data_[Sb6Pb2Au4]
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 [Amm2]
_cell_length_a [4.1606]
_cell_length_b [8.4791]
_cell_length_c [9.9682]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [Sb3PbAu2]
_chemical_formula_sum '[Sb6 Pb2 Au4]'
_cell_volume [351.6578]
_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  4  0.0000  0.1955  0.5557  1
  Sb  Sb1  2  0.5000  0.0000  0.1800  1
  Pb  Pb2  2  0.5000  0.0000  0.7719  1
  Au  Au3  2  0.0000  0.0000  0.9852  1
  Au  Au4  2  0.5000  0.0000  0.4515  1
]