data_[Cs4Cd16Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Cd  1.6900  1.5500  1.0900
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.5200]
_cell_length_b [7.7357]
_cell_length_c [5.6981]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.9829]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CsCd4Au]
_chemical_formula_sum '[Cs4 Cd16 Au4]'
_cell_volume [795.4728]
_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  4  0.2154  0.0000  0.1726  1.0
  Cd  Cd1  8  0.0849  0.1818  0.5772  1.0
  Cd  Cd2  4  0.0000  0.1962  0.0000  1.0
  Cd  Cd3  4  0.0882  0.5000  0.3037  1.0
  Au  Au4  4  0.0807  0.5000  0.8110  1.0
]