# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.48172743
_cell_length_b   7.64347054
_cell_length_c   47.88904143
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   80.72341050
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni36
_cell_volume   896.527268002
_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  0.103422  0.794233  0.341985  1
  Ni  Ni2  1  0.859830  0.281317  0.294662  1
  Ni  Ni3  1  0.483727  0.032613  0.317247  1
  Ni  Ni4  1  0.637307  0.728183  0.298675  1
  Ni  Ni5  1  0.254160  0.493675  0.323099  1
  Ni  Ni6  1  0.875265  0.251090  0.345673  1
  Ni  Ni7  1  0.963654  0.073253  0.413164  1
  Ni  Ni8  1  0.723326  0.554460  0.365915  1
  Ni  Ni9  1  0.343755  0.313210  0.389244  1
  Ni  Ni10  1  0.494423  0.012931  0.369427  1
  Ni  Ni11  1  0.114124  0.773502  0.393516  1
  Ni  Ni12  1  0.734623  0.532308  0.417290  1
  Ni  Ni13  1  0.824097  0.352007  0.484759  1
  Ni  Ni14  1  0.583830  0.832864  0.437098  1
  Ni  Ni15  1  0.204000  0.592367  0.460916  1
  Ni  Ni16  1  0.354692  0.292013  0.441082  1
  Ni  Ni17  1  0.974724  0.051833  0.464945  1
  Ni  Ni18  1  0.594862  0.811417  0.488791  1
  Ni  Ni19  1  0.684387  0.631028  0.556318  1
  Ni  Ni20  1  0.444218  0.111623  0.508609  1
  Ni  Ni21  1  0.064355  0.871207  0.532455  1
  Ni  Ni22  1  0.214983  0.571033  0.512641  1
  Ni  Ni23  1  0.835079  0.330673  0.536484  1
  Ni  Ni24  1  0.455249  0.090176  0.560302  1
  Ni  Ni25  1  0.544656  0.910109  0.627973  1
  Ni  Ni26  1  0.304457  0.390733  0.580110  1
  Ni  Ni27  1  0.924956  0.149538  0.603883  1
  Ni  Ni28  1  0.075426  0.849787  0.584236  1
  Ni  Ni29  1  0.695324  0.609830  0.608155  1
  Ni  Ni30  1  0.315753  0.368580  0.631485  1
  Ni  Ni31  1  0.401772  0.194857  0.698724  1
  Ni  Ni32  1  0.163814  0.671950  0.651727  1
  Ni  Ni33  1  0.784920  0.429365  0.674300  1
  Ni  Ni34  1  0.935658  0.128808  0.655415  1
  Ni  Ni35  1  0.555352  0.890427  0.680152  1
  Ni  Ni36  1  0.179250  0.641723  0.702738  1
