data_[Sb4Pb2Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sb  2.0500  1.4500  0.8300
  Pb  2.3300  1.8000  1.1225
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [11.9547]
_cell_length_b [3.6095]
_cell_length_c [5.6179]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.4273]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Sb2PbAu]
_chemical_formula_sum '[Sb4 Pb2 Au2]'
_cell_volume [222.4300]
_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  0.0288  0.0000  0.0303  1.0
  Sb  Sb1  2  0.3276  0.5000  0.2111  1.0
  Pb  Pb2  2  0.1922  0.0000  0.6430  1.0
  Au  Au3  2  0.4514  0.0000  0.6156  1.0
]