# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.47698702
_cell_length_b   7.68647900
_cell_length_c   48.66039874
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   99.22130014
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni36
_cell_volume   914.487484652
_cell_formula_units_Z   36
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  0.849472  0.697919  0.305450  1
  Ni  Ni2  1  0.229251  0.457741  0.329758  1
  Ni  Ni3  1  0.609815  0.218485  0.352717  1
  Ni  Ni4  1  0.458029  0.915669  0.333478  1
  Ni  Ni5  1  0.697380  0.395152  0.287001  1
  Ni  Ni6  1  0.074893  0.149440  0.308952  1
  Ni  Ni7  1  0.991454  0.981562  0.376955  1
  Ni  Ni8  1  0.372531  0.743575  0.400873  1
  Ni  Ni9  1  0.753564  0.505426  0.424588  1
  Ni  Ni10  1  0.602072  0.203289  0.404730  1
  Ni  Ni11  1  0.839589  0.678753  0.357417  1
  Ni  Ni12  1  0.220447  0.440228  0.380951  1
  Ni  Ni13  1  0.134854  0.267799  0.448448  1
  Ni  Ni14  1  0.516086  0.030076  0.472310  1
  Ni  Ni15  1  0.897262  0.792231  0.496128  1
  Ni  Ni16  1  0.745831  0.490234  0.476276  1
  Ni  Ni17  1  0.983488  0.965949  0.428642  1
  Ni  Ni18  1  0.364597  0.727966  0.452448  1
  Ni  Ni19  1  0.278524  0.554560  0.519977  1
  Ni  Ni20  1  0.659758  0.316827  0.543804  1
  Ni  Ni21  1  0.040867  0.078845  0.567610  1
  Ni  Ni22  1  0.889501  0.776995  0.547804  1
  Ni  Ni23  1  0.127093  0.252562  0.500125  1
  Ni  Ni24  1  0.508269  0.014717  0.523942  1
  Ni  Ni25  1  0.422284  0.841504  0.591523  1
  Ni  Ni26  1  0.803908  0.604566  0.615301  1
  Ni  Ni27  1  0.184766  0.366040  0.638835  1
  Ni  Ni28  1  0.032901  0.063231  0.619297  1
  Ni  Ni29  1  0.270791  0.539367  0.571665  1
  Ni  Ni30  1  0.651825  0.301218  0.595379  1
  Ni  Ni31  1  0.566326  0.129124  0.662774  1
  Ni  Ni32  1  0.949462  0.895354  0.687300  1
  Ni  Ni33  1  0.326975  0.649641  0.709251  1
  Ni  Ni34  1  0.174883  0.346874  0.690802  1
  Ni  Ni35  1  0.414540  0.826309  0.643535  1
  Ni  Ni36  1  0.795104  0.587053  0.666494  1
