# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.08372716
_cell_length_b   4.27394849
_cell_length_c   47.33294794
_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   Ni34
_cell_volume   826.132211212
_cell_formula_units_Z   34
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  0.252581  0.173199  0.287685  1
  Ni  Ni2  1  0.752581  0.832605  0.287685  1
  Ni  Ni3  1  0.252581  0.669820  0.313841  1
  Ni  Ni4  1  0.752581  0.335984  0.313841  1
  Ni  Ni5  1  0.252581  0.169472  0.340343  1
  Ni  Ni6  1  0.752581  0.836333  0.340343  1
  Ni  Ni7  1  0.252581  0.670313  0.366452  1
  Ni  Ni8  1  0.752581  0.335492  0.366452  1
  Ni  Ni9  1  0.252581  0.170810  0.392841  1
  Ni  Ni10  1  0.752581  0.834995  0.392841  1
  Ni  Ni11  1  0.252581  0.670965  0.419142  1
  Ni  Ni12  1  0.752581  0.334840  0.419142  1
  Ni  Ni13  1  0.252581  0.171029  0.445477  1
  Ni  Ni14  1  0.752581  0.834776  0.445477  1
  Ni  Ni15  1  0.252581  0.671048  0.471802  1
  Ni  Ni16  1  0.752581  0.334757  0.471802  1
  Ni  Ni17  1  0.252581  0.171053  0.498130  1
  Ni  Ni18  1  0.752581  0.834751  0.498130  1
  Ni  Ni19  1  0.252581  0.671048  0.524458  1
  Ni  Ni20  1  0.752581  0.334757  0.524458  1
  Ni  Ni21  1  0.252581  0.171029  0.550782  1
  Ni  Ni22  1  0.752581  0.834776  0.550782  1
  Ni  Ni23  1  0.252581  0.670965  0.577117  1
  Ni  Ni24  1  0.752581  0.334840  0.577117  1
  Ni  Ni25  1  0.252581  0.170810  0.603418  1
  Ni  Ni26  1  0.752581  0.834995  0.603418  1
  Ni  Ni27  1  0.252581  0.670313  0.629807  1
  Ni  Ni28  1  0.752581  0.335492  0.629807  1
  Ni  Ni29  1  0.252581  0.169472  0.655916  1
  Ni  Ni30  1  0.752581  0.836333  0.655916  1
  Ni  Ni31  1  0.252581  0.669820  0.682418  1
  Ni  Ni32  1  0.752581  0.335984  0.682418  1
  Ni  Ni33  1  0.252581  0.173199  0.708575  1
  Ni  Ni34  1  0.752581  0.832605  0.708575  1
