data_[Ba12Cd16Rh8]
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
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [15.1729]
_cell_length_b [10.4361]
_cell_length_c [7.7824]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.4943]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Ba3(Cd2Rh)2]
_chemical_formula_sum '[Ba12 Cd16 Rh8]'
_cell_volume [1154.3185]
_cell_formula_units_Z [4]
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  8  0.1336  0.1050  0.6662  1.0
  Ba  Ba1  4  0.0000  0.4546  0.7500  1.0
  Cd  Cd2  8  0.1300  0.2597  0.1512  1.0
  Cd  Cd3  8  0.1977  0.4016  0.5511  1.0
  Rh  Rh4  8  0.2194  0.3595  0.9132  1.0
]