data_[Ru4Xe8F36]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ru  2.2000  1.3000  0.6610
  Xe  2.6000  2.16  0.6200
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [Cc]
_cell_length_a [13.4793]
_cell_length_b [7.6847]
_cell_length_c [9.2798]
_cell_angle_alpha [90.0000]
_cell_angle_beta [130.8694]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [9]
_chemical_formula_structural [RuXe2F9]
_chemical_formula_sum '[Ru4 Xe8 F36]'
_cell_volume [726.8969]
_cell_formula_units_Z [4]
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
[
  Ru  Ru0  4  0.2437  0.1232  0.6717  1
  Xe  Xe1  4  0.0475  0.4123  0.1320  1
  Xe  Xe2  4  0.4133  0.4301  0.1931  1
  F  F3  4  0.0305  0.1992  0.9663  1
  F  F4  4  0.0721  0.1071  0.5833  1
  F  F5  4  0.0874  0.3967  0.8102  1
  F  F6  4  0.1799  0.0960  0.4217  1
  F  F7  4  0.2115  0.3640  0.6204  1
  F  F8  4  0.2795  0.1187  0.2215  1
  F  F9  4  0.3099  0.1576  0.9225  1
  F  F10  4  0.3291  0.4287  0.4555  1
  F  F11  4  0.4169  0.1584  0.7685  1
]