# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.46436438
_cell_length_b   7.70318409
_cell_length_c   49.25583512
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   99.17179907
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni36
_cell_volume   923.091095033
_cell_formula_units_Z   36
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  0.868199  0.730889  0.305904  1
  Ni  Ni2  1  0.250588  0.495740  0.330005  1
  Ni  Ni3  1  0.632180  0.258640  0.352315  1
  Ni  Ni4  1  0.479598  0.953928  0.332880  1
  Ni  Ni5  1  0.718876  0.432905  0.288686  1
  Ni  Ni6  1  0.096354  0.187436  0.308977  1
  Ni  Ni7  1  0.015082  0.024324  0.376470  1
  Ni  Ni8  1  0.397539  0.789166  0.400686  1
  Ni  Ni9  1  0.779684  0.553342  0.424538  1
  Ni  Ni10  1  0.627223  0.248904  0.404463  1
  Ni  Ni11  1  0.862791  0.720289  0.357105  1
  Ni  Ni12  1  0.244713  0.483992  0.380840  1
  Ni  Ni13  1  0.162003  0.317854  0.448360  1
  Ni  Ni14  1  0.544447  0.082638  0.472320  1
  Ni  Ni15  1  0.926837  0.847314  0.496252  1
  Ni  Ni16  1  0.774698  0.543546  0.476284  1
  Ni  Ni17  1  0.009989  0.014350  0.428468  1
  Ni  Ni18  1  0.392379  0.779024  0.452415  1
  Ni  Ni19  1  0.309246  0.612022  0.520139  1
  Ni  Ni20  1  0.691564  0.376545  0.544008  1
  Ni  Ni21  1  0.073954  0.141219  0.567955  1
  Ni  Ni22  1  0.921940  0.837714  0.548063  1
  Ni  Ni23  1  0.157106  0.308254  0.500171  1
  Ni  Ni24  1  0.539496  0.072931  0.524103  1
  Ni  Ni25  1  0.456721  0.906664  0.591960  1
  Ni  Ni26  1  0.839230  0.671576  0.615583  1
  Ni  Ni27  1  0.221153  0.435280  0.639318  1
  Ni  Ni28  1  0.068861  0.131245  0.619953  1
  Ni  Ni29  1  0.304260  0.602226  0.571884  1
  Ni  Ni30  1  0.686405  0.366402  0.595737  1
  Ni  Ni31  1  0.604345  0.201640  0.663543  1
  Ni  Ni32  1  0.987590  0.968132  0.687446  1
  Ni  Ni33  1  0.365068  0.722663  0.707737  1
  Ni  Ni34  1  0.215744  0.424679  0.690519  1
  Ni  Ni35  1  0.451763  0.896928  0.644108  1
  Ni  Ni36  1  0.833355  0.659828  0.666418  1
