# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.08291095
_cell_length_b   6.56334254
_cell_length_c   48.96906387
_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   Ni54
_cell_volume   1312.2506001
_cell_formula_units_Z   54
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  0.250641  0.106055  0.313602  1
  Ni  Ni2  1  0.250641  0.828710  0.280321  1
  Ni  Ni3  1  0.250641  0.459038  0.295917  1
  Ni  Ni4  1  0.750641  0.048263  0.285689  1
  Ni  Ni5  1  0.750641  0.683830  0.301757  1
  Ni  Ni6  1  0.750641  0.328019  0.319170  1
  Ni  Ni7  1  0.250641  0.036547  0.363095  1
  Ni  Ni8  1  0.250641  0.749073  0.329377  1
  Ni  Ni9  1  0.250641  0.394630  0.346335  1
  Ni  Ni10  1  0.750641  0.966631  0.335137  1
  Ni  Ni11  1  0.750641  0.610449  0.351948  1
  Ni  Ni12  1  0.750641  0.252022  0.368700  1
  Ni  Ni13  1  0.250641  0.965706  0.413081  1
  Ni  Ni14  1  0.250641  0.680008  0.379679  1
  Ni  Ni15  1  0.250641  0.322881  0.396388  1
  Ni  Ni16  1  0.750641  0.895057  0.385331  1
  Ni  Ni17  1  0.750641  0.537912  0.401991  1
  Ni  Ni18  1  0.750641  0.180693  0.418694  1
  Ni  Ni19  1  0.250641  0.894320  0.463093  1
  Ni  Ni20  1  0.250641  0.608600  0.429729  1
  Ni  Ni21  1  0.250641  0.251482  0.446419  1
  Ni  Ni22  1  0.750641  0.823528  0.435358  1
  Ni  Ni23  1  0.750641  0.466419  0.452027  1
  Ni  Ni24  1  0.750641  0.109255  0.468710  1
  Ni  Ni25  1  0.250641  0.822912  0.513116  1
  Ni  Ni26  1  0.250641  0.537194  0.479762  1
  Ni  Ni27  1  0.250641  0.180048  0.496443  1
  Ni  Ni28  1  0.750641  0.752115  0.485382  1
  Ni  Ni29  1  0.750641  0.394978  0.502054  1
  Ni  Ni30  1  0.750641  0.037833  0.518735  1
  Ni  Ni31  1  0.250641  0.751499  0.563139  1
  Ni  Ni32  1  0.250641  0.465772  0.529787  1
  Ni  Ni33  1  0.250641  0.108608  0.546470  1
  Ni  Ni34  1  0.750641  0.680706  0.535404  1
  Ni  Ni35  1  0.750641  0.323544  0.552079  1
  Ni  Ni36  1  0.750641  0.966426  0.568768  1
  Ni  Ni37  1  0.250641  0.679970  0.613166  1
  Ni  Ni38  1  0.250641  0.394333  0.579803  1
  Ni  Ni39  1  0.250641  0.037114  0.596506  1
  Ni  Ni40  1  0.750641  0.609321  0.585417  1
  Ni  Ni41  1  0.750641  0.252146  0.602110  1
  Ni  Ni42  1  0.750641  0.895018  0.618818  1
  Ni  Ni43  1  0.250641  0.608396  0.663360  1
  Ni  Ni44  1  0.250641  0.323005  0.629797  1
  Ni  Ni45  1  0.250641  0.964578  0.646549  1
  Ni  Ni46  1  0.750641  0.538480  0.635403  1
  Ni  Ni47  1  0.750641  0.180397  0.652162  1
  Ni  Ni48  1  0.750641  0.825953  0.669120  1
  Ni  Ni49  1  0.250641  0.526763  0.712809  1
  Ni  Ni50  1  0.250641  0.247008  0.679328  1
  Ni  Ni51  1  0.250641  0.891197  0.696740  1
  Ni  Ni52  1  0.750641  0.468972  0.684895  1
  Ni  Ni53  1  0.750641  0.115988  0.702580  1
  Ni  Ni54  1  0.750641  0.746316  0.718177  1
