data_[Tl6Zn9Sb3F36]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Zn  1.6500  1.3500  0.8800
  Sb  2.0500  1.4500  0.8300
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [7.4141]
_cell_length_b [7.4141]
_cell_length_c [19.8729]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Tl2Zn3SbF12]
_chemical_formula_sum '[Tl6 Zn9 Sb3 F36]'
_cell_volume [946.0276]
_cell_formula_units_Z [3]
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  6  0.0000  0.0000  0.4108  1
  Zn  Zn1  9  0.0000  0.5000  0.5000  1
  Sb  Sb2  3  0.0000  0.0000  0.0000  1
  F  F3  18  0.0633  0.5316  0.8530  1
  F  F4  18  0.0690  0.5345  0.6083  1
]