data_[Cs4Cd4Pb4Cl20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Cd  1.6900  1.5500  1.0900
  Pb  2.3300  1.8000  1.1225
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.6485]
_cell_length_b [13.0440]
_cell_length_c [10.4874]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.5697]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [CsCdPbCl5]
_chemical_formula_sum '[Cs4 Cd4 Pb4 Cl20]'
_cell_volume [1209.7699]
_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  0.3431  0.2500  1.0
  Cd  Cd1  4  0.0000  0.3130  0.7500  1.0
  Pb  Pb2  4  0.0000  0.0000  0.0000  1.0
  Cl  Cl3  8  0.1093  0.2080  0.6117  1.0
  Cl  Cl4  8  0.1836  0.4303  0.9315  1.0
  Cl  Cl5  4  0.0000  0.0815  0.2500  1.0
]