# generated using pymatgen
data_Y3Hf(Al3Ir)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.48926985
_cell_length_b   7.47768020
_cell_length_c   9.35866750
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.62296248
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y3Hf(Al3Ir)6
_chemical_formula_sum   'Y3 Hf1 Al18 Ir6'
_cell_volume   455.60503621
_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
  Y  Y0  1  0.00504316  0.32852680  0.75000000  1.0
  Y  Y1  1  0.67100106  0.99500711  0.25000000  1.0
  Y  Y2  1  0.32944161  0.00536827  0.75000000  1.0
  Hf  Hf3  1  0.99600616  0.67226171  0.25000000  1.0
  Al  Al4  1  0.12834506  0.12486011  0.25000000  1.0
  Al  Al5  1  0.87016481  0.86897481  0.75000000  1.0
  Al  Al6  1  0.00083250  0.33814566  0.07751641  1.0
  Al  Al7  1  0.99865860  0.66524341  0.93010431  1.0
  Al  Al8  1  0.99865860  0.66524341  0.56989569  1.0
  Al  Al9  1  0.33198463  0.99840473  0.42232949  1.0
  Al  Al10  1  0.00083250  0.33814566  0.42248359  1.0
  Al  Al11  1  0.66497893  0.99763375  0.57340087  1.0
  Al  Al12  1  0.66497893  0.99763375  0.92659913  1.0
  Al  Al13  1  0.33198463  0.99840473  0.07767051  1.0
  Al  Al14  1  0.33414320  0.33415461  0.54740185  1.0
  Al  Al15  1  0.66889306  0.66637819  0.44341873  1.0
  Al  Al16  1  0.66889306  0.66637819  0.05658127  1.0
  Al  Al17  1  0.33414320  0.33415461  0.95259815  1.0
  Al  Al18  1  0.33406429  0.54810192  0.25000000  1.0
  Al  Al19  1  0.66099273  0.45295555  0.75000000  1.0
  Al  Al20  1  0.55427606  0.34505674  0.25000000  1.0
  Al  Al21  1  0.45251939  0.65989415  0.75000000  1.0
  Ir  Ir22  1  0.67291436  0.32841816  0.00166450  1.0
  Ir  Ir23  1  0.32759352  0.67252677  0.00194323  1.0
  Ir  Ir24  1  0.32759352  0.67252677  0.49805677  1.0
  Ir  Ir25  1  0.67291436  0.32841816  0.49833550  1.0
  Ir  Ir26  1  0.99907404  0.99859313  0.00205786  1.0
  Ir  Ir27  1  0.99907404  0.99859313  0.49794214  1.0