data_[In4Br2Cl4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Br  2.9600  1.1500  0.8825
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [3.8974]
_cell_length_b [4.3547]
_cell_length_c [18.0422]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [In2BrCl2]
_chemical_formula_sum '[In4 Br2 Cl4]'
_cell_volume [306.2116]
_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  2  0.0000  0.5000  0.4433  1
  In  In1  2  0.0000  0.5000  0.6938  1
  Br  Br2  2  0.0000  0.5000  0.2479  1
  Cl  Cl3  2  0.0000  0.0000  0.0795  1
  Cl  Cl4  2  0.0000  0.5000  0.9028  1
]