data_[Cs4Cd8Pb40]
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
]
_symmetry_space_group_name_H-M [Fmmm]
_cell_length_a [6.4255]
_cell_length_b [15.6911]
_cell_length_c [17.0680]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [69]
_chemical_formula_structural [Cs(CdPb5)2]
_chemical_formula_sum '[Cs4 Cd8 Pb40]'
_cell_volume [1720.8641]
_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  0.0000  0.0000  1
  Cd  Cd1  8  0.2500  0.0000  0.2500  1
  Pb  Pb2  16  0.0000  0.1097  0.3812  1
  Pb  Pb3  16  0.0000  0.1781  0.1784  1
  Pb  Pb4  8  0.2500  0.2500  0.0000  1
]