data_[Cs2Ga2Hg1F6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Ga  1.8100  1.3000  0.7600
  Hg  2.0000  1.5000  1.2450
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [7.2361]
_cell_length_b [7.8703]
_cell_length_c [7.8891]
_cell_angle_alpha [92.9761]
_cell_angle_beta [116.3254]
_cell_angle_gamma [113.8663]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Cs2Ga2HgF6]
_chemical_formula_sum '[Cs2 Ga2 Hg1 F6]'
_cell_volume [353.2823]
_cell_formula_units_Z [1]
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
[
  Cs  Cs0  2  0.4075  0.7775  0.2016  1.0
  Ga  Ga1  2  0.1798  0.1424  0.1204  1.0
  Hg  Hg2  1  0.0000  0.5000  0.5000  1.0
  F  F3  2  0.1503  0.3635  0.1402  1.0
  F  F4  2  0.3111  0.1160  0.3718  1.0
  F  F5  2  0.4284  0.2070  0.0781  1.0
]