data_[Tl12Sb4F24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Sb  2.0500  1.4500  0.8300
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [Fmmm]
_cell_length_a [8.2818]
_cell_length_b [9.5831]
_cell_length_c [11.7008]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [69]
_chemical_formula_structural [Tl3SbF6]
_chemical_formula_sum '[Tl12 Sb4 F24]'
_cell_volume [928.6374]
_cell_formula_units_Z [4]
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  0.2500  0.2500  0.2500  1.0
  Tl  Tl1  4  0.0000  0.0000  0.5000  1.0
  Sb  Sb2  4  0.0000  0.0000  0.0000  1.0
  F  F3  16  0.1946  0.0000  0.8688  1.0
  F  F4  8  0.0000  0.2290  0.0000  1.0
]