data_[In10Hg4Cl10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  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 [I4mm]
_cell_length_a [10.9122]
_cell_length_b [10.9122]
_cell_length_c [7.9633]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [107]
_chemical_formula_structural [In5Hg2Cl5]
_chemical_formula_sum '[In10 Hg4 Cl10]'
_cell_volume [948.2311]
_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
[
  In  In0  8  0.0000  0.2608  0.0398  1
  In  In1  2  0.0000  0.0000  0.4563  1
  Hg  Hg2  4  0.0000  0.5000  0.2767  1
  Cl  Cl3  8  0.1788  0.1788  0.2749  1
  Cl  Cl4  2  0.0000  0.0000  0.9246  1
]