data_[B2Rh6Pb2]
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 [P2/m]
_cell_length_a [5.8065]
_cell_length_b [4.2645]
_cell_length_c [6.5673]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.6028]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [BRh3Pb]
_chemical_formula_sum '[B2 Rh6 Pb2]'
_cell_volume [150.1285]
_cell_formula_units_Z [2]
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  2  0.1299  0.0000  0.7377  1.0
  Rh  Rh1  2  0.1594  0.5000  0.7578  1.0
  Rh  Rh2  2  0.2405  0.0000  0.4777  1.0
  Rh  Rh3  1  0.0000  0.0000  0.0000  1.0
  Rh  Rh4  1  0.5000  0.0000  0.0000  1.0
  Pb  Pb5  2  0.3482  0.5000  0.2281  1.0
]