data_[Tl6Cd3Rh9F36]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Cd  1.6900  1.5500  1.0900
  Rh  2.2800  1.3500  0.7450
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [7.6646]
_cell_length_b [7.6646]
_cell_length_c [18.3645]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Tl2CdRh3F12]
_chemical_formula_sum '[Tl6 Cd3 Rh9 F36]'
_cell_volume [934.3122]
_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  0.3625  1
  Cd  Cd1  3  0.0000  0.0000  0.0000  1
  Rh  Rh2  9  0.0000  0.5000  0.5000  1
  F  F3  18  0.0304  0.5152  0.6099  1
  F  F4  18  0.0646  0.5323  0.8497  1
]