# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.55632041
_cell_length_b   12.48887074
_cell_length_c   48.06945652
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   92.15459569
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni162
_cell_volume   3933.19435819
_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  0.554275  0.176044  0.316744  1
  Ni  Ni2  1  0.536704  0.852101  0.299600  1
  Ni  Ni3  1  0.509136  0.534268  0.283656  1
  Ni  Ni4  1  0.887608  0.842711  0.316744  1
  Ni  Ni5  1  0.870037  0.518768  0.299600  1
  Ni  Ni6  1  0.220941  0.509378  0.316744  1
  Ni  Ni7  1  0.842469  0.200935  0.283656  1
  Ni  Ni8  1  0.203370  0.185435  0.299600  1
  Ni  Ni9  1  0.175802  0.867601  0.283656  1
  Ni  Ni10  1  0.630128  0.355150  0.297181  1
  Ni  Ni11  1  0.603727  0.036224  0.281470  1
  Ni  Ni12  1  0.655061  0.675118  0.314560  1
  Ni  Ni13  1  0.963462  0.021817  0.297181  1
  Ni  Ni14  1  0.937060  0.702890  0.281470  1
  Ni  Ni15  1  0.296795  0.688483  0.297181  1
  Ni  Ni16  1  0.988394  0.341785  0.314560  1
  Ni  Ni17  1  0.270394  0.369557  0.281470  1
  Ni  Ni18  1  0.321728  0.008452  0.314560  1
  Ni  Ni19  1  0.620158  0.136572  0.366752  1
  Ni  Ni20  1  0.597613  0.815923  0.349923  1
  Ni  Ni21  1  0.576075  0.494327  0.333062  1
  Ni  Ni22  1  0.953491  0.803239  0.366752  1
  Ni  Ni23  1  0.930947  0.482590  0.349923  1
  Ni  Ni24  1  0.286825  0.469905  0.366752  1
  Ni  Ni25  1  0.909409  0.160993  0.333062  1
  Ni  Ni26  1  0.264280  0.149257  0.349923  1
  Ni  Ni27  1  0.242742  0.827660  0.333062  1
  Ni  Ni28  1  0.703231  0.317631  0.347304  1
  Ni  Ni29  1  0.678716  0.998131  0.330972  1
  Ni  Ni30  1  0.725944  0.638151  0.364175  1
  Ni  Ni31  1  0.036564  0.984297  0.347304  1
  Ni  Ni32  1  0.012049  0.664798  0.330972  1
  Ni  Ni33  1  0.369898  0.650964  0.347304  1
  Ni  Ni34  1  0.059277  0.304818  0.364175  1
  Ni  Ni35  1  0.345383  0.331465  0.330972  1
  Ni  Ni36  1  0.392610  0.971484  0.364175  1
  Ni  Ni37  1  0.688480  0.098139  0.416758  1
  Ni  Ni38  1  0.665550  0.777598  0.400064  1
  Ni  Ni39  1  0.642849  0.456843  0.383338  1
  Ni  Ni40  1  0.021813  0.764805  0.416758  1
  Ni  Ni41  1  0.998883  0.444264  0.400064  1
  Ni  Ni42  1  0.355146  0.431472  0.416758  1
  Ni  Ni43  1  0.976182  0.123510  0.383338  1
  Ni  Ni44  1  0.332216  0.110931  0.400064  1
  Ni  Ni45  1  0.309516  0.790176  0.383338  1
  Ni  Ni46  1  0.771981  0.279600  0.397415  1
  Ni  Ni47  1  0.749216  0.958992  0.380745  1
  Ni  Ni48  1  0.794884  0.600171  0.414091  1
  Ni  Ni49  1  0.105314  0.946267  0.397415  1
  Ni  Ni50  1  0.082550  0.625658  0.380745  1
