# generated using pymatgen
data_Hf6Al6NiIr5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.11526585
_cell_length_b   7.11516850
_cell_length_c   6.84227384
_cell_angle_alpha   90.00002148
_cell_angle_beta   90.00001461
_cell_angle_gamma   119.99912633
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf6Al6NiIr5
_chemical_formula_sum   'Hf6 Al6 Ni1 Ir5'
_cell_volume   299.99307316
_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  0.59734257  0.99953265  0.75000811  1.0
  Hf  Hf1  1  0.00046712  0.59781251  0.75000906  1.0
  Hf  Hf2  1  0.40218208  0.40264667  0.75000670  1.0
  Hf  Hf3  1  0.99959674  0.59861543  0.24998649  1.0
  Hf  Hf4  1  0.59902247  0.00041270  0.24998770  1.0
  Hf  Hf5  1  0.40138016  0.40096491  0.24998745  1.0
  Al  Al6  1  0.74535843  0.74526535  0.99206753  1.0
  Al  Al7  1  0.25472462  0.00008793  0.99204874  1.0
  Al  Al8  1  0.99991932  0.25464237  0.99205850  1.0
  Al  Al9  1  0.74535372  0.74526074  0.50793246  1.0
  Al  Al10  1  0.25474420  0.00009294  0.50795815  1.0
  Al  Al11  1  0.99991958  0.25464712  0.50794121  1.0
  Ni  Ni12  1  0.99999268  0.99999982  0.75003675  1.0
  Ir  Ir13  1  0.00000614  0.99999522  0.25000753  1.0
  Ir  Ir14  1  0.66666825  0.33337623  0.99757192  1.0
  Ir  Ir15  1  0.66666843  0.33337698  0.50241038  1.0
  Ir  Ir16  1  0.33332597  0.66663427  0.50205863  1.0
  Ir  Ir17  1  0.33332751  0.66663614  0.99792368  1.0