# generated using pymatgen
data_Li5Hf(TiIr2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.30835663
_cell_length_b   6.04775726
_cell_length_c   12.87488933
_cell_angle_alpha   90.00000000
_cell_angle_beta   89.99975761
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Hf(TiIr2)6
_chemical_formula_sum   'Li5 Hf1 Ti6 Ir12'
_cell_volume   335.46676535
_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  0.49977630  0.50000000  0.16937388  1.0
  Li  Li1  1  0.99975195  0.00000000  0.33540553  1.0
  Li  Li2  1  0.50000409  0.50000000  0.50000641  1.0
  Li  Li3  1  0.00024012  0.00000000  0.66460234  1.0
  Li  Li4  1  0.50022638  0.50000000  0.83061933  1.0
  Hf  Hf5  1  0.00000024  0.00000000  0.99998475  1.0
  Ti  Ti6  1  0.00000026  0.50000000  0.99998697  1.0
  Ti  Ti7  1  0.49982725  0.00000000  0.17836334  1.0
  Ti  Ti8  1  0.99975428  0.50000000  0.33991685  1.0
  Ti  Ti9  1  0.49999823  0.00000000  0.50001789  1.0
  Ti  Ti10  1  0.00024285  0.50000000  0.66009843  1.0
  Ti  Ti11  1  0.50017260  0.00000000  0.82162485  1.0
  Ir  Ir12  1  0.50000021  0.25702835  0.99998429  1.0
  Ir  Ir13  1  0.50000021  0.74297165  0.99998429  1.0
  Ir  Ir14  1  0.99979869  0.25474175  0.17017723  1.0
  Ir  Ir15  1  0.99979869  0.74525725  0.17017723  1.0
  Ir  Ir16  1  0.49975458  0.25181011  0.33557273  1.0
  Ir  Ir17  1  0.49975458  0.74819089  0.33557273  1.0
  Ir  Ir18  1  0.99999964  0.24778538  0.50001438  1.0
  Ir  Ir19  1  0.99999964  0.75221362  0.50001438  1.0
  Ir  Ir20  1  0.50024173  0.25181654  0.66444425  1.0
  Ir  Ir21  1  0.50024173  0.74818446  0.66444425  1.0
  Ir  Ir22  1  0.00020088  0.25474319  0.82980583  1.0
  Ir  Ir23  1  0.00020088  0.74525581  0.82980583  1.0