data_[Cs2Pu2N2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Pu  1.2800  1.7500  0.9675
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [4.1623]
_cell_length_b [4.1634]
_cell_length_c [13.3571]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.6239]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [CsPuN]
_chemical_formula_sum '[Cs2 Pu2 N2]'
_cell_volume [231.4518]
_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
[
  Cs  Cs0  2  0.2639  0.2500  0.3252  1
  Pu  Pu1  2  0.2475  0.2500  0.9306  1
  N  N2  2  0.2500  0.7500  1.0000  1
]