data_[Nd16Pd24Pb8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Pd  2.2000  1.4000  0.8462
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Fmmm]
_cell_length_a [7.2003]
_cell_length_b [9.1529]
_cell_length_c [16.9717]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [69]
_chemical_formula_structural [Nd2Pd3Pb]
_chemical_formula_sum '[Nd16 Pd24 Pb8]'
_cell_volume [1118.4964]
_cell_formula_units_Z [8]
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
[
  Nd  Nd0  8  0.2439  0.0000  0.0000  1
  Nd  Nd1  8  0.2500  0.2500  0.2500  1
  Pd  Pd2  16  0.0000  0.2443  0.0802  1
  Pd  Pd3  8  0.0000  0.0000  0.1737  1
  Pb  Pb4  8  0.0000  0.0000  0.3371  1
]