data_[Cs12Tl36Sb6Pt6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Tl  1.6200  1.9000  1.3325
  Sb  2.0500  1.4500  0.8300
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [8.7991]
_cell_length_b [8.7991]
_cell_length_c [37.2804]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Cs2Tl6SbPt]
_chemical_formula_sum '[Cs12 Tl36 Sb6 Pt6]'
_cell_volume [2499.7147]
_cell_formula_units_Z [6]
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
[
  Cs  Cs0  6  0.0000  0.0000  0.1485  1.0
  Cs  Cs1  6  0.0000  0.0000  0.2847  1.0
  Tl  Tl2  18  0.0637  0.5319  0.1148  1.0
  Tl  Tl3  18  0.0697  0.5348  0.7203  1.0
  Sb  Sb4  6  0.0000  0.0000  0.3817  1.0
  Pt  Pt5  3  -0.0000  -0.0000  0.5000  1.0
  Pt  Pt6  3  0.0000  0.0000  0.0000  1.0
]