337  1
  Ni  Ni309  1  0.787909  0.451429  0.520504  1
  Ni  Ni310  1  0.786644  0.956465  0.015948  1
  Ni  Ni311  1  0.788595  0.951837  0.521682  1
  Ni  Ni312  1  0.214241  0.377579  0.474971  1
  Ni  Ni313  1  0.213655  0.341166  0.972648  1
  Ni  Ni314  1  0.214244  0.878372  0.476396  1
  Ni  Ni315  1  0.213493  0.840886  0.973313  1
  Ni  Ni316  1  0.545696  0.376927  0.472815  1
  Ni  Ni317  1  0.550536  0.372849  0.981415  1
  Ni  Ni318  1  0.547112  0.876961  0.474140  1
  Ni  Ni319  1  0.551098  0.873286  0.982014  1
  Ni  Ni320  1  0.882971  0.375894  0.486665  1
  Ni  Ni321  1  0.879520  0.403508  0.974984  1
  Ni  Ni322  1  0.883312  0.876912  0.486354  1
  Ni  Ni323  1  0.880175  0.903875  0.975938  1
  Ni  Ni324  1  0.121353  0.159940  0.033948  1
  Ni  Ni325  1  0.120001  0.122912  0.523397  1
  Ni  Ni326  1  0.120542  0.661173  0.026234  1
  Ni  Ni327  1  0.119672  0.622926  0.523536  1
  Ni  Ni328  1  0.453989  0.098797  0.024797  1
  Ni  Ni329  1  0.451004  0.125330  0.513174  1
  Ni  Ni330  1  0.454555  0.598604  0.024254  1
  Ni  Ni331  1  0.449896  0.623430  0.511435  1
  Ni  Ni332  1  0.784596  0.129261  0.018644  1
  Ni  Ni333  1  0.787079  0.124286  0.525937  1
  Ni  Ni334  1  0.783510  0.628824  0.017793  1
  Ni  Ni335  1  0.786740  0.624240  0.525652  1
  Ni  Ni336  1  0.086158  0.351956  0.375068  1
  Ni  Ni337  1  0.091931  0.390534  0.878687  1
  Ni  Ni338  1  0.086564  0.850382  0.375401  1
  Ni  Ni339  1  0.092246  0.890836  0.880671  1
  Ni  Ni340  1  0.416492  0.346841  0.364065  1
  Ni  Ni341  1  0.423474  0.328267  0.872912  1
  Ni  Ni342  1  0.419589  0.849579  0.366527  1
  Ni  Ni343  1  0.423895  0.828870  0.873492  1
  Ni  Ni344  1  0.756370  0.359087  0.374062  1
  Ni  Ni345  1  0.751336  0.361135  0.867830  1
  Ni  Ni346  1  0.757588  0.860087  0.374138  1
  Ni  Ni347  1  0.751258  0.860726  0.868181  1
