data_[Zn8Sn4I24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  Sn  1.9600  1.4500  0.8300
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [14.7415]
_cell_length_b [13.5763]
_cell_length_c [7.6200]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.2813]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Zn2SnI6]
_chemical_formula_sum '[Zn8 Sn4 I24]'
_cell_volume [1495.5614]
_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  8  0.1924  0.4222  0.3139  1.0
  Sn  Sn1  4  0.0000  0.1153  0.2500  1.0
  I  I2  8  0.1235  0.0875  0.6466  1.0
  I  I3  8  0.1280  0.2646  0.1221  1.0
  I  I4  8  0.1330  0.4199  0.6191  1.0
]