# generated using pymatgen
data_BPb3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.49707172
_cell_length_b   6.49497121
_cell_length_c   5.89979600
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.17548087
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BPb3
_chemical_formula_sum   'B2 Pb6'
_cell_volume   215.22457189
_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  1  0.33326100  0.66672400  0.75000100  1.0
  B  B1  1  0.66674300  0.33327000  0.25000100  1.0
  Pb  Pb2  1  0.16965600  0.33948600  0.25000100  1.0
  Pb  Pb3  1  0.66051700  0.83034500  0.25000100  1.0
  Pb  Pb4  1  0.16985100  0.83021100  0.25000100  1.0
  Pb  Pb5  1  0.83034000  0.66051300  0.75000100  1.0
  Pb  Pb6  1  0.33948400  0.16965600  0.75000100  1.0
  Pb  Pb7  1  0.83014900  0.16979200  0.75000100  1.0