# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.47598551
_cell_length_b   5.93660875
_cell_length_c   47.67542328
_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   700.779008986
_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  0.501999  0.603809  0.317197  1
  Ni  Ni2  1  1.001999  0.874463  0.287173  1
  Ni  Ni3  1  0.001999  0.930851  0.337338  1
  Ni  Ni4  1  0.501999  0.199357  0.307130  1
  Ni  Ni5  1  0.501999  0.077662  0.379399  1
  Ni  Ni6  1  1.001999  0.341179  0.348693  1
  Ni  Ni7  1  1.001999  0.405264  0.400255  1
  Ni  Ni8  1  0.501999  0.667635  0.368646  1
  Ni  Ni9  1  0.501999  0.555234  0.442140  1
  Ni  Ni10  1  0.001999  0.816308  0.410721  1
  Ni  Ni11  1  1.001999  0.881641  0.462902  1
  Ni  Ni12  1  0.501999  0.143004  0.431542  1
  Ni  Ni13  1  0.501999  0.032123  0.504798  1
  Ni  Ni14  1  1.001999  0.293613  0.473449  1
  Ni  Ni15  1  1.001999  0.358634  0.525612  1
  Ni  Ni16  1  0.501999  0.620125  0.494263  1
  Ni  Ni17  1  0.501999  0.509244  0.567519  1
  Ni  Ni18  1  1.001999  0.770606  0.536159  1
  Ni  Ni19  1  0.001999  0.835940  0.588340  1
  Ni  Ni20  1  0.501999  0.097014  0.556921  1
  Ni  Ni21  1  0.501999  0.984612  0.630415  1
  Ni  Ni22  1  1.001999  0.246984  0.598806  1
  Ni  Ni23  1  1.001999  0.311069  0.650368  1
  Ni  Ni24  1  0.501999  0.574586  0.619662  1
  Ni  Ni25  1  0.501999  0.452890  0.691931  1
  Ni  Ni26  1  1.001999  0.721397  0.661723  1
  Ni  Ni27  1  1.001999  0.777785  0.711888  1
  Ni  Ni28  1  0.501999  0.048439  0.681864  1
