data_[Ge2Au6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ge  2.0100  1.2500  0.7700
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.3587]
_cell_length_b [5.4319]
_cell_length_c [5.9452]
_cell_angle_alpha [76.0467]
_cell_angle_beta [86.3853]
_cell_angle_gamma [62.7156]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [GeAu3]
_chemical_formula_sum '[Ge2 Au6]'
_cell_volume [149.0336]
_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  0.3214  0.4422  0.2677  1.0
  Au  Au1  2  0.1939  0.5143  0.7892  1.0
  Au  Au2  2  0.2095  0.0619  0.6004  1.0
  Au  Au3  2  0.2578  0.9724  0.1141  1.0
]