data_[Cd4Pd16Pb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Pd  2.2000  1.4000  0.8462
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.5719]
_cell_length_b [4.1628]
_cell_length_c [6.3404]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.7029]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cd2Pd8Pb]
_chemical_formula_sum '[Cd4 Pd16 Pb2]'
_cell_volume [372.0160]
_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  4  0.2235  0.0000  0.6466  1.0
  Pd  Pd1  4  0.0418  0.0000  0.7228  1.0
  Pd  Pd2  4  0.0916  0.5000  0.4588  1.0
  Pd  Pd3  4  0.1408  0.0000  0.1866  1.0
  Pd  Pd4  4  0.1803  0.5000  0.9111  1.0
  Pb  Pb5  2  0.0000  0.5000  0.0000  1.0
]