data_[H24Cl4O8F4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  H  2.2000  0.2500  0.0000
  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 [C2/c]
_cell_length_a [6.7939]
_cell_length_b [10.2927]
_cell_length_c [6.3109]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.7672]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [H6ClO2F]
_chemical_formula_sum '[H24 Cl4 O8 F4]'
_cell_volume [400.7175]
_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  0.1150  0.3609  0.4780  1.0
  H  H1  8  0.1921  0.1871  0.2761  1.0
  H  H2  8  0.1981  0.0298  0.3299  1.0
  Cl  Cl3  4  0.0000  0.1041  0.7500  1.0
  O  O4  8  0.2054  0.3870  0.6506  1.0
  F  F5  4  0.0000  0.2982  0.2500  1.0
]