data_[B1Sb1Pd6Pb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  B  2.0400  0.8500  0.4100
  Sb  2.0500  1.4500  0.8300
  Pd  2.2000  1.4000  0.8462
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.7697]
_cell_length_b [5.8598]
_cell_length_c [6.9766]
_cell_angle_alpha [91.6199]
_cell_angle_beta [111.0805]
_cell_angle_gamma [118.9115]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [BSb(Pd3Pb)2]
_chemical_formula_sum '[B1 Sb1 Pd6 Pb2]'
_cell_volume [186.6611]
_cell_formula_units_Z [1]
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  0.0000  0.5000  0.5000  1
  Sb  Sb1  1  0.0000  0.0000  0.0000  1
  Pd  Pd2  2  0.1599  0.8337  0.3686  1
  Pd  Pd3  2  0.1757  0.3348  0.3683  1
  Pd  Pd4  2  0.4060  0.7163  0.7724  1
  Pb  Pb5  2  0.4762  0.2470  0.7873  1
]