data_[Na8Pd16Pb12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Pd  2.2000  1.4000  0.8462
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Cmce]
_cell_length_a [6.3277]
_cell_length_b [17.0486]
_cell_length_c [7.5100]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [64]
_chemical_formula_structural [Na2Pd4Pb3]
_chemical_formula_sum '[Na8 Pd16 Pb12]'
_cell_volume [810.1740]
_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
[
  Na  Na0  8  0.0000  0.0904  0.5935  1.0
  Pd  Pd1  8  0.0000  0.1640  0.9842  1.0
  Pd  Pd2  8  0.2500  0.0756  0.2500  1.0
  Pb  Pb3  8  0.2500  0.2420  0.2500  1.0
  Pb  Pb4  4  0.0000  0.0000  0.0000  1.0
]