# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.27592024
_cell_length_b   4.77297500
_cell_length_c   46.49213688
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   116.62098330
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni34
_cell_volume   848.263966726
_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  0.713215  0.766103  0.299093  1
  Ni  Ni2  1  0.823099  0.310546  0.287539  1
  Ni  Ni3  1  0.176793  0.683413  0.324904  1
  Ni  Ni4  1  0.278369  0.220481  0.312060  1
  Ni  Ni5  1  0.633945  0.597730  0.350591  1
  Ni  Ni6  1  0.737217  0.138921  0.338281  1
  Ni  Ni7  1  0.092659  0.516089  0.376232  1
  Ni  Ni8  1  0.196822  0.057116  0.363543  1
  Ni  Ni9  1  0.550515  0.431901  0.401940  1
  Ni  Ni10  1  0.656263  0.973236  0.389235  1
  Ni  Ni11  1  0.008982  0.348737  0.427608  1
  Ni  Ni12  1  0.115136  0.890115  0.414837  1
  Ni  Ni13  1  0.467335  0.265339  0.453285  1
  Ni  Ni14  1  0.573775  0.806854  0.440498  1
  Ni  Ni15  1  0.925766  0.182069  0.478953  1
  Ni  Ni16  1  0.032264  0.723592  0.466149  1
  Ni  Ni17  1  0.384176  0.098773  0.504617  1
  Ni  Ni18  1  0.490715  0.640327  0.491812  1
  Ni  Ni19  1  0.842627  0.015508  0.530280  1
  Ni  Ni20  1  0.949126  0.557030  0.517477  1
  Ni  Ni21  1  0.301117  0.932246  0.555931  1
  Ni  Ni22  1  0.407556  0.473760  0.543144  1
  Ni  Ni23  1  0.759756  0.848985  0.581593  1
  Ni  Ni24  1  0.865909  0.390363  0.568822  1
  Ni  Ni25  1  0.218629  0.765864  0.607194  1
  Ni  Ni26  1  0.324377  0.307199  0.594490  1
  Ni  Ni27  1  0.678069  0.681984  0.632886  1
  Ni  Ni28  1  0.782232  0.223011  0.620197  1
  Ni  Ni29  1  0.137675  0.600179  0.658148  1
  Ni  Ni30  1  0.240947  0.141369  0.645838  1
  Ni  Ni31  1  0.596522  0.518619  0.684370  1
  Ni  Ni32  1  0.698098  0.055686  0.671526  1
  Ni  Ni33  1  0.051793  0.428554  0.708891  1
  Ni  Ni34  1  0.161676  0.972997  0.697336  1
