# generated using pymatgen
data_Li6HfSc11Ir6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.61071058
_cell_length_b   6.51922829
_cell_length_c   13.85558048
_cell_angle_alpha   90.00000000
_cell_angle_beta   89.99966816
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6HfSc11Ir6
_chemical_formula_sum   'Li6 Hf1 Sc11 Ir6'
_cell_volume   416.47484635
_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  0.00000000  0.99863249  0.00000000  1.0
  Li  Li1  1  0.49951370  0.50038616  0.16710118  1.0
  Li  Li2  1  0.99955398  0.99981319  0.33335458  1.0
  Li  Li3  1  0.50000000  0.50087727  0.50000000  1.0
  Li  Li4  1  0.00044802  0.99981319  0.66664542  1.0
  Li  Li5  1  0.50048530  0.50038616  0.83289882  1.0
  Hf  Hf6  1  0.50000000  0.24838891  0.00000000  1.0
  Sc  Sc7  1  0.50000000  0.74868806  0.00000000  1.0
  Sc  Sc8  1  0.99972588  0.24969565  0.16735588  1.0
  Sc  Sc9  1  0.99971478  0.75013764  0.16678454  1.0
  Sc  Sc10  1  0.49973087  0.25117046  0.33360710  1.0
  Sc  Sc11  1  0.49972346  0.75039842  0.33324210  1.0
  Sc  Sc12  1  0.00000000  0.24992019  0.50000000  1.0
  Sc  Sc13  1  0.00000000  0.75032020  0.50000000  1.0
  Sc  Sc14  1  0.50026813  0.25117046  0.66639290  1.0
  Sc  Sc15  1  0.50027554  0.75039842  0.66675790  1.0
  Sc  Sc16  1  0.00027312  0.24969565  0.83264412  1.0
  Sc  Sc17  1  0.00028422  0.75013764  0.83321546  1.0
  Ir  Ir18  1  0.00000000  0.48804538  0.00000000  1.0
  Ir  Ir19  1  0.49980295  0.00449923  0.16246168  1.0
  Ir  Ir20  1  0.99969167  0.50130214  0.33315363  1.0
  Ir  Ir21  1  0.50000000  0.00032672  0.50000000  1.0
  Ir  Ir22  1  0.00030833  0.50130214  0.66684637  1.0
  Ir  Ir23  1  0.50019905  0.00449923  0.83753832  1.0