# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.28944621
_cell_length_b   4.80112681
_cell_length_c   46.43669668
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   116.57504344
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni34
_cell_volume   855.288901295
_cell_formula_units_Z   34
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  0.698266  0.772915  0.300386  1
  Ni  Ni2  1  0.829847  0.326574  0.289623  1
  Ni  Ni3  1  0.170027  0.691270  0.326364  1
  Ni  Ni4  1  0.281142  0.222979  0.313668  1
  Ni  Ni5  1  0.630380  0.601690  0.351387  1
  Ni  Ni6  1  0.744276  0.145972  0.339583  1
  Ni  Ni7  1  0.092577  0.521244  0.377603  1
  Ni  Ni8  1  0.199310  0.061868  0.364948  1
  Ni  Ni9  1  0.552008  0.436951  0.403217  1
  Ni  Ni10  1  0.657613  0.977132  0.390551  1
  Ni  Ni11  1  0.010588  0.353664  0.428984  1
  Ni  Ni12  1  0.116799  0.895397  0.416292  1
  Ni  Ni13  1  0.469421  0.270618  0.454708  1
  Ni  Ni14  1  0.575051  0.811711  0.441912  1
  Ni  Ni15  1  0.927838  0.187205  0.480402  1
  Ni  Ni16  1  0.033734  0.728691  0.467617  1
  Ni  Ni17  1  0.386339  0.104010  0.506107  1
  Ni  Ni18  1  0.492186  0.645465  0.493302  1
  Ni  Ni19  1  0.844791  0.020785  0.531792  1
  Ni  Ni20  1  0.950687  0.562270  0.519007  1
  Ni  Ni21  1  0.303474  0.937765  0.557496  1
  Ni  Ni22  1  0.409104  0.478858  0.544701  1
  Ni  Ni23  1  0.761725  0.854078  0.583116  1
  Ni  Ni24  1  0.867936  0.395811  0.570424  1
  Ni  Ni25  1  0.220911  0.772344  0.608857  1
  Ni  Ni26  1  0.326517  0.312524  0.596192  1
  Ni  Ni27  1  0.679215  0.687608  0.634460  1
  Ni  Ni28  1  0.785948  0.228232  0.621806  1
  Ni  Ni29  1  0.134249  0.603504  0.659826  1
  Ni  Ni30  1  0.248145  0.147786  0.648022  1
  Ni  Ni31  1  0.597383  0.526497  0.685741  1
  Ni  Ni32  1  0.708498  0.058205  0.673045  1
  Ni  Ni33  1  0.048677  0.422902  0.709785  1
  Ni  Ni34  1  0.180259  0.976561  0.699023  1
