data_[Ru2Cl2O4F12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ru  2.2000  1.3000  0.6610
  Cl  3.1600  1.0000  0.7800
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2/c]
_cell_length_a [7.1891]
_cell_length_b [5.9122]
_cell_length_c [10.2867]
_cell_angle_alpha [90.0000]
_cell_angle_beta [132.2757]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [13]
_chemical_formula_structural [RuCl(OF3)2]
_chemical_formula_sum '[Ru2 Cl2 O4 F12]'
_cell_volume [323.5060]
_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
[
  Ru  Ru0  2  0.5000  0.0184  0.7500  1.0
  Cl  Cl1  2  0.0000  0.3386  0.7500  1.0
  O  O2  4  0.1406  0.4645  0.9097  1.0
  F  F3  4  0.2235  0.0229  0.5045  1.0
  F  F4  4  0.3400  0.2004  0.2768  1.0
  F  F5  4  0.3459  0.2584  0.7788  1.0
]