data_[Ce12Ge12Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Ge  2.0100  1.2500  0.7700
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [4.4589]
_cell_length_b [10.9647]
_cell_length_c [14.8463]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [Ce3Ge3Au2]
_chemical_formula_sum '[Ce12 Ge12 Au8]'
_cell_volume [725.8396]
_cell_formula_units_Z [4]
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
[
  Ce  Ce0  8  0.0000  0.0837  0.6112  1.0
  Ce  Ce1  4  0.0000  0.3606  0.7500  1.0
  Ge  Ge2  8  0.0000  0.3926  0.5410  1.0
  Ge  Ge3  4  0.0000  0.3569  0.2500  1.0
  Au  Au4  8  0.0000  0.2122  0.0997  1.0
]