data_[Ge2Pb4Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ge  2.0100  1.2500  0.7700
  Pb  2.3300  1.8000  1.1225
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.9946]
_cell_length_b [6.2552]
_cell_length_c [8.9024]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.5453]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Ge(PbAu2)2]
_chemical_formula_sum '[Ge2 Pb4 Au8]'
_cell_volume [319.9946]
_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
[
  Ge  Ge0  2  0.1193  0.7500  0.7826  1
  Pb  Pb1  2  0.1349  0.7500  0.3970  1
  Pb  Pb2  2  0.2840  0.2500  0.0165  1
  Au  Au3  4  0.3791  0.0242  0.6969  1
  Au  Au4  2  0.2390  0.7500  0.0854  1
  Au  Au5  2  0.2956  0.2500  0.3985  1
]