data_[Na16Cd4Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  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 [17.8421]
_cell_length_b [5.4429]
_cell_length_c [7.1899]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.0840]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Na8Cd2Au]
_chemical_formula_sum '[Na16 Cd4 Au2]'
_cell_volume [655.7757]
_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
[
  Na  Na0  4  0.0129  0.0000  0.7665  1.0
  Na  Na1  4  0.1149  0.5000  0.4172  1.0
  Na  Na2  4  0.1512  0.5000  0.9176  1.0
  Na  Na3  4  0.1878  0.0000  0.2265  1.0
  Cd  Cd4  4  0.1881  0.0000  0.6856  1.0
  Au  Au5  2  0.0000  0.5000  0.0000  1.0
]