data_[Pu2Tl4Pd2Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pu  1.2800  1.7500  0.9675
  Tl  1.6200  1.9000  1.3325
  Pd  2.2000  1.4000  0.8462
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [7.5498]
_cell_length_b [10.6959]
_cell_length_c [7.4497]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [59]
_chemical_formula_structural [PuTl2PdCl6]
_chemical_formula_sum '[Pu2 Tl4 Pd2 Cl12]'
_cell_volume [601.5792]
_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  2  0.0000  0.0000  0.2483  1
  Tl  Tl1  4  0.0000  0.2913  0.7805  1
  Pd  Pd2  2  0.0000  0.5000  0.2581  1
  Cl  Cl3  4  0.0000  0.2498  0.2331  1
  Cl  Cl4  4  0.2381  0.5000  0.5119  1
  Cl  Cl5  4  0.2425  0.5000  0.0021  1
]