data_[Cs4Pu2I10Cl2]
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
  I  2.6600  1.4000  1.2733
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [I4mm]
_cell_length_a [8.5890]
_cell_length_b [8.5890]
_cell_length_c [11.7547]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [107]
_chemical_formula_structural [Cs2PuI5Cl]
_chemical_formula_sum '[Cs4 Pu2 I10 Cl2]'
_cell_volume [867.1467]
_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  4  0.0000  0.5000  0.2473  1
  Pu  Pu1  2  0.0000  0.0000  0.9923  1
  I  I2  8  0.2481  0.2481  0.9978  1
  I  I3  2  0.0000  0.0000  0.2478  1
  Cl  Cl4  2  0.0000  0.0000  0.7741  1
]