data_[Cd4Sb2I16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Sb  2.0500  1.4500  0.8300
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.3867]
_cell_length_b [12.7227]
_cell_length_c [7.4169]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.0463]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cd2SbI8]
_chemical_formula_sum '[Cd4 Sb2 I16]'
_cell_volume [1138.6693]
_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
[
  Cd  Cd0  4  0.2141  0.0000  0.6758  1.0
  Sb  Sb1  2  0.0000  0.0000  0.0000  1.0
  I  I2  8  0.1001  0.1700  0.7964  1.0
  I  I3  4  0.0519  0.5000  0.2234  1.0
  I  I4  4  0.2197  0.0000  0.2931  1.0
]