data_[Cd2Sn4Pb16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Sn  1.9600  1.4500  0.8300
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.3516]
_cell_length_b [8.8871]
_cell_length_c [5.8079]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.8745]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cd(SnPb4)2]
_chemical_formula_sum '[Cd2 Sn4 Pb16]'
_cell_volume [722.1392]
_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  0.0000  1
  Sn  Sn1  4  0.1154  0.0000  0.5109  1
  Pb  Pb2  8  0.0718  0.2966  0.7876  1
  Pb  Pb3  4  0.1375  0.5000  0.3426  1
  Pb  Pb4  4  0.2282  0.0000  0.0728  1
]