# generated using pymatgen
data_NiBi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.19019256
_cell_length_b   8.19448927
_cell_length_c   11.45924686
_cell_angle_alpha   79.76002458
_cell_angle_beta   79.59229435
_cell_angle_gamma   119.94532659
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NiBi
_chemical_formula_sum   'Ni16 Bi16'
_cell_volume   622.20828255
_cell_formula_units_Z   16
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  Ni0  1  0.24378556  0.25163462  0.50486327  1.0
  Ni  Ni1  1  0.76052773  0.75481812  0.48469746  1.0
  Ni  Ni2  1  0.22774060  0.89526175  0.87780868  1.0
  Ni  Ni3  1  0.77134615  0.10571866  0.12182580  1.0
  Ni  Ni4  1  0.12780842  0.12311133  0.75020362  1.0
  Ni  Ni5  1  0.87283522  0.88143157  0.24535754  1.0
  Ni  Ni6  1  0.76024230  0.26092523  0.50159422  1.0
  Ni  Ni7  1  0.23747057  0.73782476  0.50168454  1.0
  Ni  Ni8  1  -0.00010481  0.00006583  0.99896003  1.0
  Ni  Ni9  1  0.62027327  0.12029540  0.74840308  1.0
  Ni  Ni10  1  0.86865300  0.36654943  0.24958398  1.0
  Ni  Ni11  1  0.13093429  0.63138421  0.74855958  1.0
  Ni  Ni12  1  0.38421792  0.88223951  0.24973604  1.0
  Ni  Ni13  1  0.49893796  0.99889287  -0.00003015  1.0
  Ni  Ni14  1  0.00113779  0.50083950  0.00025804  1.0
  Ni  Ni15  1  0.02308727  0.35374992  0.62267448  1.0
  Bi  Bi16  1  0.84049546  0.53294913  0.62645966  1.0
  Bi  Bi17  1  0.14972326  0.47814382  0.37207247  1.0
  Bi  Bi18  1  0.35557810  0.02204096  0.62221687  1.0
  Bi  Bi19  1  0.64262940  0.97951100  0.37827944  1.0
  Bi  Bi20  1  0.89473851  0.23017505  0.87524916  1.0
  Bi  Bi21  1  0.10212437  0.76865247  0.12945701  1.0
  Bi  Bi22  1  0.40848678  0.25528528  0.87695355  1.0
  Bi  Bi23  1  0.13026675  0.28181674  0.12586104  1.0
  Bi  Bi24  1  0.86800697  0.71482075  0.87719680  1.0
  Bi  Bi25  1  0.59147283  0.74323084  0.12611630  1.0
  Bi  Bi26  1  0.40798456  0.71416696  0.87778693  1.0
  Bi  Bi27  1  0.58894921  0.28467074  0.12625788  1.0
  Bi  Bi28  1  0.83867946  0.99039009  0.63022813  1.0
  Bi  Bi29  1  0.63952864  0.47388030  0.37404375  1.0
  Bi  Bi30  1  0.37914092  0.53101765  0.63014013  1.0
  Bi  Bi31  1  0.15240254  0.98680650  0.37409865  1.0