data_[Ce84Fe32Bi28C48]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Fe  1.8300  1.4000  0.8525
  Bi  2.0200  1.6000  1.0350
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [16.0265]
_cell_length_b [16.0265]
_cell_length_c [16.0265]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [225]
_chemical_formula_structural [Ce21Fe8Bi7C12]
_chemical_formula_sum '[Ce84 Fe32 Bi28 C48]'
_cell_volume [4116.3941]
_cell_formula_units_Z [4]
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  48  0.0000  0.1709  0.1709  1
  Ce  Ce1  32  0.1386  0.1386  0.3614  1
  Ce  Ce2  4  0.0000  0.0000  0.5000  1
  Fe  Fe3  32  0.1940  0.1940  0.1940  1
  Bi  Bi4  24  0.0000  0.0000  0.2914  1
  Bi  Bi5  4  0.0000  0.0000  0.0000  1
  C  C6  48  0.1038  0.2500  0.2500  1
]