data_[Na8Pu6Pt2S16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Pu  1.2800  1.7500  0.9675
  Pt  2.2800  1.3500  0.8050
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.2324]
_cell_length_b [7.6955]
_cell_length_c [7.9874]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.6196]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Na4Pu3PtS8]
_chemical_formula_sum '[Na8 Pu6 Pt2 S16]'
_cell_volume [736.8260]
_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
[
  Na  Na0  4  0.2500  0.2500  0.0000  1
  Na  Na1  2  0.0000  0.0000  0.0000  1
  Na  Na2  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
  Pt  Pt5  2  0.0000  0.0000  0.5000  1
  S  S6  8  0.0154  0.2201  0.3004  1
  S  S7  4  0.2198  0.5000  0.2412  1
  S  S8  4  0.2347  0.5000  0.7273  1
]