data_[Cs4Li4Cd8I24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Li  0.9800  1.4500  0.9000
  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 [17.2984]
_cell_length_b [14.2939]
_cell_length_c [9.2678]
_cell_angle_alpha [90.0000]
_cell_angle_beta [118.1334]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [CsLi(CdI3)2]
_chemical_formula_sum '[Cs4 Li4 Cd8 I24]'
_cell_volume [2020.8355]
_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  0.1855  0.2500  1
  Li  Li1  4  0.0000  0.1826  0.7500  1
  Cd  Cd2  8  0.2114  0.4237  0.1473  1
  I  I3  8  0.1056  0.0597  0.6734  1
  I  I4  8  0.1387  0.2446  0.0443  1
  I  I5  8  0.1431  0.4464  0.3825  1
]