data_[Pt4Rh4Pb12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pt  2.2800  1.3500  0.8050
  Rh  2.2800  1.3500  0.7450
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.1193]
_cell_length_b [3.5310]
_cell_length_c [10.2716]
_cell_angle_alpha [90.0000]
_cell_angle_beta [120.9091]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [PtRhPb3]
_chemical_formula_sum '[Pt4 Rh4 Pb12]'
_cell_volume [501.6090]
_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
[
  Pt  Pt0  4  0.0090  0.5000  0.6399  1
  Rh  Rh1  4  0.2189  0.0000  0.1843  1
  Pb  Pb2  4  0.1038  0.5000  0.2263  1
  Pb  Pb3  4  0.1359  0.0000  0.5872  1
  Pb  Pb4  4  0.1508  0.5000  0.9390  1
]