data_[Pu4Sb2Se10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pu  1.2800  1.7500  0.9675
  Sb  2.0500  1.4500  0.8300
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [Pbam]
_cell_length_a [8.0363]
_cell_length_b [12.0135]
_cell_length_c [4.1037]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [55]
_chemical_formula_structural [Pu2SbSe5]
_chemical_formula_sum '[Pu4 Sb2 Se10]'
_cell_volume [396.1863]
_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
[
  Pu  Pu0  4  0.0406  0.3274  0.5000  1
  Sb  Sb1  2  0.0000  0.0000  0.0000  1
  Se  Se2  4  0.1726  0.7977  0.0000  1
  Se  Se3  4  0.1815  0.0981  0.5000  1
  Se  Se4  2  0.0000  0.5000  0.0000  1
]