# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.27967201
_cell_length_b   4.77310144
_cell_length_c   46.51558782
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   116.62748253
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni34
_cell_volume   849.410694157
_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  0.709395  0.766972  0.299804  1
  Ni  Ni2  1  0.822300  0.313117  0.289125  1
  Ni  Ni3  1  0.174930  0.684900  0.325190  1
  Ni  Ni4  1  0.278052  0.219372  0.312331  1
  Ni  Ni5  1  0.631749  0.596310  0.350639  1
  Ni  Ni6  1  0.739375  0.139206  0.338669  1
  Ni  Ni7  1  0.092091  0.515468  0.376512  1
  Ni  Ni8  1  0.196941  0.055967  0.363773  1
  Ni  Ni9  1  0.550251  0.430981  0.402206  1
  Ni  Ni10  1  0.656081  0.971913  0.389552  1
  Ni  Ni11  1  0.008902  0.348057  0.427954  1
  Ni  Ni12  1  0.114998  0.889453  0.415179  1
  Ni  Ni13  1  0.467432  0.264802  0.453671  1
  Ni  Ni14  1  0.573590  0.806119  0.440883  1
  Ni  Ni15  1  0.925947  0.181659  0.479386  1
  Ni  Ni16  1  0.032199  0.723104  0.466571  1
  Ni  Ni17  1  0.384456  0.098518  0.505091  1
  Ni  Ni18  1  0.490721  0.639959  0.492278  1
  Ni  Ni19  1  0.842979  0.015373  0.530798  1
  Ni  Ni20  1  0.949231  0.556817  0.517984  1
  Ni  Ni21  1  0.301588  0.932358  0.556486  1
  Ni  Ni22  1  0.407746  0.473674  0.543698  1
  Ni  Ni23  1  0.760179  0.849024  0.582190  1
  Ni  Ni24  1  0.866275  0.390420  0.569416  1
  Ni  Ni25  1  0.219097  0.766564  0.607817  1
  Ni  Ni26  1  0.324927  0.307496  0.595164  1
  Ni  Ni27  1  0.678236  0.682510  0.633596  1
  Ni  Ni28  1  0.783087  0.223009  0.620857  1
  Ni  Ni29  1  0.135802  0.599271  0.658701  1
  Ni  Ni30  1  0.243429  0.142166  0.646730  1
  Ni  Ni31  1  0.597126  0.519105  0.685039  1
  Ni  Ni32  1  0.700248  0.053577  0.672179  1
  Ni  Ni33  1  0.052878  0.425360  0.708244  1
  Ni  Ni34  1  0.165783  0.971505  0.697565  1
