# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.28916286
_cell_length_b   4.80093429
_cell_length_c   46.43763579
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   116.57504338
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni34
_cell_volume   855.215404448
_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  0.698281  0.772924  0.300369  1
  Ni  Ni2  1  0.829946  0.326617  0.289606  1
  Ni  Ni3  1  0.170050  0.691268  0.326350  1
  Ni  Ni4  1  0.281206  0.222972  0.313652  1
  Ni  Ni5  1  0.630404  0.601692  0.351372  1
  Ni  Ni6  1  0.744337  0.145974  0.339567  1
  Ni  Ni7  1  0.092600  0.521250  0.377590  1
  Ni  Ni8  1  0.199369  0.061876  0.364934  1
  Ni  Ni9  1  0.552033  0.436961  0.403204  1
  Ni  Ni10  1  0.657669  0.977139  0.390538  1
  Ni  Ni11  1  0.010613  0.353676  0.428972  1
  Ni  Ni12  1  0.116857  0.895409  0.416280  1
  Ni  Ni13  1  0.469447  0.270634  0.454697  1
  Ni  Ni14  1  0.575108  0.811725  0.441901  1
  Ni  Ni15  1  0.927865  0.187223  0.480391  1
  Ni  Ni16  1  0.033792  0.728708  0.467606  1
  Ni  Ni17  1  0.386366  0.104031  0.506097  1
  Ni  Ni18  1  0.492245  0.645485  0.493292  1
  Ni  Ni19  1  0.844819  0.020808  0.531782  1
  Ni  Ni20  1  0.950746  0.562293  0.518997  1
  Ni  Ni21  1  0.303503  0.937791  0.557488  1
  Ni  Ni22  1  0.409164  0.478882  0.544692  1
  Ni  Ni23  1  0.761754  0.854107  0.583109  1
  Ni  Ni24  1  0.867998  0.395840  0.570416  1
  Ni  Ni25  1  0.220942  0.772377  0.608851  1
  Ni  Ni26  1  0.326578  0.312555  0.596184  1
  Ni  Ni27  1  0.679242  0.687640  0.634454  1
  Ni  Ni28  1  0.786011  0.228266  0.621799  1
  Ni  Ni29  1  0.134274  0.603542  0.659821  1
  Ni  Ni30  1  0.248207  0.147824  0.648016  1
  Ni  Ni31  1  0.597405  0.526544  0.685736  1
  Ni  Ni32  1  0.708561  0.058248  0.673038  1
  Ni  Ni33  1  0.048665  0.422899  0.709782  1
  Ni  Ni34  1  0.180330  0.976592  0.699019  1
