data_[Tl2Ag1Sb1Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Ag  1.9300  1.6000  1.0867
  Sb  2.0500  1.4500  0.8300
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [7.4449]
_cell_length_b [7.4651]
_cell_length_c [7.4689]
_cell_angle_alpha [118.8989]
_cell_angle_beta [119.4168]
_cell_angle_gamma [90.7242]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Tl2AgSbCl6]
_chemical_formula_sum '[Tl2 Ag1 Sb1 Cl6]'
_cell_volume [299.0630]
_cell_formula_units_Z [1]
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  2  0.2378  0.7708  0.5068  1.0
  Ag  Ag1  1  0.5000  0.5000  0.0000  1.0
  Sb  Sb2  1  0.0000  0.0000  0.0000  1.0
  Cl  Cl3  2  0.2075  0.2073  0.4938  1.0
  Cl  Cl4  2  0.2200  0.3332  0.0600  1.0
  Cl  Cl5  2  0.3083  0.8156  0.0086  1.0
]