data_[Ba6Li8Cd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Li  0.9800  1.4500  0.9000
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.5076]
_cell_length_b [5.1917]
_cell_length_c [10.1678]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.5584]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ba3(Li2Cd)2]
_chemical_formula_sum '[Ba6 Li8 Cd4]'
_cell_volume [622.1617]
_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
[
  Ba  Ba0  4  0.1353  0.5000  0.6846  1.0
  Ba  Ba1  2  0.0000  0.0000  0.0000  1.0
  Li  Li2  4  0.1196  0.0000  0.4265  1.0
  Li  Li3  4  0.2224  0.5000  0.0687  1.0
  Cd  Cd4  4  0.1554  0.5000  0.3159  1.0
]