data_[Cs8Tl2Au10]
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 [I4]
_cell_length_a [10.7675]
_cell_length_b [10.7675]
_cell_length_c [7.2685]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [79]
_chemical_formula_structural [Cs4TlAu5]
_chemical_formula_sum '[Cs8 Tl2 Au10]'
_cell_volume [842.7091]
_cell_formula_units_Z [2]
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  0.0832  0.7073  0.5370  1
  Tl  Tl1  2  0.0000  0.0000  0.8954  1
  Au  Au2  8  0.0792  0.7568  0.0432  1
  Au  Au3  2  0.0000  0.0000  0.2938  1
]