# generated using pymatgen
data_HfAlIr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.32297923
_cell_length_b   5.32297923
_cell_length_c   8.22219200
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.53238015
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfAlIr
_chemical_formula_sum   'Hf4 Al4 Ir4'
_cell_volume   202.70057430
_cell_formula_units_Z   4
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  0.66530900  0.33469100  0.29001100  1.0
  Hf  Hf1  1  0.32893200  0.67106800  0.17854500  1.0
  Hf  Hf2  1  0.32893200  0.67106800  0.82145500  1.0
  Hf  Hf3  1  0.66530900  0.33469100  0.70998900  1.0
  Al  Al4  1  0.00547200  0.99452800  0.24550300  1.0
  Al  Al5  1  0.00547200  0.99452800  0.75449700  1.0
  Al  Al6  1  0.65564100  0.82740600  0.50000000  1.0
  Al  Al7  1  0.17259400  0.34435900  0.50000000  1.0
  Ir  Ir8  1  0.17102400  0.82897600  0.50000000  1.0
  Ir  Ir9  1  0.33740800  0.16936300  0.00000000  1.0
  Ir  Ir10  1  0.83063700  0.66259200  0.00000000  1.0
  Ir  Ir11  1  0.83326100  0.16673900  0.00000000  1.0