# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.53220149
_cell_length_b   12.50329495
_cell_length_c   47.98284344
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   92.13976768
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni162
_cell_volume   3916.22015688
_cell_formula_units_Z   162
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
  Ni  Ni1  1  0.550315  0.178804  0.316443  1
  Ni  Ni2  1  0.531872  0.856547  0.298749  1
  Ni  Ni3  1  0.504004  0.537840  0.283470  1
  Ni  Ni4  1  0.883648  0.845471  0.316443  1
  Ni  Ni5  1  0.865206  0.523214  0.298749  1
  Ni  Ni6  1  0.216982  0.512138  0.316443  1
  Ni  Ni7  1  0.837337  0.204507  0.283470  1
  Ni  Ni8  1  0.198539  0.189880  0.298749  1
  Ni  Ni9  1  0.170670  0.871174  0.283470  1
  Ni  Ni10  1  0.634522  0.359319  0.296442  1
  Ni  Ni11  1  0.607235  0.040720  0.280963  1
  Ni  Ni12  1  0.657971  0.680089  0.313696  1
  Ni  Ni13  1  0.967856  0.025985  0.296442  1
  Ni  Ni14  1  0.940569  0.707387  0.280963  1
  Ni  Ni15  1  0.301189  0.692652  0.296442  1
  Ni  Ni16  1  0.991305  0.346756  0.313696  1
  Ni  Ni17  1  0.273902  0.374054  0.280963  1
  Ni  Ni18  1  0.324638  0.013423  0.313696  1
  Ni  Ni19  1  0.620078  0.140946  0.366177  1
  Ni  Ni20  1  0.596321  0.820349  0.349550  1
  Ni  Ni21  1  0.575199  0.498684  0.333000  1
  Ni  Ni22  1  0.953411  0.807613  0.366177  1
  Ni  Ni23  1  0.929655  0.487016  0.349550  1
  Ni  Ni24  1  0.286745  0.474279  0.366177  1
  Ni  Ni25  1  0.908533  0.165350  0.333000  1
  Ni  Ni26  1  0.262988  0.153683  0.349550  1
  Ni  Ni27  1  0.241866  0.832017  0.333000  1
  Ni  Ni28  1  0.704071  0.321978  0.346828  1
  Ni  Ni29  1  0.681861  1.000982  0.330317  1
  Ni  Ni30  1  0.726437  0.643123  0.363506  1
  Ni  Ni31  1  0.037404  0.988644  0.346828  1
  Ni  Ni32  1  0.015194  0.667649  0.330317  1
  Ni  Ni33  1  0.370738  0.655311  0.346828  1
  Ni  Ni34  1  0.059771  0.309789  0.363506  1
  Ni  Ni35  1  0.348527  0.334315  0.330317  1
  Ni  Ni36  1  0.393104  0.976456  0.363506  1
  Ni  Ni37  1  0.689101  0.103478  0.416216  1
  Ni  Ni38  1  0.666199  0.782632  0.399545  1
  Ni  Ni39  1  0.643146  0.461714  0.382904  1
  Ni  Ni40  1  0.022434  0.770145  0.416216  1
  Ni  Ni41  1  0.999533  0.449298  0.399545  1
  Ni  Ni42  1  0.355767  0.436811  0.416216  1
  Ni  Ni43  1  0.976480  0.128381  0.382904  1
  Ni  Ni44  1  0.332866  0.115965  0.399545  1
  Ni  Ni45  1  0.309813  0.795047  0.382904  1
  Ni  Ni46  1  0.772222  0.284591  0.396868  1
  Ni  Ni47  1  0.749418  0.963769  0.380203  1
  Ni  Ni48  1  0.795098  0.605475  0.413538  1
  Ni  Ni49  1  0.105556  0.951257  0.396868  1
