# generated using pymatgen
data_CaZrNiBi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.36632079
_cell_length_b   4.36632125
_cell_length_c   15.25390746
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99998170
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaZrNiBi2
_chemical_formula_sum   'Ca2 Zr2 Ni2 Bi4'
_cell_volume   251.85069010
_cell_formula_units_Z   2
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
  Ca  Ca0  1  0.66666700  0.33333300  0.39357054  1.0
  Ca  Ca1  1  0.33333300  0.66666700  0.89357054  1.0
  Zr  Zr2  1  0.33333300  0.66666700  0.63115984  1.0
  Zr  Zr3  1  0.66666700  0.33333300  0.13115984  1.0
  Ni  Ni4  1  0.00000000  0.00000000  0.69480942  1.0
  Ni  Ni5  1  0.00000000  0.00000000  0.19480942  1.0
  Bi  Bi6  1  0.33333300  0.66666700  0.25975820  1.0
  Bi  Bi7  1  0.00000000  0.00000000  0.02070000  1.0
  Bi  Bi8  1  0.00000000  0.00000000  0.52070000  1.0
  Bi  Bi9  1  0.66666700  0.33333300  0.75975820  1.0