data_[Cs2Na1Tl4Au3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Na  0.9300  1.8000  1.1600
  Tl  1.6200  1.9000  1.3325
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P-4m2]
_cell_length_a [5.2767]
_cell_length_b [5.2767]
_cell_length_c [12.1934]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [115]
_chemical_formula_structural [Cs2NaTl4Au3]
_chemical_formula_sum '[Cs2 Na1 Tl4 Au3]'
_cell_volume [339.5130]
_cell_formula_units_Z [1]
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  2  0.0000  0.5000  0.7541  1.0
  Na  Na1  1  0.5000  0.5000  0.5000  1.0
  Tl  Tl2  2  0.0000  0.5000  0.3647  1.0
  Tl  Tl3  1  0.0000  0.0000  0.0000  1.0
  Tl  Tl4  1  0.5000  0.5000  0.0000  1.0
  Au  Au5  2  0.0000  0.5000  0.1214  1.0
  Au  Au6  1  0.0000  0.0000  0.5000  1.0
]