data_[Pd4Pt2Pb16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pd  2.2000  1.4000  0.8462
  Pt  2.2800  1.3500  0.8050
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.5913]
_cell_length_b [4.8171]
_cell_length_c [7.1911]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.5085]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pd2PtPb8]
_chemical_formula_sum '[Pd4 Pt2 Pb16]'
_cell_volume [574.3778]
_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
[
  Pd  Pd0  4  0.1763  0.0000  0.6900  1.0
  Pt  Pt1  2  0.0000  0.5000  0.0000  1.0
  Pb  Pb2  4  0.0312  0.0000  0.7986  1.0
  Pb  Pb3  4  0.0891  0.5000  0.4512  1.0
  Pb  Pb4  4  0.1691  0.5000  0.9753  1.0
  Pb  Pb5  4  0.2106  0.0000  0.3237  1.0
]