data_[Li4Cd16Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Cd  1.6900  1.5500  1.0900
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [4.6979]
_cell_length_b [7.2026]
_cell_length_c [13.4155]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Li2Cd8Au]
_chemical_formula_sum '[Li4 Cd16 Au2]'
_cell_volume [453.9408]
_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
[
  Li  Li0  4  0.0000  0.5000  0.1948  1.0
  Cd  Cd1  8  0.0000  0.2092  0.6459  1.0
  Cd  Cd2  4  0.0000  0.0000  0.1587  1.0
  Cd  Cd3  4  0.0000  0.2998  0.0000  1.0
  Au  Au4  2  0.0000  0.5000  0.5000  1.0
]