  Ni  Ni50  1  0.082751  0.630436  0.380203  1
  Ni  Ni51  1  0.438889  0.617924  0.396868  1
  Ni  Ni52  1  0.128431  0.272141  0.413538  1
  Ni  Ni53  1  0.416085  0.297103  0.380203  1
  Ni  Ni54  1  0.461764  0.938808  0.413538  1
  Ni  Ni55  1  0.757997  0.066048  0.466244  1
  Ni  Ni56  1  0.735061  0.745184  0.449568  1
  Ni  Ni57  1  0.712115  0.424323  0.432898  1
  Ni  Ni58  1  0.091330  0.732715  0.466244  1
  Ni  Ni59  1  0.068394  0.411851  0.449568  1
  Ni  Ni60  1  0.424663  0.399381  0.466244  1
  Ni  Ni61  1  0.045448  0.090990  0.432898  1
  Ni  Ni62  1  0.401727  0.078518  0.449568  1
  Ni  Ni63  1  0.378782  0.757657  0.432898  1
  Ni  Ni64  1  0.840950  0.247178  0.446896  1
  Ni  Ni65  1  0.818011  0.926339  0.430224  1
  Ni  Ni66  1  0.863875  0.568041  0.463573  1
  Ni  Ni67  1  0.174283  0.913844  0.446896  1
  Ni  Ni68  1  0.151344  0.593006  0.430224  1
  Ni  Ni69  1  0.507617  0.580511  0.446896  1
  Ni  Ni70  1  0.197209  0.234708  0.463573  1
  Ni  Ni71  1  0.484678  0.259672  0.430224  1
  Ni  Ni72  1  0.530542  0.901375  0.463573  1
  Ni  Ni73  1  0.826825  0.028615  0.516271  1
  Ni  Ni74  1  0.803884  0.707760  0.499595  1
  Ni  Ni75  1  0.780947  0.386900  0.482920  1
  Ni  Ni76  1  0.160158  0.695282  0.516271  1
  Ni  Ni77  1  0.137217  0.374426  0.499595  1
  Ni  Ni78  1  0.493492  0.361949  0.516271  1
  Ni  Ni79  1  0.114281  0.053567  0.482920  1
  Ni  Ni80  1  0.470551  0.041093  0.499595  1
  Ni  Ni81  1  0.447614  0.720233  0.482920  1
  Ni  Ni82  1  0.909754  0.209754  0.496925  1
  Ni  Ni83  1  0.886814  0.888899  0.480250  1
  Ni  Ni84  1  0.932691  0.530614  0.513600  1
  Ni  Ni85  1  0.243088  0.876421  0.496925  1
  Ni  Ni86  1  0.220147  0.555565  0.480250  1
  Ni  Ni87  1  0.576421  0.543088  0.496925  1
  Ni  Ni88  1  0.266024  0.197281  0.513600  1
  Ni  Ni89  1  0.553480  0.222232  0.480250  1
  Ni  Ni90  1  0.599358  0.863947  0.513600  1
  Ni  Ni91  1  0.895627  0.991175  0.566296  1
  Ni  Ni92  1  0.872689  0.670336  0.549624  1
  Ni  Ni93  1  0.849763  0.349472  0.532948  1
  Ni  Ni94  1  0.228961  0.657842  0.566296  1
  Ni  Ni95  1  0.206022  0.337003  0.549624  1
  Ni  Ni96  1  0.562294  0.324508  0.566296  1
  Ni  Ni97  1  0.183097  0.016139  0.532948  1
  Ni  Ni98  1  0.539355  0.003670  0.549624  1
  Ni  Ni99  1  0.516430  0.682806  0.532948  1
  Ni  Ni100  1  0.978578  0.172330  0.546952  1
  Ni  Ni101  1  0.955642  0.851466  0.530276  1
  Ni  Ni102  1  1.001523  0.493190  0.563622  1
  Ni  Ni103  1  0.311911  0.838996  0.546952  1
  Ni  Ni104  1  0.288975  0.518132  0.530276  1
  Ni  Ni105  1  0.645245  0.505663  0.546952  1
  Ni  Ni106  1  0.334857  0.159857  0.563622  1
