data_[Tl8Cr2Cl12]
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
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P4/mnc]
_cell_length_a [8.5898]
_cell_length_b [8.5898]
_cell_length_c [9.0091]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [128]
_chemical_formula_structural [Tl4CrCl6]
_chemical_formula_sum '[Tl8 Cr2 Cl12]'
_cell_volume [664.7279]
_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  8  0.1551  0.6551  0.2500  1
  Cr  Cr1  2  0.0000  0.0000  0.5000  1
  Cl  Cl2  8  0.1252  0.2799  0.5000  1
  Cl  Cl3  4  0.0000  0.0000  0.2354  1
]