data_[Hg6Pt2F12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hg  2.0000  1.5000  1.2450
  Pt  2.2800  1.3500  0.8050
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.8607]
_cell_length_b [4.8871]
_cell_length_c [12.3363]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.4409]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Hg3PtF6]
_chemical_formula_sum '[Hg6 Pt2 F12]'
_cell_volume [349.0712]
_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  0.2083  0.1479  0.7033  1
  Hg  Hg1  2  0.5000  0.0000  0.5000  1
  Pt  Pt2  2  0.0000  0.0000  0.0000  1
  F  F3  4  0.1146  0.2263  0.9107  1
  F  F4  4  0.2834  0.7309  0.5809  1
  F  F5  4  0.3629  0.7351  0.3415  1
]