data_[Li4Zn8I24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Zn  1.6500  1.3500  0.8800
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [13.4913]
_cell_length_b [15.8916]
_cell_length_c [7.5380]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.8907]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Li(ZnI3)2]
_chemical_formula_sum '[Li4 Zn8 I24]'
_cell_volume [1509.8959]
_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
[
  Li  Li0  4  0.0000  0.2013  0.7500  1
  Zn  Zn1  8  0.2081  0.4320  0.8582  1
  I  I2  8  0.0805  0.0864  0.0598  1
  I  I3  8  0.1504  0.4285  0.1584  1
  I  I4  8  0.1509  0.2935  0.6650  1
]