data_[B4Rh12Pb4]
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 [C2/m]
_cell_length_a [14.3727]
_cell_length_b [4.1043]
_cell_length_c [5.6384]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.0662]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [BRh3Pb]
_chemical_formula_sum '[B4 Rh12 Pb4]'
_cell_volume [326.4291]
_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
[
  B  B0  4  0.0992  0.5000  0.7942  1
  Rh  Rh1  4  0.1104  0.0000  0.8093  1
  Rh  Rh2  4  0.1954  0.5000  0.1084  1
  Rh  Rh3  4  0.2054  0.5000  0.6020  1
  Pb  Pb4  4  0.0854  0.0000  0.2974  1
]