data_[Cs2Tl2Cd4Cl16]
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
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.5575]
_cell_length_b [7.9566]
_cell_length_c [9.5568]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.1412]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CsTl(CdCl4)2]
_chemical_formula_sum '[Cs2 Tl2 Cd4 Cl16]'
_cell_volume [767.1287]
_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  0.0000  0.5000  1.0
  Tl  Tl1  2  0.0000  0.0000  0.0000  1.0
  Cd  Cd2  4  0.0643  0.5000  0.7321  1.0
  Cl  Cl3  8  0.0526  0.2359  0.2132  1.0
  Cl  Cl4  4  0.1666  0.5000  0.5298  1.0
  Cl  Cl5  4  0.2471  0.0000  0.0151  1.0
]