data_[Rb8Pu6Au2S16]
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
  Au  2.5400  1.3500  1.0700
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.6289]
_cell_length_b [8.4988]
_cell_length_c [7.8278]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.8756]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Rb4Pu3AuS8]
_chemical_formula_sum '[Rb8 Pu6 Au2 S16]'
_cell_volume [905.5456]
_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  0.2500  0.2500  0.0000  1
  Rb  Rb1  2  0.0000  0.0000  0.0000  1
  Rb  Rb2  2  0.0000  0.5000  0.0000  1
  Pu  Pu3  4  0.2500  0.2500  0.5000  1
  Pu  Pu4  2  0.0000  0.5000  0.5000  1
  Au  Au5  2  0.0000  0.0000  0.5000  1
  S  S6  8  0.0863  0.2808  0.3020  1
  S  S7  4  0.1574  0.0000  0.6688  1
  S  S8  4  0.1757  0.5000  0.6886  1
]