data_[Ce10Pu2Cd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Pu  1.2800  1.7500  0.9675
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [6.4498]
_cell_length_b [9.0439]
_cell_length_c [7.0532]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [Ce5PuCd2]
_chemical_formula_sum '[Ce10 Pu2 Cd4]'
_cell_volume [411.4197]
_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
[
  Ce  Ce0  8  0.2427  0.2269  0.9887  1
  Ce  Ce1  2  0.0000  0.5000  0.7153  1
  Pu  Pu2  2  0.0000  0.0000  0.2104  1
  Cd  Cd3  2  0.0000  0.0000  0.6990  1
  Cd  Cd4  2  0.0000  0.5000  0.2066  1
]