data_[Tl4Cr2Cd2Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Cr  1.6600  1.4000  0.9400
  Cd  1.6900  1.5500  1.0900
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.1522]
_cell_length_b [7.2168]
_cell_length_c [12.5145]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.5704]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Tl2CrCdCl6]
_chemical_formula_sum '[Tl4 Cr2 Cd2 Cl12]'
_cell_volume [531.8961]
_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
[
  Tl  Tl0  4  0.2580  0.5403  0.7507  1.0
  Cr  Cr1  2  0.5000  0.0000  0.0000  1.0
  Cd  Cd2  2  0.0000  0.0000  0.5000  1.0
  Cl  Cl3  4  0.2054  0.5052  0.2570  1.0
  Cl  Cl4  4  0.2538  0.2044  0.0261  1.0
  Cl  Cl5  4  0.3218  0.7268  0.0260  1.0
]