data_[Ce2Cd1Bi4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Cd  1.6900  1.5500  1.0900
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [P-4m2]
_cell_length_a [4.5947]
_cell_length_b [4.5947]
_cell_length_c [10.4927]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [115]
_chemical_formula_structural [Ce2CdBi4]
_chemical_formula_sum '[Ce2 Cd1 Bi4]'
_cell_volume [221.5175]
_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
[
  Ce  Ce0  2  0.0000  0.5000  0.2558  1.0
  Cd  Cd1  1  0.5000  0.5000  0.0000  1.0
  Bi  Bi2  2  0.0000  0.5000  0.8166  1.0
  Bi  Bi3  1  0.0000  0.0000  0.5000  1.0
  Bi  Bi4  1  0.5000  0.5000  0.5000  1.0
]