data_[Rb8Tl24Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Tl  1.6200  1.9000  1.3325
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [16.8239]
_cell_length_b [10.9251]
_cell_length_c [7.2431]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.0747]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [RbTl3Au]
_chemical_formula_sum '[Rb8 Tl24 Au8]'
_cell_volume [1301.8371]
_cell_formula_units_Z [8]
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
[
  Rb  Rb0  4  0.0000  0.0385  0.7500  1.0
  Rb  Rb1  4  0.0000  0.3603  0.2500  1.0
  Tl  Tl2  8  0.1814  0.1636  0.5833  1.0
  Tl  Tl3  8  0.1814  0.1709  0.0993  1.0
  Tl  Tl4  8  0.1824  0.4970  0.0906  1.0
  Au  Au5  8  0.0837  0.3336  0.7813  1.0
]