data_[In2Cl4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [7.4540]
_cell_length_b [17.0326]
_cell_length_c [17.0326]
_cell_angle_alpha [120.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [InCl2]
_chemical_formula_sum '[In2 Cl4]'
_cell_volume [1872.7632]
_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  1  0.0988  0.4931  0.9862  1
  In  In1  1  0.5836  0.5271  0.0536  1
  Cl  Cl2  1  0.2875  0.6003  0.9738  1
  Cl  Cl3  1  0.3022  0.3718  0.9547  1
  Cl  Cl4  1  0.8319  0.4510  0.8945  1
  Cl  Cl5  1  0.9827  0.5567  0.1371  1
]