  Ni  Ni51  1  0.438647  0.612933  0.397415  1
  Ni  Ni52  1  0.128217  0.266838  0.414091  1
  Ni  Ni53  1  0.415883  0.292325  0.380745  1
  Ni  Ni54  1  0.461551  0.933505  0.414091  1
  Ni  Ni55  1  0.757060  0.059951  0.466781  1
  Ni  Ni56  1  0.734166  0.739356  0.450104  1
  Ni  Ni57  1  0.711293  0.418756  0.433423  1
  Ni  Ni58  1  0.090394  0.726617  0.466781  1
  Ni  Ni59  1  0.067499  0.406022  0.450104  1
  Ni  Ni60  1  0.423727  0.393284  0.466781  1
  Ni  Ni61  1  0.044626  0.085422  0.433423  1
  Ni  Ni62  1  0.400833  0.072689  0.450104  1
  Ni  Ni63  1  0.377960  0.752089  0.433423  1
  Ni  Ni64  1  0.840640  0.241408  0.447419  1
  Ni  Ni65  1  0.817779  0.920789  0.430746  1
  Ni  Ni66  1  0.863533  0.562008  0.464090  1
  Ni  Ni67  1  0.173973  0.908074  0.447419  1
  Ni  Ni68  1  0.151112  0.587456  0.430746  1
  Ni  Ni69  1  0.507306  0.574741  0.447419  1
  Ni  Ni70  1  0.196866  0.228674  0.464090  1
  Ni  Ni71  1  0.484446  0.254122  0.430746  1
  Ni  Ni72  1  0.530199  0.895341  0.464090  1
  Ni  Ni73  1  0.825713  0.021767  0.516799  1
  Ni  Ni74  1  0.802825  0.701161  0.500126  1
  Ni  Ni75  1  0.779938  0.380559  0.483452  1
  Ni  Ni76  1  0.159046  0.688434  0.516799  1
  Ni  Ni77  1  0.136159  0.367827  0.500126  1
  Ni  Ni78  1  0.492380  0.355100  0.516799  1
  Ni  Ni79  1  0.113272  0.047226  0.483452  1
  Ni  Ni80  1  0.469492  0.034494  0.500126  1
  Ni  Ni81  1  0.446605  0.713893  0.483452  1
  Ni  Ni82  1  0.909303  0.203219  0.497432  1
  Ni  Ni83  1  0.886416  0.882612  0.480759  1
  Ni  Ni84  1  0.932191  0.523820  0.514105  1
  Ni  Ni85  1  0.242637  0.869885  0.497432  1
  Ni  Ni86  1  0.219749  0.549279  0.480759  1
  Ni  Ni87  1  0.575970  0.536552  0.497432  1
  Ni  Ni88  1  0.265524  0.190487  0.514105  1
  Ni  Ni89  1  0.553083  0.215945  0.480759  1
  Ni  Ni90  1  0.598857  0.857153  0.514105  1
  Ni  Ni91  1  0.894350  0.983590  0.566811  1
  Ni  Ni92  1  0.871489  0.662972  0.550139  1
  Ni  Ni93  1  0.848596  0.342371  0.533468  1
  Ni  Ni94  1  0.227683  0.650257  0.566811  1
  Ni  Ni95  1  0.204822  0.329638  0.550139  1
  Ni  Ni96  1  0.561017  0.316924  0.566811  1
  Ni  Ni97  1  0.181929  0.009038  0.533468  1
  Ni  Ni98  1  0.538156  0.996305  0.550139  1
  Ni  Ni99  1  0.515263  0.675705  0.533468  1
  Ni  Ni100  1  0.977963  0.165024  0.547454  1
  Ni  Ni101  1  0.955068  0.844429  0.530777  1
  Ni  Ni102  1  1.000836  0.485623  0.564135  1
  Ni  Ni103  1  0.311296  0.831690  0.547454  1
  Ni  Ni104  1  0.288402  0.511095  0.530777  1
  Ni  Ni105  1  0.644630  0.498357  0.547454  1
  Ni  Ni106  1  0.334169  0.152290  0.564135  1
  Ni  Ni107  1  0.621735  0.177762  0.530777  1
