data_[Ge1Sb2Pb3Au6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ge  2.0100  1.2500  0.7700
  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 [P-3m1]
_cell_length_a [6.0492]
_cell_length_b [6.0492]
_cell_length_c [9.2368]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [GeSb2(PbAu2)3]
_chemical_formula_sum '[Ge1 Sb2 Pb3 Au6]'
_cell_volume [292.7203]
_cell_formula_units_Z [1]
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
[
  Ge  Ge0  1  0.0000  0.0000  0.5000  1
  Sb  Sb1  2  0.3333  0.6667  0.0489  1
  Pb  Pb2  2  0.3333  0.6667  0.5973  1
  Pb  Pb3  1  0.0000  0.0000  0.0000  1
  Au  Au4  6  0.1687  0.3374  0.2869  1
]