data_[Ba12Cd4Rh2Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Cd  1.6900  1.5500  1.0900
  Rh  2.2800  1.3500  0.7450
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [8.1147]
_cell_length_b [9.0445]
_cell_length_c [14.4836]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.2548]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Ba6Cd2RhAu]
_chemical_formula_sum '[Ba12 Cd4 Rh2 Au2]'
_cell_volume [888.9161]
_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  0.1207  0.5254  0.2411  1.0
  Ba  Ba1  4  0.2221  0.1971  0.0564  1.0
  Ba  Ba2  4  0.3713  0.6746  0.0558  1.0
  Cd  Cd3  4  0.2996  0.6054  0.7501  1.0
  Rh  Rh4  2  0.0000  0.0000  0.5000  1.0
  Au  Au5  2  0.5000  0.0000  0.0000  1.0
]