data_[Tl4Cd4In20Bi8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Cd  1.6900  1.5500  1.0900
  In  1.7800  1.5500  0.9400
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.5574]
_cell_length_b [18.7939]
_cell_length_c [13.0722]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [TlCdIn5Bi2]
_chemical_formula_sum '[Tl4 Cd4 In20 Bi8]'
_cell_volume [1119.6452]
_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
[
  Tl  Tl0  4  0.0000  0.4782  0.4467  1.0
  Cd  Cd1  4  0.0000  0.1741  0.0056  1.0
  In  In2  4  0.0000  0.0295  0.1236  1.0
  In  In3  4  0.0000  0.2779  0.3498  1.0
  In  In4  4  0.0000  0.3347  0.9957  1.0
  In  In5  4  0.0000  0.3452  0.6763  1.0
  In  In6  4  0.0000  0.4368  0.2125  1.0
  Bi  Bi7  4  0.0000  0.1065  0.3420  1.0
  Bi  Bi8  4  0.0000  0.1796  0.6719  1.0
]