# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.27601310
_cell_length_b   4.77294270
_cell_length_c   46.49063518
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   116.62098322
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni34
_cell_volume   848.249248183
_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  0.713202  0.766092  0.299105  1
  Ni  Ni2  1  0.823068  0.310530  0.287550  1
  Ni  Ni3  1  0.176781  0.683406  0.324916  1
  Ni  Ni4  1  0.278345  0.220473  0.312071  1
  Ni  Ni5  1  0.633932  0.597724  0.350604  1
  Ni  Ni6  1  0.737194  0.138914  0.338294  1
  Ni  Ni7  1  0.092649  0.516085  0.376245  1
  Ni  Ni8  1  0.196801  0.057111  0.363556  1
  Ni  Ni9  1  0.550505  0.431898  0.401953  1
  Ni  Ni10  1  0.656243  0.973233  0.389249  1
  Ni  Ni11  1  0.008974  0.348736  0.427622  1
  Ni  Ni12  1  0.115118  0.890113  0.414851  1
  Ni  Ni13  1  0.467329  0.265340  0.453300  1
  Ni  Ni14  1  0.573758  0.806854  0.440513  1
  Ni  Ni15  1  0.925761  0.182071  0.478968  1
  Ni  Ni16  1  0.032249  0.723594  0.466165  1
  Ni  Ni17  1  0.384172  0.098777  0.504633  1
  Ni  Ni18  1  0.490701  0.640330  0.491828  1
  Ni  Ni19  1  0.842624  0.015513  0.530297  1
  Ni  Ni20  1  0.949113  0.557035  0.517493  1
  Ni  Ni21  1  0.301115  0.932253  0.555949  1
  Ni  Ni22  1  0.407544  0.473767  0.543161  1
  Ni  Ni23  1  0.759756  0.848994  0.581611  1
  Ni  Ni24  1  0.865899  0.390371  0.568839  1
  Ni  Ni25  1  0.218630  0.765874  0.607213  1
  Ni  Ni26  1  0.324368  0.307209  0.594508  1
  Ni  Ni27  1  0.678072  0.681996  0.632906  1
  Ni  Ni28  1  0.782224  0.223022  0.620216  1
  Ni  Ni29  1  0.137679  0.600193  0.658168  1
  Ni  Ni30  1  0.240941  0.141383  0.645858  1
  Ni  Ni31  1  0.596529  0.518634  0.684390  1
  Ni  Ni32  1  0.698093  0.055701  0.671546  1
  Ni  Ni33  1  0.051805  0.428577  0.708912  1
  Ni  Ni34  1  0.161671  0.973014  0.697357  1
