data_[Sb2Pd8Au4]
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 [P1]
_cell_length_a [5.8949]
_cell_length_b [7.0971]
_cell_length_c [7.2251]
_cell_angle_alpha [110.2337]
_cell_angle_beta [102.7829]
_cell_angle_gamma [109.6788]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Sb(Pd2Au)2]
_chemical_formula_sum '[Sb2 Pd8 Au4]'
_cell_volume [246.7729]
_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  1  0.2668  0.5536  0.8070  1.0
  Sb  Sb1  1  0.9310  0.0142  0.9786  1.0
  Pd  Pd2  1  0.0466  0.7843  0.6791  1.0
  Pd  Pd3  1  0.0902  0.2938  0.3896  1.0
  Pd  Pd4  1  0.2828  0.8882  0.1311  1.0
  Pd  Pd5  1  0.3163  0.0725  0.5476  1.0
  Pd  Pd6  1  0.3261  0.4358  0.1178  1.0
  Pd  Pd7  1  0.5001  0.7429  0.5890  1.0
  Pd  Pd8  1  0.7214  0.5528  0.8601  1.0
  Pd  Pd9  1  0.8569  0.1900  0.7037  1.0
  Au  Au10  1  0.5517  0.1643  0.9667  1.0
  Au  Au11  1  0.6270  0.3493  0.4158  1.0
  Au  Au12  1  0.7418  0.8648  0.3072  1.0
  Au  Au13  1  0.9912  0.5934  0.2567  1.0
]