# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.53012919
_cell_length_b   12.53802778
_cell_length_c   48.01294228
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   92.13457284
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni162
_cell_volume   3928.32906656
_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  0.552404  0.181106  0.316359  1
  Ni  Ni2  1  0.535440  0.857885  0.298223  1
  Ni  Ni3  1  0.504907  0.539225  0.283557  1
  Ni  Ni4  1  0.885737  0.847773  0.316359  1
  Ni  Ni5  1  0.868773  0.524551  0.298223  1
  Ni  Ni6  1  0.219070  0.514440  0.316359  1
  Ni  Ni7  1  0.838241  0.205891  0.283557  1
  Ni  Ni8  1  0.202107  0.191218  0.298223  1
  Ni  Ni9  1  0.171574  0.872558  0.283557  1
  Ni  Ni10  1  0.632683  0.360252  0.296083  1
  Ni  Ni11  1  0.606717  0.043370  0.281612  1
  Ni  Ni12  1  0.656581  0.681044  0.313655  1
  Ni  Ni13  1  0.966016  0.026919  0.296083  1
  Ni  Ni14  1  0.940050  0.710037  0.281612  1
  Ni  Ni15  1  0.299350  0.693585  0.296083  1
  Ni  Ni16  1  0.989914  0.347711  0.313655  1
  Ni  Ni17  1  0.273384  0.376703  0.281612  1
  Ni  Ni18  1  0.323248  0.014377  0.313655  1
  Ni  Ni19  1  0.621155  0.142730  0.366100  1
  Ni  Ni20  1  0.597616  0.822022  0.349335  1
  Ni  Ni21  1  0.577199  0.499894  0.332696  1
  Ni  Ni22  1  0.954489  0.809396  0.366100  1
  Ni  Ni23  1  0.930949  0.488688  0.349335  1
  Ni  Ni24  1  0.287822  0.476063  0.366100  1
  Ni  Ni25  1  0.910532  0.166561  0.332696  1
  Ni  Ni26  1  0.264283  0.155355  0.349335  1
  Ni  Ni27  1  0.243865  0.833228  0.332696  1
  Ni  Ni28  1  0.704089  0.323568  0.346762  1
  Ni  Ni29  1  0.680924  0.002949  0.330398  1
  Ni  Ni30  1  0.726505  0.644664  0.363475  1
  Ni  Ni31  1  0.037423  0.990234  0.346762  1
  Ni  Ni32  1  0.014258  0.669615  0.330398  1
  Ni  Ni33  1  0.370756  0.656901  0.346762  1
  Ni  Ni34  1  0.059838  0.311331  0.363475  1
  Ni  Ni35  1  0.347591  0.336282  0.330398  1
  Ni  Ni36  1  0.393172  0.977998  0.363475  1
  Ni  Ni37  1  0.689699  0.105236  0.416141  1
  Ni  Ni38  1  0.666786  0.784385  0.399437  1
  Ni  Ni39  1  0.643929  0.463421  0.382773  1
  Ni  Ni40  1  0.023032  0.771903  0.416141  1
  Ni  Ni41  1  1.000119  0.451052  0.399437  1
  Ni  Ni42  1  0.356365  0.438570  0.416141  1
  Ni  Ni43  1  0.977262  0.130088  0.382773  1
  Ni  Ni44  1  0.333453  0.117719  0.399437  1
  Ni  Ni45  1  0.310596  0.796755  0.382773  1
  Ni  Ni46  1  0.772702  0.286326  0.396819  1
  Ni  Ni47  1  0.749826  0.965412  0.380169  1
  Ni  Ni48  1  0.795590  0.607214  0.413483  1
  Ni  Ni49  1  0.106036  0.952992  0.396819  1
  Ni  Ni50  1  0.083159  0.632079  0.380169  1
