data_[Cs8Cd8Pb24]
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 [C2/c]
_cell_length_a [15.8785]
_cell_length_b [12.0638]
_cell_length_c [8.0161]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.0116]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [CsCdPb3]
_chemical_formula_sum '[Cs8 Cd8 Pb24]'
_cell_volume [1483.1190]
_cell_formula_units_Z [8]
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  0.0295  0.2500  1.0
  Cs  Cs1  4  0.0000  0.3574  0.7500  1.0
  Cd  Cd2  8  0.0947  0.3391  0.2786  1.0
  Pb  Pb3  8  0.1868  0.1659  0.0672  1.0
  Pb  Pb4  8  0.1899  0.1872  0.6196  1.0
  Pb  Pb5  8  0.2056  0.4845  0.6072  1.0
]