data_[In4Cl16]
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 [C2/m]
_cell_length_a [6.5867]
_cell_length_b [11.4033]
_cell_length_c [9.7498]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.2869]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [InCl4]
_chemical_formula_sum '[In4 Cl16]'
_cell_volume [724.6611]
_cell_formula_units_Z [4]
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  4  0.0000  0.1671  0.0000  1.0
  Cl  Cl1  8  0.1494  0.3185  0.8481  1.0
  Cl  Cl2  4  0.1054  0.0000  0.8486  1.0
  Cl  Cl3  4  0.1390  0.5000  0.4708  1.0
]