data_[Pu8Cd6Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pu  1.2800  1.7500  0.9675
  Cd  1.6900  1.5500  1.0900
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [5.3345]
_cell_length_b [5.7799]
_cell_length_c [17.1493]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Pu4Cd3Au4]
_chemical_formula_sum '[Pu8 Cd6 Au8]'
_cell_volume [528.7575]
_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
[
  Pu  Pu0  8  0.0000  0.2497  0.3225  1
  Cd  Cd1  4  0.0000  0.0000  0.0949  1
  Cd  Cd2  2  0.0000  0.5000  0.0000  1
  Au  Au3  4  0.0000  0.2539  0.5000  1
  Au  Au4  4  0.0000  0.5000  0.1640  1
]