data_[Na2Pu10I24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Pu  1.2800  1.7500  0.9675
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.8672]
_cell_length_b [13.6564]
_cell_length_c [15.3737]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0261]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [NaPu5I12]
_chemical_formula_sum '[Na2 Pu10 I24]'
_cell_volume [1651.7077]
_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
[
  Na  Na0  2  0.0000  0.0000  0.0000  1
  Pu  Pu1  4  0.0000  0.1667  0.5000  1
  Pu  Pu2  4  0.0000  0.3334  0.0000  1
  Pu  Pu3  2  0.0000  0.5000  0.5000  1
  I  I4  8  0.1671  0.3326  0.3805  1
  I  I5  8  0.1712  0.1713  0.1185  1
  I  I6  4  0.1573  0.5000  0.1186  1
  I  I7  4  0.1646  0.0000  0.3804  1
]