data_[Pu4Cd40Au8]
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 [Fmmm]
_cell_length_a [5.7005]
_cell_length_b [14.1695]
_cell_length_c [14.3770]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [69]
_chemical_formula_structural [Pu(Cd5Au)2]
_chemical_formula_sum '[Pu4 Cd40 Au8]'
_cell_volume [1161.2707]
_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
[
  Pu  Pu0  4  0.0000  0.0000  0.0000  1
  Cd  Cd1  16  0.0000  0.1066  0.3970  1
  Cd  Cd2  16  0.0000  0.1785  0.1704  1
  Cd  Cd3  8  0.2500  0.0000  0.2500  1
  Au  Au4  8  0.2500  0.2500  0.0000  1
]