data_[Li2Zn2Hg4F12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Zn  1.6500  1.3500  0.8800
  Hg  2.0000  1.5000  1.2450
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [5.6423]
_cell_length_b [5.7938]
_cell_length_c [9.8090]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.8317]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [LiZnHg2F6]
_chemical_formula_sum '[Li2 Zn2 Hg4 F12]'
_cell_volume [263.2092]
_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
[
  Li  Li0  2  0.0000  0.0000  0.5000  1.0
  Zn  Zn1  2  0.5000  0.0000  0.0000  1.0
  Hg  Hg2  4  0.2344  0.5515  0.7492  1.0
  F  F3  4  0.1572  0.7036  0.4524  1.0
  F  F4  4  0.2477  0.2077  0.4491  1.0
  F  F5  4  0.3452  0.5290  0.2506  1.0
]