data_[Zn2In2Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  In  1.7800  1.5500  0.9400
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.6279]
_cell_length_b [10.0105]
_cell_length_c [6.2867]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.8467]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [ZnInCl3]
_chemical_formula_sum '[Zn2 In2 Cl6]'
_cell_volume [321.3941]
_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
[
  Zn  Zn0  2  0.1125  0.2500  0.7457  1.0
  In  In1  2  0.4186  0.2500  0.5238  1.0
  Cl  Cl2  4  0.1822  0.5772  0.3162  1.0
  Cl  Cl3  2  0.4485  0.2500  0.1253  1.0
]