data_[Rh8Pb12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rh  2.2800  1.3500  0.7450
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [12.1752]
_cell_length_b [6.2699]
_cell_length_c [7.4907]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.1677]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Rh2Pb3]
_chemical_formula_sum '[Rh8 Pb12]'
_cell_volume [484.0363]
_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
[
  Rh  Rh0  8  0.0673  0.2742  0.9876  1.0
  Pb  Pb1  8  0.1884  0.4001  0.7701  1.0
  Pb  Pb2  4  0.0000  0.1004  0.2500  1.0
]