data_[Cs16Tl4Au4]
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
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [12.0025]
_cell_length_b [17.3853]
_cell_length_c [8.5757]
_cell_angle_alpha [90.0000]
_cell_angle_beta [121.7763]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Cs4TlAu]
_chemical_formula_sum '[Cs16 Tl4 Au4]'
_cell_volume [1521.2445]
_cell_formula_units_Z [4]
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  8  0.1141  0.1693  0.5807  1.0
  Cs  Cs1  8  0.2105  0.4375  0.7882  1.0
  Tl  Tl2  4  0.0000  0.3631  0.2500  1.0
  Au  Au3  4  0.0000  0.0013  0.7500  1.0
]