# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.00424927
_cell_length_b   10.75452490
_cell_length_c   46.00964277
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni84
_cell_volume   1981.34998357
_cell_formula_units_Z   84
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  0.751950  0.519482  0.297361  1
  Ni  Ni2  1  0.751950  0.301855  0.277097  1
  Ni  Ni3  1  0.751950  0.915132  0.287132  1
  Ni  Ni4  1  0.251950  0.383294  0.301375  1
  Ni  Ni5  1  0.251950  0.165840  0.280348  1
  Ni  Ni6  1  0.251950  0.776202  0.290886  1
  Ni  Ni7  1  0.751950  0.332956  0.329920  1
  Ni  Ni8  1  0.751950  0.121451  0.309417  1
  Ni  Ni9  1  0.751950  0.728553  0.319460  1
  Ni  Ni10  1  0.251950  0.200714  0.333506  1
  Ni  Ni11  1  0.251950  0.986976  0.312865  1
  Ni  Ni12  1  0.251950  0.593936  0.323053  1
  Ni  Ni13  1  0.751950  0.148187  0.362274  1
  Ni  Ni14  1  0.751950  0.936599  0.340991  1
  Ni  Ni15  1  0.751950  0.542678  0.351260  1
  Ni  Ni16  1  0.251950  0.016009  0.365865  1
  Ni  Ni17  1  0.251950  0.804605  0.344470  1
  Ni  Ni18  1  0.251950  0.410460  0.354908  1
  Ni  Ni19  1  0.751950  0.963860  0.394550  1
  Ni  Ni20  1  0.751950  0.752744  0.372956  1
  Ni  Ni21  1  0.751950  0.358988  0.383629  1
  Ni  Ni22  1  0.251950  0.831274  0.398124  1
  Ni  Ni23  1  0.251950  0.620524  0.376487  1
  Ni  Ni24  1  0.251950  0.226440  0.387365  1
  Ni  Ni25  1  0.751950  0.779822  0.426796  1
  Ni  Ni26  1  0.751950  0.569259  0.405208  1
  Ni  Ni27  1  0.751950  0.174729  0.416003  1
  Ni  Ni28  1  0.251950  0.647149  0.430405  1
  Ni  Ni29  1  0.251950  0.436676  0.408866  1
  Ni  Ni30  1  0.251950  0.042035  0.419677  1
  Ni  Ni31  1  0.751950  0.595779  0.459077  1
  Ni  Ni32  1  0.751950  0.385251  0.437519  1
  Ni  Ni33  1  0.751950  0.990512  0.448328  1
  Ni  Ni34  1  0.251950  0.463094  0.462736  1
  Ni  Ni35  1  0.251950  0.252570  0.441214  1
  Ni  Ni36  1  0.251950  0.857790  0.451972  1
  Ni  Ni37  1  0.751950  0.411677  0.491386  1
  Ni  Ni38  1  0.751950  0.201110  0.469848  1
  Ni  Ni39  1  0.751950  0.806367  0.480631  1
  Ni  Ni40  1  0.251950  0.278966  0.495055  1
  Ni  Ni41  1  0.251950  0.068390  0.473523  1
  Ni  Ni42  1  0.251950  0.673660  0.484279  1
  Ni  Ni43  1  0.751950  0.227525  0.523696  1
  Ni  Ni44  1  0.751950  0.016948  0.502164  1
  Ni  Ni45  1  0.751950  0.622255  0.512940  1
  Ni  Ni46  1  0.251950  0.094805  0.527371  1
  Ni  Ni47  1  0.251950  0.884237  0.505833  1
  Ni  Ni48  1  0.251950  0.489548  0.516588  1
  Ni  Ni49  1  0.751950  0.043345  0.556005  1
  Ni  Ni50  1  0.751950  0.832821  0.534484  1
  Ni  Ni51  1  0.751950  0.438125  0.545248  1
  Ni  Ni52  1  0.251950  0.910663  0.559701  1
  Ni  Ni53  1  0.251950  0.700136  0.538142  1
  Ni  Ni54  1  0.251950  0.305402  0.548891  1
  Ni  Ni55  1  0.751950  0.859238  0.588353  1
  Ni  Ni56  1  0.751950  0.648766  0.566814  1
  Ni  Ni57  1  0.751950  0.253880  0.577542  1
  Ni  Ni58  1  0.251950  0.726656  0.592011  1
  Ni  Ni59  1  0.251950  0.516093  0.570423  1
  Ni  Ni60  1  0.251950  0.121186  0.581216  1
  Ni  Ni61  1  0.751950  0.675391  0.620732  1
  Ni  Ni62  1  0.751950  0.464640  0.599095  1
  Ni  Ni63  1  0.751950  0.069475  0.609854  1
  Ni  Ni64  1  0.251950  0.543171  0.624263  1
  Ni  Ni65  1  0.251950  0.332055  0.602670  1
  Ni  Ni66  1  0.251950  0.936926  0.613590  1
  Ni  Ni67  1  0.751950  0.491310  0.652750  1
  Ni  Ni68  1  0.751950  0.279906  0.631354  1
  Ni  Ni69  1  0.751950  0.885455  0.642311  1
  Ni  Ni70  1  0.251950  0.359316  0.656228  1
  Ni  Ni71  1  0.251950  0.147727  0.634945  1
  Ni  Ni72  1  0.251950  0.753236  0.645959  1
  Ni  Ni73  1  0.751950  0.308938  0.684354  1
  Ni  Ni74  1  0.751950  0.095200  0.663714  1
  Ni  Ni75  1  0.751950  0.701978  0.674166  1
  Ni  Ni76  1  0.251950  0.174463  0.687802  1
  Ni  Ni77  1  0.251950  0.962958  0.667299  1
  Ni  Ni78  1  0.251950  0.567362  0.677759  1
  Ni  Ni79  1  0.751950  0.130075  0.716871  1
  Ni  Ni80  1  0.751950  0.912620  0.695844  1
  Ni  Ni81  1  0.751950  0.519713  0.706333  1
  Ni  Ni82  1  0.251950  0.994060  0.720122  1
  Ni  Ni83  1  0.251950  0.776433  0.699858  1
  Ni  Ni84  1  0.251950  0.380782  0.710087  1
