data_BPb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.64
_cell_length_b   4.64
_cell_length_c   14.18
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BPb
_chemical_formula_sum   'B6 Pb6'
_cell_volume   264.86
_cell_formula_units_Z   6
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  1  0.0  0.0  0.81  1.0
  B  B1  1  0.0  0.0  0.37  1.0
  B  B2  1  0.0  0.68  0.6  1.0
  B  B3  1  0.0  0.68  0.99  1.0
  B  B4  1  0.32  0.34  0.19  1.0
  B  B5  1  0.32  0.34  0.58  1.0
  Pb  Pb6  1  0.0  0.0  0.41  1.0
  Pb  Pb7  1  0.0  0.0  0.76  1.0
  Pb  Pb8  1  0.0  0.68  0.09  1.0
  Pb  Pb9  1  0.0  0.68  0.33  1.0
  Pb  Pb10  1  0.32  0.34  0.84  1.0
  Pb  Pb11  1  0.32  0.34  0.09  1.0

data_BPb
_symmetry_space_group_name_H-M   C2
_cell_length_a   8.05
_cell_length_b   4.64
_cell_length_c   14.18
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   5
_chemical_formula_structural   BPb
_chemical_formula_sum   'B12 Pb12'
_cell_volume   529.72
_cell_formula_units_Z   12
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-x, y, -z'
  3  'x+1/2, y+1/2, z'
  4  '-x+1/2, y+1/2, -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  0.0  0.0  0.28  1.0
  B  B1  4  0.16  0.84  0.1  1.0
  B  B2  4  0.16  0.84  0.49  1.0
  Pb  Pb3  4  0.0  0.0  0.33  1.0
  Pb  Pb4  4  0.16  0.84  0.0  1.0
  Pb  Pb5  4  0.16  0.84  0.75  1.0

B B B B B B Pb Pb Pb Pb Pb Pb