data_[Zn4In12Cl24]
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 [Cmc2_1]
_cell_length_a [12.2006]
_cell_length_b [14.8838]
_cell_length_c [7.0486]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Zn(InCl2)3]
_chemical_formula_sum '[Zn4 In12 Cl24]'
_cell_volume [1279.9596]
_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
[
  Zn  Zn0  4  0.0000  0.2044  0.5381  1.0
  In  In1  8  0.1783  0.1068  0.9752  1.0
  In  In2  4  0.0000  0.4181  0.8864  1.0
  Cl  Cl3  8  0.1346  0.4708  0.1776  1.0
  Cl  Cl4  8  0.1446  0.2738  0.6979  1.0
  Cl  Cl5  4  0.0000  0.0579  0.6394  1.0
  Cl  Cl6  4  0.0000  0.2201  0.2201  1.0
]