data_[Rb6Pu4In2Se12]
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
  In  1.7800  1.5500  0.9400
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.4478]
_cell_length_b [12.8991]
_cell_length_c [8.3013]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.3888]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Rb3Pu2InSe6]
_chemical_formula_sum '[Rb6 Pu4 In2 Se12]'
_cell_volume [761.0590]
_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  0.0000  0.1657  0.5000  1
  Rb  Rb1  2  0.0000  0.5000  0.5000  1
  Pu  Pu2  4  0.0000  0.3332  0.0000  1
  In  In3  2  0.0000  0.0000  0.0000  1
  Se  Se4  8  0.2299  0.1655  0.1931  1
  Se  Se5  4  0.2333  0.5000  0.1928  1
]