data_[Pu4P8H8C4O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pu  1.2800  1.7500  0.9675
  P  2.1900  1.0000  0.5500
  H  2.2000  0.2500  0.0000
  C  2.5500  0.7000  0.3000
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.6026]
_cell_length_b [13.8258]
_cell_length_c [5.3917]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.4458]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [PuP2H2CO6]
_chemical_formula_sum '[Pu4 P8 H8 C4 O24]'
_cell_volume [588.3362]
_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  0.2348  0.0000  1
  P  P1  8  0.2459  0.8834  0.6312  1
  H  H2  4  0.0957  0.0000  0.7649  1
  H  H3  4  0.1866  0.5000  0.0208  1
  C  C4  4  0.2240  0.0000  0.7653  1
  O  O5  8  0.0652  0.3590  0.2968  1
  O  O6  8  0.1359  0.1216  0.3267  1
  O  O7  8  0.1960  0.1919  0.8012  1
]