# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.08582440
_cell_length_b   6.53852081
_cell_length_c   48.87050712
_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   1305.58771193
_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  0.252323  0.111532  0.312857  1
  Ni  Ni2  1  0.252323  0.828374  0.280138  1
  Ni  Ni3  1  0.252323  0.463908  0.295246  1
  Ni  Ni4  1  0.752323  0.044273  0.285072  1
  Ni  Ni5  1  0.752323  0.679477  0.301039  1
  Ni  Ni6  1  0.752323  0.325389  0.318042  1
  Ni  Ni7  1  0.252323  0.038069  0.362491  1
  Ni  Ni8  1  0.252323  0.751755  0.329431  1
  Ni  Ni9  1  0.252323  0.396323  0.345954  1
  Ni  Ni10  1  0.752323  0.965354  0.334748  1
  Ni  Ni11  1  0.752323  0.610337  0.351407  1
  Ni  Ni12  1  0.752323  0.252844  0.367966  1
  Ni  Ni13  1  0.252323  0.966161  0.412520  1
  Ni  Ni14  1  0.252323  0.680830  0.379248  1
  Ni  Ni15  1  0.252323  0.323225  0.395831  1
  Ni  Ni16  1  0.752323  0.896004  0.384782  1
  Ni  Ni17  1  0.752323  0.538539  0.401432  1
  Ni  Ni18  1  0.752323  0.181594  0.418107  1
  Ni  Ni19  1  0.252323  0.894452  0.462529  1
  Ni  Ni20  1  0.252323  0.608810  0.429189  1
  Ni  Ni21  1  0.252323  0.251657  0.445850  1
  Ni  Ni22  1  0.752323  0.824310  0.434803  1
  Ni  Ni23  1  0.752323  0.467142  0.451487  1
  Ni  Ni24  1  0.752323  0.109972  0.468158  1
  Ni  Ni25  1  0.252323  0.822911  0.512556  1
  Ni  Ni26  1  0.252323  0.537265  0.479206  1
  Ni  Ni27  1  0.252323  0.180096  0.495876  1
  Ni  Ni28  1  0.752323  0.752791  0.484841  1
  Ni  Ni29  1  0.752323  0.395605  0.501522  1
  Ni  Ni30  1  0.752323  0.038437  0.518192  1
  Ni  Ni31  1  0.252323  0.751391  0.562594  1
  Ni  Ni32  1  0.252323  0.465729  0.529240  1
  Ni  Ni33  1  0.252323  0.108560  0.545911  1
  Ni  Ni34  1  0.752323  0.681250  0.534869  1
  Ni  Ni35  1  0.752323  0.324045  0.551548  1
  Ni  Ni36  1  0.752323  0.966891  0.568208  1
  Ni  Ni37  1  0.252323  0.679697  0.612616  1
  Ni  Ni38  1  0.252323  0.394107  0.579291  1
  Ni  Ni39  1  0.252323  0.037162  0.595965  1
  Ni  Ni40  1  0.752323  0.609540  0.584878  1
  Ni  Ni41  1  0.752323  0.252476  0.601567  1
  Ni  Ni42  1  0.752323  0.894872  0.618149  1
  Ni  Ni43  1  0.252323  0.610348  0.662650  1
  Ni  Ni44  1  0.252323  0.322858  0.629432  1
  Ni  Ni45  1  0.252323  0.965365  0.645991  1
  Ni  Ni46  1  0.752323  0.537632  0.634907  1
  Ni  Ni47  1  0.752323  0.179378  0.651444  1
  Ni  Ni48  1  0.752323  0.823947  0.667966  1
  Ni  Ni49  1  0.252323  0.531429  0.712326  1
  Ni  Ni50  1  0.252323  0.250312  0.679355  1
  Ni  Ni51  1  0.252323  0.896225  0.696359  1
  Ni  Ni52  1  0.752323  0.464170  0.684540  1
  Ni  Ni53  1  0.752323  0.111794  0.702152  1
  Ni  Ni54  1  0.752323  0.747327  0.717259  1
