data_[Sb24Pd9Au3]
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
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [R-3]
_cell_length_a [9.3402]
_cell_length_b [9.3402]
_cell_length_c [11.5288]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [148]
_chemical_formula_structural [Sb8Pd3Au]
_chemical_formula_sum '[Sb24 Pd9 Au3]'
_cell_volume [871.0180]
_cell_formula_units_Z [3]
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  18  0.0018  0.7448  0.6279  1.0
  Sb  Sb1  6  0.0000  0.0000  0.1256  1.0
  Pd  Pd2  9  0.0000  0.5000  0.5000  1.0
  Au  Au3  3  -0.0000  0.0000  0.5000  1.0
]