  Ni  Ni51  1  0.439369  0.619659  0.396819  1
  Ni  Ni52  1  0.128923  0.273881  0.413483  1
  Ni  Ni53  1  0.416493  0.298746  0.380169  1
  Ni  Ni54  1  0.462257  0.940547  0.413483  1
  Ni  Ni55  1  0.758491  0.067869  0.466175  1
  Ni  Ni56  1  0.735549  0.746988  0.449492  1
  Ni  Ni57  1  0.712643  0.426114  0.432816  1
  Ni  Ni58  1  0.091825  0.734535  0.466175  1
  Ni  Ni59  1  0.068882  0.413654  0.449492  1
  Ni  Ni60  1  0.425158  0.401202  0.466175  1
  Ni  Ni61  1  0.045977  0.092780  0.432816  1
  Ni  Ni62  1  0.402215  0.080321  0.449492  1
  Ni  Ni63  1  0.379310  0.759447  0.432816  1
  Ni  Ni64  1  0.841476  0.248971  0.446839  1
  Ni  Ni65  1  0.818537  0.928086  0.430168  1
  Ni  Ni66  1  0.864397  0.569854  0.463512  1
  Ni  Ni67  1  0.174809  0.915637  0.446839  1
  Ni  Ni68  1  0.151870  0.594753  0.430168  1
  Ni  Ni69  1  0.508142  0.582304  0.446839  1
  Ni  Ni70  1  0.197730  0.236521  0.463512  1
  Ni  Ni71  1  0.485204  0.261419  0.430168  1
  Ni  Ni72  1  0.531064  0.903187  0.463512  1
  Ni  Ni73  1  0.827297  0.030506  0.516204  1
  Ni  Ni74  1  0.804356  0.709624  0.499527  1
  Ni  Ni75  1  0.781428  0.388745  0.482851  1
  Ni  Ni76  1  0.160631  0.697172  0.516204  1
  Ni  Ni77  1  0.137690  0.376290  0.499527  1
  Ni  Ni78  1  0.493964  0.363839  0.516204  1
  Ni  Ni79  1  0.114761  0.055412  0.482851  1
  Ni  Ni80  1  0.471023  0.042957  0.499527  1
  Ni  Ni81  1  0.448094  0.722079  0.482851  1
  Ni  Ni82  1  0.910275  0.211611  0.496867  1
  Ni  Ni83  1  0.887334  0.890729  0.480190  1
  Ni  Ni84  1  0.933204  0.532489  0.513543  1
  Ni  Ni85  1  0.243608  0.878278  0.496867  1
  Ni  Ni86  1  0.220667  0.557396  0.480190  1
  Ni  Ni87  1  0.576942  0.544944  0.496867  1
  Ni  Ni88  1  0.266537  0.199156  0.513543  1
  Ni  Ni89  1  0.554001  0.224062  0.480190  1
  Ni  Ni90  1  0.599871  0.865822  0.513543  1
  Ni  Ni91  1  0.896095  0.993149  0.566226  1
  Ni  Ni92  1  0.873156  0.672264  0.549555  1
  Ni  Ni93  1  0.850234  0.351380  0.532882  1
  Ni  Ni94  1  0.229428  0.659815  0.566226  1
  Ni  Ni95  1  0.206489  0.338931  0.549555  1
  Ni  Ni96  1  0.562761  0.326482  0.566226  1
  Ni  Ni97  1  0.183568  0.018047  0.532882  1
  Ni  Ni98  1  0.539822  0.005597  0.549555  1
  Ni  Ni99  1  0.516901  0.684714  0.532882  1
  Ni  Ni100  1  0.979083  0.174247  0.546903  1
  Ni  Ni101  1  0.956140  0.853366  0.530219  1
  Ni  Ni102  1  1.001988  0.495121  0.563578  1
  Ni  Ni103  1  0.312416  0.840914  0.546903  1
  Ni  Ni104  1  0.289473  0.520033  0.530219  1
  Ni  Ni105  1  0.645750  0.507580  0.546903  1
  Ni  Ni106  1  0.335322  0.161788  0.563578  1
  Ni  Ni107  1  0.622807  0.186699  0.530219  1
