data_[Pd6Rh3Pb12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pd  2.2000  1.4000  0.8462
  Rh  2.2800  1.3500  0.7450
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [4.4033]
_cell_length_b [4.4033]
_cell_length_c [29.9002]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Pd2RhPb4]
_chemical_formula_sum '[Pd6 Rh3 Pb12]'
_cell_volume [502.0780]
_cell_formula_units_Z [3]
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  6  0.0000  0.0000  0.4062  1.0
  Rh  Rh1  3  -0.0000  -0.0000  0.5000  1.0
  Pb  Pb2  6  0.0000  0.0000  0.7001  1.0
  Pb  Pb3  6  0.0000  0.0000  0.8760  1.0
]