data_[Re4Hg4O16F4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Re  1.9000  1.3500  0.7125
  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 [9.4027]
_cell_length_b [7.8641]
_cell_length_c [8.3328]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.5820]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [ReHgO4F]
_chemical_formula_sum '[Re4 Hg4 O16 F4]'
_cell_volume [564.7018]
_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
[
  Re  Re0  4  0.1290  0.5000  0.2781  1.0
  Hg  Hg1  4  0.1976  0.0000  0.1547  1.0
  O  O2  8  0.2117  0.3194  0.2292  1.0
  O  O3  4  0.0762  0.5000  0.8502  1.0
  O  O4  4  0.1677  0.5000  0.5006  1.0
  F  F5  4  0.0256  0.0000  0.8438  1.0
]