data_[Cs4Rb4Cd8I24]
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
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [12.7199]
_cell_length_b [17.5153]
_cell_length_c [11.3622]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.5397]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [CsRb(CdI3)2]
_chemical_formula_sum '[Cs4 Rb4 Cd8 I24]'
_cell_volume [2450.3323]
_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
[
  Cs  Cs0  4  0.0000  0.0507  0.2500  1.0
  Rb  Rb1  4  0.0000  0.4551  0.7500  1.0
  Cd  Cd2  8  0.1762  0.3459  0.4477  1.0
  I  I3  8  0.0402  0.3737  0.0627  1.0
  I  I4  8  0.2077  0.0204  0.5762  1.0
  I  I5  8  0.2247  0.2171  0.3117  1.0
]