data_[Cs2Tl4Cd4]
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
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [7.3711]
_cell_length_b [7.4016]
_cell_length_c [7.7101]
_cell_angle_alpha [114.3865]
_cell_angle_beta [110.0657]
_cell_angle_gamma [91.3778]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Cs(TlCd)2]
_chemical_formula_sum '[Cs2 Tl4 Cd4]'
_cell_volume [353.0459]
_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  0.4343  0.3422  0.1946  1.0
  Tl  Tl1  2  0.0385  0.3979  0.7021  1.0
  Tl  Tl2  2  0.3170  0.0552  0.6041  1.0
  Cd  Cd3  2  0.0404  0.8675  0.7471  1.0
  Cd  Cd4  2  0.1994  0.8097  0.1331  1.0
]