data_[Rb1Pu2U1S8]
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
  U  1.3800  1.7500  0.9913
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [6.1666]
_cell_length_b [8.4072]
_cell_length_c [6.4784]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.4685]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [RbPu2US8]
_chemical_formula_sum '[Rb1 Pu2 U1 S8]'
_cell_volume [335.8531]
_cell_formula_units_Z [1]
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  1  0.0000  0.5000  0.0000  1
  Pu  Pu1  2  0.5000  0.2476  0.5000  1
  U  U2  1  0.0000  0.0000  0.0000  1
  S  S3  4  0.2471  0.2004  0.1661  1
  S  S4  2  0.2712  0.5000  0.5873  1
  S  S5  2  0.2755  0.0000  0.6745  1
]