data_[Rb6Pu2Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Pu  1.2800  1.7500  0.9675
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.8423]
_cell_length_b [8.3170]
_cell_length_c [13.7178]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.9207]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Rb3PuCl6]
_chemical_formula_sum '[Rb6 Pu2 Cl12]'
_cell_volume [733.6296]
_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
[
  Rb  Rb0  4  0.2244  0.5676  0.2507  1
  Rb  Rb1  2  0.5000  0.0000  0.5000  1
  Pu  Pu2  2  0.0000  0.0000  0.0000  1
  Cl  Cl3  4  0.0990  0.7281  0.9293  1
  Cl  Cl4  4  0.2135  0.1829  0.9388  1
  Cl  Cl5  4  0.3479  0.5570  0.7235  1
]