data_[Ce16Os4Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Os  2.2000  1.3000  0.6730
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.0641]
_cell_length_b [12.7924]
_cell_length_c [11.4309]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Ce4OsAu]
_chemical_formula_sum '[Ce16 Os4 Au4]'
_cell_volume [594.2806]
_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  4  0.0000  0.0741  0.2731  1
  Ce  Ce1  4  0.0000  0.1433  0.5202  1
  Ce  Ce2  4  0.0000  0.2752  0.7964  1
  Ce  Ce3  4  0.0000  0.4195  0.4908  1
  Os  Os4  4  0.0000  0.2101  0.0638  1
  Au  Au5  4  0.0000  0.4011  0.2167  1
]