data_[Li24Al8Zn8]
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 [C2/c]
_cell_length_a [10.4840]
_cell_length_b [8.8641]
_cell_length_c [7.6580]
_cell_angle_alpha [90.0000]
_cell_angle_beta [118.6582]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Li3AlZn]
_chemical_formula_sum '[Li24 Al8 Zn8]'
_cell_volume [624.4791]
_cell_formula_units_Z [8]
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  8  0.0926  0.1262  0.6456  1
  Li  Li1  8  0.2000  0.1205  0.0459  1
  Li  Li2  8  0.2039  0.3722  0.5575  1
  Al  Al3  8  0.0947  0.3722  0.1440  1
  Zn  Zn4  4  0.0000  0.1300  0.2500  1
  Zn  Zn5  4  0.0000  0.3813  0.7500  1
]