data_[Nd8Rh16Pb12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Rh  2.2800  1.3500  0.7450
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Cmce]
_cell_length_a [6.2085]
_cell_length_b [17.2596]
_cell_length_c [7.3423]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [64]
_chemical_formula_structural [Nd2Rh4Pb3]
_chemical_formula_sum '[Nd8 Rh16 Pb12]'
_cell_volume [786.7770]
_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
[
  Nd  Nd0  8  0.0000  0.1014  0.5841  1.0
  Rh  Rh1  8  0.0000  0.1622  0.9698  1.0
  Rh  Rh2  8  0.2500  0.0751  0.2500  1.0
  Pb  Pb3  8  0.2500  0.2360  0.2500  1.0
  Pb  Pb4  4  0.0000  0.0000  0.0000  1.0
]