data_[Na6Pu4Rh2Se12]
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
  Rh  2.2800  1.3500  0.7450
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.9245]
_cell_length_b [11.9821]
_cell_length_c [7.4334]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.1284]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Na3Pu2RhSe6]
_chemical_formula_sum '[Na6 Pu4 Rh2 Se12]'
_cell_volume [586.1287]
_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  4  0.0000  0.1681  0.5000  1
  Na  Na1  2  0.0000  0.5000  0.5000  1
  Pu  Pu2  4  0.0000  0.3332  0.0000  1
  Rh  Rh3  2  0.0000  0.0000  0.0000  1
  Se  Se4  8  0.2273  0.1531  0.2221  1
  Se  Se5  4  0.2327  0.0000  0.7802  1
]