# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.48000129
_cell_length_b   5.96809488
_cell_length_c   47.68366826
_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   Ni28
_cell_volume   705.760394797
_cell_formula_units_Z   28
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  0.501602  0.607463  0.318310  1
  Ni  Ni2  1  0.001602  0.873073  0.288373  1
  Ni  Ni3  1  0.001602  0.933930  0.338725  1
  Ni  Ni4  1  0.501602  0.195152  0.308190  1
  Ni  Ni5  1  0.501602  0.084741  0.380591  1
  Ni  Ni6  1  0.001602  0.345191  0.349466  1
  Ni  Ni7  1  0.001602  0.412184  0.401398  1
  Ni  Ni8  1  0.501602  0.672414  0.369844  1
  Ni  Ni9  1  0.501602  0.564193  0.443241  1
  Ni  Ni10  1  0.001602  0.824263  0.411834  1
  Ni  Ni11  1  0.001602  0.890951  0.464054  1
  Ni  Ni12  1  0.501602  0.151344  0.432716  1
  Ni  Ni13  1  0.501602  0.043313  0.505902  1
  Ni  Ni14  1  0.001602  0.303752  0.474566  1
  Ni  Ni15  1  0.001602  0.370142  0.526760  1
  Ni  Ni16  1  0.501602  0.630581  0.495424  1
  Ni  Ni17  1  0.501602  0.522551  0.568610  1
  Ni  Ni18  1  0.001602  0.782943  0.537272  1
  Ni  Ni19  1  0.001602  0.849632  0.589492  1
  Ni  Ni20  1  0.501602  0.109701  0.558085  1
  Ni  Ni21  1  0.501602  0.001480  0.631482  1
  Ni  Ni22  1  0.001602  0.261710  0.599928  1
  Ni  Ni23  1  0.001602  0.328703  0.651860  1
  Ni  Ni24  1  0.501602  0.589153  0.620735  1
  Ni  Ni25  1  0.501602  0.478742  0.693136  1
  Ni  Ni26  1  0.001602  0.739964  0.662601  1
  Ni  Ni27  1  0.001602  0.800822  0.712953  1
  Ni  Ni28  1  0.501602  0.066432  0.683016  1
