# generated using pymatgen
data_Hf6Al6CuIr5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.19319795
_cell_length_b   7.19319889
_cell_length_c   6.74348586
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000022
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf6Al6CuIr5
_chemical_formula_sum   'Hf6 Al6 Cu1 Ir5'
_cell_volume   302.17543957
_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
  Hf  Hf0  1  0.59471987  0.99962272  0.75000000  1.0
  Hf  Hf1  1  0.00037728  0.59509715  0.75000000  1.0
  Hf  Hf2  1  0.40490285  0.40528013  0.75000000  1.0
  Hf  Hf3  1  0.99967105  0.60348106  0.25000000  1.0
  Hf  Hf4  1  0.60381001  0.00032895  0.25000000  1.0
  Hf  Hf5  1  0.39651894  0.39618999  0.25000000  1.0
  Al  Al6  1  0.73890772  0.73888865  0.99683078  1.0
  Al  Al7  1  0.26111135  0.00001807  0.99683078  1.0
  Al  Al8  1  0.99998193  0.26109228  0.99683078  1.0
  Al  Al9  1  0.73890772  0.73888865  0.50316922  1.0
  Al  Al10  1  0.26111135  0.00001807  0.50316922  1.0
  Al  Al11  1  0.99998193  0.26109228  0.50316922  1.0
  Cu  Cu12  1  0.00000000  0.00000000  0.75000000  1.0
  Ir  Ir13  1  0.00000000  0.00000000  0.25000000  1.0
  Ir  Ir14  1  0.66666700  0.33333300  0.99829735  1.0
  Ir  Ir15  1  0.66666700  0.33333300  0.50170265  1.0
  Ir  Ir16  1  0.33333300  0.66666700  0.50084120  1.0
  Ir  Ir17  1  0.33333300  0.66666700  0.99915980  1.0