# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.27624177
_cell_length_b   4.77298196
_cell_length_c   46.48499142
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   116.62098340
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni34
_cell_volume   848.198607008
_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  0.713180  0.766077  0.299148  1
  Ni  Ni2  1  0.822993  0.310496  0.287592  1
  Ni  Ni3  1  0.176756  0.683397  0.324959  1
  Ni  Ni4  1  0.278288  0.220464  0.312115  1
  Ni  Ni5  1  0.633907  0.597713  0.350651  1
  Ni  Ni6  1  0.737141  0.138904  0.338340  1
  Ni  Ni7  1  0.092626  0.516076  0.376294  1
  Ni  Ni8  1  0.196750  0.057100  0.363604  1
  Ni  Ni9  1  0.550483  0.431889  0.402005  1
  Ni  Ni10  1  0.656196  0.973224  0.389299  1
  Ni  Ni11  1  0.008954  0.348728  0.427676  1
  Ni  Ni12  1  0.115071  0.890105  0.414903  1
  Ni  Ni13  1  0.467309  0.265333  0.453357  1
  Ni  Ni14  1  0.573713  0.806847  0.440568  1
  Ni  Ni15  1  0.925743  0.182066  0.479027  1
  Ni  Ni16  1  0.032206  0.723588  0.466222  1
  Ni  Ni17  1  0.384156  0.098773  0.504694  1
  Ni  Ni18  1  0.490659  0.640326  0.491888  1
  Ni  Ni19  1  0.842609  0.015510  0.530360  1
  Ni  Ni20  1  0.949072  0.557032  0.517556  1
  Ni  Ni21  1  0.301102  0.932252  0.556014  1
  Ni  Ni22  1  0.407506  0.473765  0.543226  1
  Ni  Ni23  1  0.759744  0.848994  0.581679  1
  Ni  Ni24  1  0.865861  0.390370  0.568906  1
  Ni  Ni25  1  0.218619  0.765875  0.607283  1
  Ni  Ni26  1  0.324332  0.307210  0.594578  1
  Ni  Ni27  1  0.678065  0.681999  0.632979  1
  Ni  Ni28  1  0.782189  0.223022  0.620288  1
  Ni  Ni29  1  0.137674  0.600195  0.658243  1
  Ni  Ni30  1  0.240908  0.141385  0.645931  1
  Ni  Ni31  1  0.596527  0.518634  0.684468  1
  Ni  Ni32  1  0.698059  0.055701  0.671623  1
  Ni  Ni33  1  0.051822  0.428602  0.708991  1
  Ni  Ni34  1  0.161635  0.973022  0.697434  1
