data_[Pu16Os2Ru10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pu  1.2800  1.7500  0.9675
  Os  2.2000  1.3000  0.6730
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [I-4]
_cell_length_a [8.3979]
_cell_length_b [8.3979]
_cell_length_c [8.3617]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [82]
_chemical_formula_structural [Pu8OsRu5]
_chemical_formula_sum '[Pu16 Os2 Ru10]'
_cell_volume [589.7079]
_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
[
  Pu  Pu0  8  0.0599  0.3188  0.5501  1
  Pu  Pu1  8  0.0751  0.1825  0.1860  1
  Ru  Ru2  8  0.1240  0.2430  0.8631  1
  Ru  Ru3  2  0.0000  0.0000  0.5000  1
  Os  Os4  2  0.0000  0.5000  0.2500  1
]