data_[Hg10O4F24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hg  2.0000  1.5000  1.2450
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.0702]
_cell_length_b [6.0132]
_cell_length_c [7.6636]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.2392]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Hg5(OF6)2]
_chemical_formula_sum '[Hg10 O4 F24]'
_cell_volume [578.2807]
_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
[
  Hg  Hg0  4  0.1834  0.5000  0.8407  1
  Hg  Hg1  4  0.1857  0.5000  0.3478  1
  Hg  Hg2  2  0.0000  0.0000  0.5000  1
  O  O3  4  0.0000  0.2241  0.0000  1
  F  F4  8  0.1558  0.2532  0.5658  1
  F  F5  8  0.1785  0.2591  0.1048  1
  F  F6  4  0.0060  0.5000  0.7871  1
  F  F7  4  0.0231  0.0000  0.7859  1
]