data_[Cd2Pb6I12Cl4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Pb  2.3300  1.8000  1.1225
  I  2.6600  1.4000  1.2733
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.4544]
_cell_length_b [8.9472]
_cell_length_c [7.1203]
_cell_angle_alpha [90.0000]
_cell_angle_beta [97.8257]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CdPb3(I3Cl)2]
_chemical_formula_sum '[Cd2 Pb6 I12 Cl4]'
_cell_volume [975.3800]
_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  2  0.0000  0.0000  0.5000  1
  Pb  Pb1  4  0.2500  0.2500  0.5000  1
  Pb  Pb2  2  0.0000  0.5000  0.0000  1
  I  I3  8  0.0927  0.2456  0.7576  1
  I  I4  4  0.1375  0.0000  0.2480  1
  Cl  Cl5  4  0.1631  0.5000  0.2734  1
]