# generated using pymatgen
data_LiAl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.47100639
_cell_length_b   4.47100668
_cell_length_c   4.47506851
_cell_angle_alpha   119.96999422
_cell_angle_beta   119.96998342
_cell_angle_gamma   89.99999585
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiAl
_chemical_formula_sum   'Li2 Al2'
_cell_volume   63.31241035
_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  1  0.37500000  0.62500000  0.75000000  1.0
  Li  Li1  1  0.62500000  0.37500000  0.25000000  1.0
  Al  Al2  1  0.87500000  0.12500000  0.75000000  1.0
  Al  Al3  1  0.12500000  0.87500000  0.25000000  1.0