data_[Co4Bi12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Co  1.8800  1.3500  0.7683
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [9.1809]
_cell_length_b [4.1465]
_cell_length_c [11.2890]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [CoBi3]
_chemical_formula_sum '[Co4 Bi12]'
_cell_volume [429.7580]
_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
[
  Co  Co0  4  0.0879  0.2500  0.5217  1.0
  Bi  Bi1  4  0.0900  0.7500  0.6770  1.0
  Bi  Bi2  4  0.1218  0.7500  0.0878  1.0
  Bi  Bi3  4  0.1957  0.7500  0.3948  1.0
]