data_[Sb4Pd8Pb8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  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 [Cmc2_1]
_cell_length_a [3.7237]
_cell_length_b [14.2145]
_cell_length_c [8.9269]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Sb(PdPb)2]
_chemical_formula_sum '[Sb4 Pd8 Pb8]'
_cell_volume [472.5079]
_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
[
  Sb  Sb0  4  0.0000  0.3061  0.4322  1.0
  Pd  Pd1  4  0.0000  0.0573  0.9696  1.0
  Pd  Pd2  4  0.0000  0.2305  0.1523  1.0
  Pb  Pb3  4  0.0000  0.1098  0.6417  1.0
  Pb  Pb4  4  0.0000  0.4161  0.7895  1.0
]