# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.47370337
_cell_length_b   5.90883454
_cell_length_c   47.69338103
_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   697.120028336
_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  0.501654  0.594841  0.315706  1
  Ni  Ni2  1  1.001654  0.857112  0.285270  1
  Ni  Ni3  1  1.001654  0.923353  0.336487  1
  Ni  Ni4  1  0.501654  0.188198  0.304596  1
  Ni  Ni5  1  0.501654  0.072195  0.378153  1
  Ni  Ni6  1  1.001654  0.333142  0.346901  1
  Ni  Ni7  1  1.001654  0.398160  0.398916  1
  Ni  Ni8  1  0.501654  0.659876  0.367587  1
  Ni  Ni9  1  0.501654  0.548378  0.440664  1
  Ni  Ni10  1  1.001654  0.810151  0.409370  1
  Ni  Ni11  1  0.001654  0.874186  0.461458  1
  Ni  Ni12  1  0.501654  0.136059  0.430183  1
  Ni  Ni13  1  0.501654  0.024565  0.503206  1
  Ni  Ni14  1  0.001654  0.286454  0.471932  1
  Ni  Ni15  1  0.001654  0.350392  0.524009  1
  Ni  Ni16  1  0.501654  0.612281  0.492734  1
  Ni  Ni17  1  0.501654  0.500787  0.565757  1
  Ni  Ni18  1  0.001654  0.762660  0.534483  1
  Ni  Ni19  1  1.001654  0.826695  0.586570  1
  Ni  Ni20  1  0.501654  0.088468  0.555276  1
  Ni  Ni21  1  0.501654  0.976970  0.628354  1
  Ni  Ni22  1  1.001654  0.238686  0.597025  1
  Ni  Ni23  1  1.001654  0.303704  0.649039  1
  Ni  Ni24  1  0.501654  0.564651  0.617787  1
  Ni  Ni25  1  0.501654  0.448648  0.691345  1
  Ni  Ni26  1  1.001654  0.713493  0.659454  1
  Ni  Ni27  1  1.001654  0.779734  0.710670  1
  Ni  Ni28  1  0.501654  0.042006  0.680235  1
