data_[Hg4H8F24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hg  2.0000  1.5000  1.2450
  H  2.2000  0.2500  0.0000
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.6836]
_cell_length_b [8.2960]
_cell_length_c [5.9981]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.8152]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [HgH2F6]
_chemical_formula_sum '[Hg4 H8 F24]'
_cell_volume [481.6222]
_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
[
  Hg  Hg0  4  0.0000  0.2237  0.7500  1.0
  H  H1  8  0.1313  0.4190  0.1513  1.0
  F  F2  8  0.1233  0.0555  0.6435  1.0
  F  F3  8  0.1279  0.3914  0.6389  1.0
  F  F4  8  0.1289  0.3038  0.1272  1.0
]