data_[K2Ga2Hg1I6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Ga  1.8100  1.3000  0.7600
  Hg  2.0000  1.5000  1.2450
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.7063]
_cell_length_b [8.6323]
_cell_length_c [10.6552]
_cell_angle_alpha [100.7838]
_cell_angle_beta [101.3302]
_cell_angle_gamma [110.5090]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [K2Ga2HgI6]
_chemical_formula_sum '[K2 Ga2 Hg1 I6]'
_cell_volume [544.0362]
_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
[
  K  K0  2  0.1981  0.8479  0.1349  1.0
  Ga  Ga1  2  0.1109  0.3141  0.3292  1.0
  Hg  Hg2  1  0.0000  0.5000  0.5000  1.0
  I  I3  2  0.2150  0.9872  0.8357  1.0
  I  I4  2  0.2726  0.4590  0.1480  1.0
  I  I5  2  0.4091  0.1994  0.4323  1.0
]