data_[H24I4O8F4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  H  2.2000  0.2500  0.0000
  I  2.6600  1.4000  1.2733
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [7.9659]
_cell_length_b [11.6206]
_cell_length_c [6.5677]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.4696]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [H6IO2F]
_chemical_formula_sum '[H24 I4 O8 F4]'
_cell_volume [507.1501]
_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
[
  H  H0  8  0.1031  0.3987  0.9458  1.0
  H  H1  8  0.1319  0.2825  0.1432  1.0
  H  H2  8  0.2323  0.1047  0.7299  1.0
  I  I3  4  0.0000  0.1271  0.2500  1.0
  O  O4  8  0.2029  0.3481  0.1190  1.0
  F  F5  4  0.0000  0.4529  0.7500  1.0
]