data_[Cd1Bi1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [3.3357]
_cell_length_b [3.9322]
_cell_length_c [4.8442]
_cell_angle_alpha [87.3601]
_cell_angle_beta [71.5539]
_cell_angle_gamma [75.6780]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [CdBi]
_chemical_formula_sum '[Cd1 Bi1]'
_cell_volume [58.3658]
_cell_formula_units_Z [1]
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
[
  Cd  Cd0  1  0.7001  0.7735  0.6745  1.0
  Bi  Bi1  1  0.9090  0.2648  0.1483  1.0
]