# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.47981629
_cell_length_b   4.75768803
_cell_length_c   47.76043744
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   74.92867163
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni22
_cell_volume   544.10449407
_cell_formula_units_Z   22
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  0.435232  0.131904  0.294499  1
  Ni  Ni2  1  0.702243  0.598543  0.301152  1
  Ni  Ni3  1  0.041625  0.919241  0.335073  1
  Ni  Ni4  1  0.309807  0.383189  0.341670  1
  Ni  Ni5  1  0.650131  0.702121  0.374935  1
  Ni  Ni6  1  0.918238  0.166124  0.381587  1
  Ni  Ni7  1  0.258598  0.485022  0.414907  1
  Ni  Ni8  1  0.526726  0.948979  0.421541  1
  Ni  Ni9  1  0.867063  0.267919  0.454883  1
  Ni  Ni10  1  0.135168  0.731924  0.461513  1
  Ni  Ni11  1  0.475511  0.050850  0.494858  1
  Ni  Ni12  1  0.743614  0.514861  0.501486  1
  Ni  Ni13  1  0.083956  0.833787  0.534831  1
  Ni  Ni14  1  0.352061  0.297793  0.541461  1
  Ni  Ni15  1  0.692398  0.616732  0.574804  1
  Ni  Ni16  1  0.960526  0.080689  0.581437  1
  Ni  Ni17  1  0.300886  0.399587  0.614757  1
  Ni  Ni18  1  0.568993  0.863590  0.621409  1
  Ni  Ni19  1  0.909317  0.182522  0.654674  1
  Ni  Ni20  1  0.177499  0.646470  0.661271  1
  Ni  Ni21  1  0.516882  0.967168  0.695192  1
  Ni  Ni22  1  0.783892  0.433807  0.701845  1
