data_[Na2Cd12Au2]
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 [Amm2]
_cell_length_a [4.7308]
_cell_length_b [7.3928]
_cell_length_c [10.1429]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [NaCd6Au]
_chemical_formula_sum '[Na2 Cd12 Au2]'
_cell_volume [354.7368]
_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  2  0.5000  0.0000  0.1185  1
  Cd  Cd1  4  0.0000  0.2069  0.6000  1
  Cd  Cd2  4  0.5000  0.2135  0.3991  1
  Cd  Cd3  2  0.0000  0.0000  0.3158  1
  Cd  Cd4  2  0.0000  0.0000  0.8769  1
  Au  Au5  2  0.5000  0.0000  0.6906  1
]