data_[Ce4Pd8Pb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Pd  2.2000  1.4000  0.8462
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [7.1245]
_cell_length_b [4.7487]
_cell_length_c [10.4382]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [CePd2Pb]
_chemical_formula_sum '[Ce4 Pd8 Pb4]'
_cell_volume [353.1441]
_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
[
  Ce  Ce0  4  0.2168  0.7500  0.8459  1.0
  Pd  Pd1  4  0.0441  0.7500  0.1020  1.0
  Pd  Pd2  4  0.2356  0.7500  0.5584  1.0
  Pb  Pb3  4  0.0536  0.2500  0.6361  1.0
]