data_[Ce16Bi10Te2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Bi  2.0200  1.6000  1.0350
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [I-4]
_cell_length_a [9.6470]
_cell_length_b [9.6470]
_cell_length_c [9.6288]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [82]
_chemical_formula_structural [Ce8Bi5Te]
_chemical_formula_sum '[Ce16 Bi10 Te2]'
_cell_volume [896.0985]
_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
[
  Ce  Ce0  8  0.0736  0.6735  0.5475  1
  Ce  Ce1  8  0.0760  0.8206  0.2019  1
  Bi  Bi2  8  0.1234  0.7519  0.8741  1
  Bi  Bi3  2  0.0000  0.0000  0.5000  1
  Te  Te4  2  0.0000  0.5000  0.2500  1
]