data_[Cs6Ge8Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Ge  2.0100  1.2500  0.7700
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [7.3424]
_cell_length_b [13.2856]
_cell_length_c [6.2485]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [59]
_chemical_formula_structural [Cs3Ge4Au]
_chemical_formula_sum '[Cs6 Ge8 Au2]'
_cell_volume [609.5346]
_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
[
  Cs  Cs0  4  0.0000  0.2338  0.1574  1.0
  Cs  Cs1  2  0.0000  0.0000  0.5734  1.0
  Ge  Ge2  4  0.0000  0.3955  0.6633  1.0
  Ge  Ge3  4  0.1877  0.5000  0.9331  1.0
  Au  Au4  2  0.0000  0.5000  0.2997  1.0
]