data_[Hg4As10H12O4F62]
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
  H  2.2000  0.2500  0.0000
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [11.5475]
_cell_length_b [11.1234]
_cell_length_c [10.3981]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.3781]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Hg2As5H6O2F31]
_chemical_formula_sum '[Hg4 As10 H12 O4 F62]'
_cell_volume [1252.0220]
_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  0.4648  0.1443  0.8552  1
  As  As1  4  0.2050  0.1809  0.0482  1
  As  As2  4  0.2411  0.6784  0.2420  1
  As  As3  2  0.5000  0.0000  0.5000  1
  H  H4  4  0.1111  0.5793  0.9394  1
  H  H5  4  0.1137  0.0522  0.3708  1
  H  H6  4  0.1209  0.5735  0.7877  1
  O  O7  4  0.0842  0.5320  0.8502  1
  F  F8  4  0.0720  0.1211  0.9280  1
  F  F9  4  0.1114  0.6398  0.2823  1
  F  F10  4  0.1421  0.1843  0.1790  1
  F  F11  4  0.1517  0.6640  0.0617  1
  F  F12  4  0.1523  0.1691  0.4999  1
  F  F13  4  0.1968  0.6668  0.7272  1
  F  F14  4  0.2715  0.0401  0.1018  1
  F  F15  4  0.2796  0.1863  0.9237  1
  F  F16  4  0.2862  0.5262  0.2447  1
  F  F17  4  0.3287  0.6974  0.4175  1
  F  F18  4  0.3422  0.5219  0.9650  1
  F  F19  4  0.3503  0.2497  0.1675  1
  F  F20  4  0.3723  0.7212  0.1989  1
  F  F21  4  0.4692  0.1534  0.4511  1
  F  F22  4  0.4801  0.5386  0.8262  1
  F  F23  2  0.5000  0.0000  0.0000  1
]