  Ni  Ni107  1  0.622308  0.184799  0.530276  1
  Ni  Ni108  1  0.668190  0.826524  0.563622  1
  Ni  Ni109  1  0.964221  0.953745  0.616317  1
  Ni  Ni110  1  0.941416  0.632923  0.599652  1
  Ni  Ni111  1  0.918541  0.312039  0.582982  1
  Ni  Ni112  1  0.297554  0.620411  0.616317  1
  Ni  Ni113  1  0.274750  0.299590  0.599652  1
  Ni  Ni114  1  0.630887  0.287078  0.616317  1
  Ni  Ni115  1  0.251874  0.978706  0.582982  1
  Ni  Ni116  1  0.608083  0.966257  0.599652  1
  Ni  Ni117  1  0.585208  0.645373  0.582982  1
  Ni  Ni118  1  0.047439  0.134882  0.596975  1
  Ni  Ni119  1  0.024538  0.814036  0.580305  1
  Ni  Ni120  1  0.070492  0.455800  0.613616  1
  Ni  Ni121  1  0.380772  0.801549  0.596975  1
  Ni  Ni122  1  0.357871  0.480702  0.580305  1
  Ni  Ni123  1  0.714106  0.468215  0.596975  1
  Ni  Ni124  1  0.403826  0.122467  0.613616  1
  Ni  Ni125  1  0.691204  0.147369  0.580305  1
  Ni  Ni126  1  0.737159  0.789133  0.613616  1
  Ni  Ni127  1  0.031778  0.916532  0.666203  1
  Ni  Ni128  1  0.009568  0.595536  0.649692  1
  Ni  Ni129  1  0.987201  0.274391  0.633014  1
  Ni  Ni130  1  0.365111  0.583199  0.666203  1
  Ni  Ni131  1  0.342901  0.262203  0.649692  1
  Ni  Ni132  1  0.698445  0.249865  0.666203  1
  Ni  Ni133  1  0.320535  0.941058  0.633014  1
  Ni  Ni134  1  0.676234  0.928870  0.649692  1
  Ni  Ni135  1  0.653868  0.607724  0.633014  1
  Ni  Ni136  1  0.117317  0.097165  0.646970  1
  Ni  Ni137  1  0.093561  0.776568  0.630344  1
  Ni  Ni138  1  0.138439  0.418830  0.663520  1
  Ni  Ni139  1  0.450651  0.763831  0.646970  1
  Ni  Ni140  1  0.426894  0.443234  0.630344  1
  Ni  Ni141  1  0.783984  0.430498  0.646970  1
  Ni  Ni142  1  0.471773  0.085497  0.663520  1
  Ni  Ni143  1  0.760227  0.109901  0.630344  1
  Ni  Ni144  1  0.805106  0.752164  0.663520  1
  Ni  Ni145  1  0.106403  0.876794  0.715557  1
  Ni  Ni146  1  0.079116  0.558195  0.700078  1
  Ni  Ni147  1  0.055667  0.237425  0.682825  1
  Ni  Ni148  1  0.439737  0.543460  0.715557  1
  Ni  Ni149  1  0.412450  0.224862  0.700078  1
  Ni  Ni150  1  0.773070  0.210127  0.715557  1
  Ni  Ni151  1  0.389001  0.904091  0.682825  1
  Ni  Ni152  1  0.745783  0.891528  0.700078  1
  Ni  Ni153  1  0.722334  0.570758  0.682825  1
  Ni  Ni154  1  0.181766  0.060967  0.697771  1
  Ni  Ni155  1  0.163323  0.738710  0.680077  1
  Ni  Ni156  1  0.209635  0.379673  0.713050  1
  Ni  Ni157  1  0.515100  0.727633  0.697771  1
  Ni  Ni158  1  0.496657  0.405376  0.680077  1
  Ni  Ni159  1  0.848433  0.394300  0.697771  1
  Ni  Ni160  1  0.542968  0.046340  0.713050  1
  Ni  Ni161  1  0.829990  0.072043  0.680077  1
  Ni  Ni162  1  0.876301  0.713007  0.713050  1
