data_[Ba2Tl4In2Bi4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  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 [4.9812]
_cell_length_b [10.3735]
_cell_length_c [8.4755]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [26]
_chemical_formula_structural [BaTl2InBi2]
_chemical_formula_sum '[Ba2 Tl4 In2 Bi4]'
_cell_volume [437.9496]
_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
[
  Ba  Ba0  2  0.0000  0.4084  0.9926  1.0
  Tl  Tl1  2  0.0000  0.1723  0.3413  1.0
  Tl  Tl2  2  0.5000  0.0649  0.0451  1.0
  In  In3  2  0.5000  0.3141  0.6533  1.0
  Bi  Bi4  2  0.0000  0.1399  0.7195  1.0
  Bi  Bi5  2  0.5000  0.3941  0.2938  1.0
]