data_[Cs24Rb96Cd40]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Rb  0.8200  2.3500  1.6600
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [Ia-3d]
_cell_length_a [24.2668]
_cell_length_b [24.2668]
_cell_length_c [24.2668]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [230]
_chemical_formula_structural [Cs3Rb12Cd5]
_chemical_formula_sum '[Cs24 Rb96 Cd40]'
_cell_volume [14290.1522]
_cell_formula_units_Z [8]
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
[
  Cs  Cs0  24  0.0000  0.2500  0.1250  1
  Rb  Rb1  96  0.0497  0.0550  0.6317  1
  Cd  Cd2  24  0.0000  0.2500  0.3750  1
  Cd  Cd3  16  0.0000  0.0000  0.0000  1
]