data_[Sb2Pd2Pb6]
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 [P2_1/m]
_cell_length_a [8.1321]
_cell_length_b [4.4401]
_cell_length_c [8.9505]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.8466]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [SbPdPb3]
_chemical_formula_sum '[Sb2 Pd2 Pb6]'
_cell_volume [290.8507]
_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
[
  Sb  Sb0  2  0.0699  0.2500  0.2731  1
  Pd  Pd1  2  0.4804  0.7500  0.0932  1
  Pb  Pb2  2  0.1964  0.2500  0.9832  1
  Pb  Pb3  2  0.3130  0.7500  0.7116  1
  Pb  Pb4  2  0.3700  0.7500  0.3531  1
]