  Ni  Ni108  1  0.667503  0.818957  0.564135  1
  Ni  Ni109  1  0.962913  0.945387  0.616813  1
  Ni  Ni110  1  0.940148  0.624779  0.600142  1
  Ni  Ni111  1  0.917245  0.304208  0.583466  1
  Ni  Ni112  1  0.296246  0.612054  0.616813  1
  Ni  Ni113  1  0.273481  0.291446  0.600142  1
  Ni  Ni114  1  0.629579  0.278721  0.616813  1
  Ni  Ni115  1  0.250578  0.970875  0.583466  1
  Ni  Ni116  1  0.606815  0.958113  0.600142  1
  Ni  Ni117  1  0.583912  0.637541  0.583466  1
  Ni  Ni118  1  0.046579  0.126782  0.597494  1
  Ni  Ni119  1  0.023649  0.806241  0.580800  1
  Ni  Ni120  1  0.069280  0.447536  0.614219  1
  Ni  Ni121  1  0.379913  0.793448  0.597494  1
  Ni  Ni122  1  0.356982  0.472907  0.580800  1
  Ni  Ni123  1  0.713246  0.460115  0.597494  1
  Ni  Ni124  1  0.402613  0.114203  0.614219  1
  Ni  Ni125  1  0.690316  0.139574  0.580800  1
  Ni  Ni126  1  0.735947  0.780870  0.614219  1
  Ni  Ni127  1  0.033413  0.906248  0.666585  1
  Ni  Ni128  1  0.008898  0.586749  0.650254  1
  Ni  Ni129  1  0.986185  0.266228  0.633382  1
  Ni  Ni130  1  0.366746  0.572914  0.666585  1
  Ni  Ni131  1  0.342231  0.253415  0.650254  1
  Ni  Ni132  1  0.700080  0.239581  0.666585  1
  Ni  Ni133  1  0.319518  0.932895  0.633382  1
  Ni  Ni134  1  0.675564  0.920082  0.650254  1
  Ni  Ni135  1  0.652852  0.599562  0.633382  1
  Ni  Ni136  1  0.114516  0.088456  0.647634  1
  Ni  Ni137  1  0.091971  0.767807  0.630805  1
  Ni  Ni138  1  0.136054  0.410053  0.664496  1
  Ni  Ni139  1  0.447849  0.755123  0.647634  1
  Ni  Ni140  1  0.425304  0.434474  0.630805  1
  Ni  Ni141  1  0.781182  0.421789  0.647634  1
  Ni  Ni142  1  0.469387  0.076719  0.664496  1
  Ni  Ni143  1  0.758638  0.101141  0.630805  1
  Ni  Ni144  1  0.802720  0.743386  0.664496  1
  Ni  Ni145  1  0.108402  0.868156  0.716088  1
  Ni  Ni146  1  0.082001  0.549229  0.700377  1
  Ni  Ni147  1  0.057068  0.229261  0.682998  1
  Ni  Ni148  1  0.441735  0.534822  0.716088  1
  Ni  Ni149  1  0.415334  0.215896  0.700377  1
  Ni  Ni150  1  0.775068  0.201489  0.716088  1
  Ni  Ni151  1  0.390401  0.895928  0.682998  1
  Ni  Ni152  1  0.748667  0.882563  0.700377  1
  Ni  Ni153  1  0.723734  0.562594  0.682998  1
  Ni  Ni154  1  0.175425  0.052278  0.697958  1
  Ni  Ni155  1  0.157854  0.728335  0.680814  1
  Ni  Ni156  1  0.202993  0.370111  0.713902  1
  Ni  Ni157  1  0.508759  0.718944  0.697958  1
  Ni  Ni158  1  0.491188  0.395002  0.680814  1
  Ni  Ni159  1  0.842092  0.385611  0.697958  1
  Ni  Ni160  1  0.536327  0.036778  0.713902  1
  Ni  Ni161  1  0.824521  0.061668  0.680814  1
  Ni  Ni162  1  0.869660  0.703445  0.713902  1
