data_[Hg6As4F24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hg  2.0000  1.5000  1.2450
  As  2.1800  1.1500  0.6600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [5.3718]
_cell_length_b [8.2964]
_cell_length_c [10.8032]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.4861]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Hg3As2F12]
_chemical_formula_sum '[Hg6 As4 F24]'
_cell_volume [481.2971]
_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  0.2265  0.2433  0.0741  1
  Hg  Hg1  2  0.0000  0.0000  0.5000  1
  As  As2  4  0.3192  0.6570  0.6737  1
  F  F3  4  0.0392  0.5510  0.6427  1
  F  F4  4  0.1522  0.6744  0.2232  1
  F  F5  4  0.3091  0.7293  0.5198  1
  F  F6  4  0.3407  0.5808  0.8254  1
  F  F7  4  0.3927  0.2425  0.3049  1
  F  F8  4  0.4903  0.0143  0.1233  1
]