data_[B8Rh24Pb8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  B  2.0400  0.8500  0.4100
  Rh  2.2800  1.3500  0.7450
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Cmce]
_cell_length_a [11.2657]
_cell_length_b [9.3408]
_cell_length_c [5.7061]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [64]
_chemical_formula_structural [BRh3Pb]
_chemical_formula_sum '[B8 Rh24 Pb8]'
_cell_volume [600.4551]
_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
[
  B  B0  8  0.0000  0.1669  0.5903  1.0
  Rh  Rh1  16  0.1218  0.1979  0.8797  1.0
  Rh  Rh2  8  0.0000  0.0507  0.2672  1.0
  Pb  Pb3  8  0.2500  0.0623  0.2500  1.0
]