data_[K1In1Hg2Cl4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  In  1.7800  1.5500  0.9400
  Hg  2.0000  1.5000  1.2450
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [6.4892]
_cell_length_b [7.7714]
_cell_length_c [7.8607]
_cell_angle_alpha [110.8858]
_cell_angle_beta [106.1221]
_cell_angle_gamma [107.5218]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [KIn(HgCl2)2]
_chemical_formula_sum '[K1 In1 Hg2 Cl4]'
_cell_volume [318.5057]
_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  1  0.0936  0.4658  0.5113  1.0
  In  In1  1  0.2485  0.9731  0.2474  1.0
  Hg  Hg2  1  0.4169  0.3784  0.9210  1.0
  Hg  Hg3  1  0.8630  0.2413  0.9197  1.0
  Cl  Cl4  1  0.1817  0.8437  0.9021  1.0
  Cl  Cl5  1  0.3792  0.7846  0.3984  1.0
  Cl  Cl6  1  0.5348  0.3335  0.4307  1.0
  Cl  Cl7  1  0.8952  0.9798  0.2824  1.0
]