# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.27479529
_cell_length_b   4.78357191
_cell_length_c   46.52624975
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   116.56784507
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni34
_cell_volume   850.942238614
_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  0.710158  0.772716  0.298796  1
  Ni  Ni2  1  0.828823  0.320843  0.288228  1
  Ni  Ni3  1  0.177295  0.690345  0.324849  1
  Ni  Ni4  1  0.282634  0.223550  0.311686  1
  Ni  Ni5  1  0.635194  0.603476  0.350337  1
  Ni  Ni6  1  0.743666  0.145727  0.338328  1
  Ni  Ni7  1  0.095740  0.523050  0.376199  1
  Ni  Ni8  1  0.201394  0.063682  0.363480  1
  Ni  Ni9  1  0.554142  0.438739  0.401847  1
  Ni  Ni10  1  0.660274  0.979606  0.389189  1
  Ni  Ni11  1  0.012794  0.355798  0.427549  1
  Ni  Ni12  1  0.119124  0.897192  0.414794  1
  Ni  Ni13  1  0.471349  0.272619  0.453222  1
  Ni  Ni14  1  0.577671  0.813929  0.440447  1
  Ni  Ni15  1  0.929856  0.189503  0.478892  1
  Ni  Ni16  1  0.036259  0.730935  0.466097  1
  Ni  Ni17  1  0.388364  0.106404  0.504555  1
  Ni  Ni18  1  0.494771  0.647834  0.491758  1
  Ni  Ni19  1  0.846876  0.023303  0.530216  1
  Ni  Ni20  1  0.953279  0.564736  0.517421  1
  Ni  Ni21  1  0.305464  0.940309  0.555867  1
  Ni  Ni22  1  0.411786  0.481620  0.543091  1
  Ni  Ni23  1  0.764011  0.857046  0.581519  1
  Ni  Ni24  1  0.870341  0.398440  0.568764  1
  Ni  Ni25  1  0.222861  0.774632  0.607124  1
  Ni  Ni26  1  0.328993  0.315500  0.594466  1
  Ni  Ni27  1  0.681741  0.690557  0.632833  1
  Ni  Ni28  1  0.787395  0.231188  0.620114  1
  Ni  Ni29  1  0.139469  0.608511  0.657986  1
  Ni  Ni30  1  0.247941  0.150763  0.645976  1
  Ni  Ni31  1  0.600501  0.530688  0.684627  1
  Ni  Ni32  1  0.705840  0.063893  0.671464  1
  Ni  Ni33  1  0.054312  0.433396  0.708085  1
  Ni  Ni34  1  0.172977  0.981523  0.697517  1
