data_[Ce4Au4S4O4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Au  2.5400  1.3500  1.0700
  S  2.5800  1.0000  0.8800
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1]
_cell_length_a [5.9162]
_cell_length_b [5.9153]
_cell_length_c [11.1685]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.1487]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [4]
_chemical_formula_structural [CeAuSO]
_chemical_formula_sum '[Ce4 Au4 S4 O4]'
_cell_volume [390.5825]
_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  2  0.0067  0.3197  0.1060  1
  Ce  Ce1  2  0.4929  0.3201  0.8941  1
  Au  Au2  2  0.1998  0.5946  0.4972  1
  Au  Au3  2  0.4979  0.3417  0.2869  1
  S  S4  2  0.2145  0.6207  0.2919  1
  S  S5  2  0.2201  0.5650  0.7031  1
  O  O6  2  0.2486  0.0692  0.0001  1
  O  O7  2  0.2511  0.5690  0.9990  1
]