data_[Li2Al10Zn8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Al  1.6100  1.2500  0.6750
  Zn  1.6500  1.3500  0.8800
]
_symmetry_space_group_name_H-M [I4]
_cell_length_a [8.2560]
_cell_length_b [8.2560]
_cell_length_c [5.0452]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [79]
_chemical_formula_structural [LiAl5Zn4]
_chemical_formula_sum '[Li2 Al10 Zn8]'
_cell_volume [343.8864]
_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
[
  Li  Li0  2  0.0000  0.0000  0.8020  1
  Al  Al1  8  0.0610  0.3432  0.0501  1
  Al  Al2  2  0.0000  0.0000  0.2877  1
  Zn  Zn3  8  0.1316  0.2459  0.5499  1
]