# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.10789078
_cell_length_b   8.91498806
_cell_length_c   46.68287058
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni72
_cell_volume   1709.61062007
_cell_formula_units_Z   72
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  0.251525  0.047504  0.302393  1
  Ni  Ni2  1  0.251525  0.780356  0.288591  1
  Ni  Ni3  1  0.251525  0.501553  0.277336  1
  Ni  Ni4  1  0.751525  0.070408  0.274306  1
  Ni  Ni5  1  0.751525  0.617699  0.297653  1
  Ni  Ni6  1  0.751525  0.343096  0.285131  1
  Ni  Ni7  1  0.251525  0.850771  0.340234  1
  Ni  Ni8  1  0.251525  0.583051  0.326987  1
  Ni  Ni9  1  0.251525  0.310725  0.314260  1
  Ni  Ni10  1  0.751525  0.884771  0.311534  1
  Ni  Ni11  1  0.751525  0.426226  0.335669  1
  Ni  Ni12  1  0.751525  0.155117  0.324566  1
  Ni  Ni13  1  0.251525  0.657475  0.378721  1
  Ni  Ni14  1  0.251525  0.388577  0.365541  1
  Ni  Ni15  1  0.251525  0.118767  0.353506  1
  Ni  Ni16  1  0.751525  0.693539  0.349148  1
  Ni  Ni17  1  0.751525  0.234309  0.375080  1
  Ni  Ni18  1  0.751525  0.963233  0.362378  1
  Ni  Ni19  1  0.251525  0.464814  0.417209  1
  Ni  Ni20  1  0.251525  0.196004  0.404613  1
  Ni  Ni21  1  0.251525  0.926145  0.391885  1
  Ni  Ni22  1  0.751525  0.502185  0.387536  1
  Ni  Ni23  1  0.751525  0.041081  0.413440  1
  Ni  Ni24  1  0.751525  0.771037  0.400559  1
  Ni  Ni25  1  0.251525  0.272564  0.455942  1
  Ni  Ni26  1  0.251525  0.003268  0.443148  1
  Ni  Ni27  1  0.251525  0.733764  0.430245  1
  Ni  Ni28  1  0.751525  0.310355  0.426300  1
  Ni  Ni29  1  0.751525  0.848395  0.451837  1
  Ni  Ni30  1  0.751525  0.579023  0.438990  1
  Ni  Ni31  1  0.251525  0.080116  0.494470  1
  Ni  Ni32  1  0.251525  0.810779  0.481583  1
  Ni  Ni33  1  0.251525  0.541488  0.468697  1
  Ni  Ni34  1  0.751525  0.117778  0.464738  1
  Ni  Ni35  1  0.751525  0.656055  0.490340  1
  Ni  Ni36  1  0.751525  0.386979  0.477603  1
  Ni  Ni37  1  0.251525  0.887607  0.532910  1
  Ni  Ni38  1  0.251525  0.618406  0.520045  1
  Ni  Ni39  1  0.251525  0.349330  0.507307  1
  Ni  Ni40  1  0.751525  0.925268  0.503178  1
  Ni  Ni41  1  0.751525  0.463897  0.528951  1
  Ni  Ni42  1  0.751525  0.194605  0.516065  1
  Ni  Ni43  1  0.251525  0.695030  0.571348  1
  Ni  Ni44  1  0.251525  0.426362  0.558658  1
  Ni  Ni45  1  0.251525  0.156990  0.545810  1
  Ni  Ni46  1  0.751525  0.732820  0.541706  1
  Ni  Ni47  1  0.751525  0.271620  0.567403  1
  Ni  Ni48  1  0.751525  1.002117  0.554499  1
  Ni  Ni49  1  0.251525  0.503199  0.610112  1
  Ni  Ni50  1  0.251525  0.234348  0.597089  1
  Ni  Ni51  1  0.251525  0.964304  0.584208  1
  Ni  Ni52  1  0.751525  0.540571  0.580439  1
  Ni  Ni53  1  0.751525  0.079239  0.605762  1
  Ni  Ni54  1  0.751525  0.809380  0.593035  1
  Ni  Ni55  1  0.251525  0.311846  0.648500  1
  Ni  Ni56  1  0.251525  0.042151  0.635270  1
  Ni  Ni57  1  0.251525  0.771076  0.622568  1
  Ni  Ni58  1  0.751525  0.347910  0.618927  1
  Ni  Ni59  1  0.751525  0.886618  0.644142  1
  Ni  Ni60  1  0.751525  0.616808  0.632107  1
  Ni  Ni61  1  0.251525  0.120614  0.686114  1
  Ni  Ni62  1  0.251525  0.850267  0.673082  1
  Ni  Ni63  1  0.251525  0.579159  0.661979  1
  Ni  Ni64  1  0.751525  0.154614  0.657414  1
  Ni  Ni65  1  0.751525  0.694659  0.683388  1
  Ni  Ni66  1  0.751525  0.422333  0.670661  1
  Ni  Ni67  1  0.251525  0.934976  0.723341  1
  Ni  Ni68  1  0.251525  0.662288  0.712517  1
  Ni  Ni69  1  0.251525  0.387685  0.699994  1
  Ni  Ni70  1  0.751525  0.957880  0.695255  1
  Ni  Ni71  1  0.751525  0.503832  0.720311  1
  Ni  Ni72  1  0.751525  0.225029  0.709057  1