  Ni  Ni108  1  0.668655  0.828454  0.563578  1
  Ni  Ni109  1  0.964805  0.955822  0.616225  1
  Ni  Ni110  1  0.941929  0.634909  0.599575  1
  Ni  Ni111  1  0.919042  0.314021  0.582911  1
  Ni  Ni112  1  0.298139  0.622489  0.616225  1
  Ni  Ni113  1  0.275263  0.301576  0.599575  1
  Ni  Ni114  1  0.631472  0.289155  0.616225  1
  Ni  Ni115  1  0.252375  0.980687  0.582911  1
  Ni  Ni116  1  0.608596  0.968242  0.599575  1
  Ni  Ni117  1  0.585708  0.647354  0.582911  1
  Ni  Ni118  1  0.047846  0.136849  0.596957  1
  Ni  Ni119  1  0.024933  0.815998  0.580253  1
  Ni  Ni120  1  0.070703  0.457813  0.613621  1
  Ni  Ni121  1  0.381179  0.803516  0.596957  1
  Ni  Ni122  1  0.358266  0.482665  0.580253  1
  Ni  Ni123  1  0.714512  0.470183  0.596957  1
  Ni  Ni124  1  0.404036  0.124480  0.613621  1
  Ni  Ni125  1  0.691599  0.149332  0.580253  1
  Ni  Ni126  1  0.737369  0.791147  0.613621  1
  Ni  Ni127  1  0.033707  0.918286  0.665996  1
  Ni  Ni128  1  0.010542  0.597667  0.649632  1
  Ni  Ni129  1  0.988126  0.276570  0.632920  1
  Ni  Ni130  1  0.367041  0.584953  0.665996  1
  Ni  Ni131  1  0.343876  0.264334  0.649632  1
  Ni  Ni132  1  0.700374  0.251619  0.665996  1
  Ni  Ni133  1  0.321460  0.943237  0.632920  1
  Ni  Ni134  1  0.677209  0.931000  0.649632  1
  Ni  Ni135  1  0.654793  0.609904  0.632920  1
  Ni  Ni136  1  0.117016  0.099213  0.647059  1
  Ni  Ni137  1  0.093476  0.778505  0.630294  1
  Ni  Ni138  1  0.137433  0.421340  0.663698  1
  Ni  Ni139  1  0.450349  0.765880  0.647059  1
  Ni  Ni140  1  0.426810  0.445171  0.630294  1
  Ni  Ni141  1  0.783682  0.432546  0.647059  1
  Ni  Ni142  1  0.470766  0.088007  0.663698  1
  Ni  Ni143  1  0.760143  0.111838  0.630294  1
  Ni  Ni144  1  0.804099  0.754674  0.663698  1
  Ni  Ni145  1  0.107915  0.877865  0.714782  1
  Ni  Ni146  1  0.081949  0.560983  0.700311  1
  Ni  Ni147  1  0.058051  0.240190  0.682739  1
  Ni  Ni148  1  0.441248  0.544531  0.714782  1
  Ni  Ni149  1  0.415282  0.227649  0.700311  1
  Ni  Ni150  1  0.774581  0.211198  0.714782  1
  Ni  Ni151  1  0.391384  0.906857  0.682739  1
  Ni  Ni152  1  0.748615  0.894316  0.700311  1
  Ni  Ni153  1  0.724717  0.573524  0.682739  1
  Ni  Ni154  1  0.179192  0.063350  0.698171  1
  Ni  Ni155  1  0.162228  0.740128  0.680035  1
  Ni  Ni156  1  0.209724  0.382010  0.712837  1
  Ni  Ni157  1  0.512525  0.730017  0.698171  1
  Ni  Ni158  1  0.495561  0.406795  0.680035  1
  Ni  Ni159  1  0.845858  0.396683  0.698171  1
  Ni  Ni160  1  0.543058  0.048677  0.712837  1
  Ni  Ni161  1  0.828895  0.073462  0.680035  1
  Ni  Ni162  1  0.876391  0.715343  0.712837  1
