data_[Cd10Ag8Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Ag  1.9300  1.6000  1.0867
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.3752]
_cell_length_b [4.6246]
_cell_length_c [6.3920]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.4228]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cd5(Ag2Au)2]
_chemical_formula_sum '[Cd10 Ag8 Au4]'
_cell_volume [453.6850]
_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
[
  Cd  Cd0  4  0.1617  0.0000  0.9477  1.0
  Cd  Cd1  4  0.1884  0.0000  0.4793  1.0
  Cd  Cd2  2  0.0000  0.5000  0.0000  1.0
  Ag  Ag3  4  0.0172  0.0000  0.2775  1.0
  Ag  Ag4  4  0.0867  0.5000  0.6144  1.0
  Au  Au5  4  0.1660  0.5000  0.2141  1.0
]