data_[Rb12Tl36Pt6Au6]
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
  Pt  2.2800  1.3500  0.8050
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [8.4694]
_cell_length_b [8.4694]
_cell_length_c [35.6611]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Rb2Tl6PtAu]
_chemical_formula_sum '[Rb12 Tl36 Pt6 Au6]'
_cell_volume [2215.2879]
_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
[
  Rb  Rb0  6  0.0000  0.0000  0.1436  1.0
  Rb  Rb1  6  0.0000  0.0000  0.2925  1.0
  Tl  Tl2  18  0.0369  0.5184  0.1167  1.0
  Tl  Tl3  18  0.0522  0.5261  0.7184  1.0
  Pt  Pt4  3  -0.0000  -0.0000  0.5000  1.0
  Pt  Pt5  3  0.0000  0.0000  0.0000  1.0
  Au  Au6  6  0.0000  0.0000  0.3878  1.0
]