data_[Cs2Tl4In2Bi4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Tl  1.6200  1.9000  1.3325
  In  1.7800  1.5500  0.9400
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [Pmc2_1]
_cell_length_a [5.5494]
_cell_length_b [8.7077]
_cell_length_c [9.5700]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [26]
_chemical_formula_structural [CsTl2InBi2]
_chemical_formula_sum '[Cs2 Tl4 In2 Bi4]'
_cell_volume [462.4495]
_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
[
  Cs  Cs0  2  0.0000  0.3917  0.4948  1.0
  Tl  Tl1  2  0.0000  0.1705  0.1410  1.0
  Tl  Tl2  2  0.5000  0.0518  0.4619  1.0
  In  In3  2  0.5000  0.3215  0.8490  1.0
  Bi  Bi4  2  0.0000  0.1361  0.8160  1.0
  Bi  Bi5  2  0.5000  0.3470  0.1917  1.0
]