data_[Li1Al1Zn4]
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 [P-1]
_cell_length_a [4.5154]
_cell_length_b [5.0310]
_cell_length_c [5.1021]
_cell_angle_alpha [94.3337]
_cell_angle_beta [112.5368]
_cell_angle_gamma [115.0317]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [LiAlZn4]
_chemical_formula_sum '[Li1 Al1 Zn4]'
_cell_volume [93.0012]
_cell_formula_units_Z [1]
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  1  0.0000  0.5000  0.0000  1.0
  Al  Al1  1  0.5000  0.0000  0.5000  1.0
  Zn  Zn2  2  0.2299  0.4013  0.5622  1.0
  Zn  Zn3  2  0.2698  0.0994  0.9384  1.0
]