# generated using pymatgen
data_Al6CrIr3Ru2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.21743237
_cell_length_b   6.01032503
_cell_length_c   12.71350019
_cell_angle_alpha   89.99990501
_cell_angle_beta   89.99779473
_cell_angle_gamma   89.99997959
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al6CrIr3Ru2
_chemical_formula_sum   'Al12 Cr2 Ir6 Ru4'
_cell_volume   322.26357399
_cell_formula_units_Z   2
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
  Al  Al0  1  0.49997451  0.24257072  0.99534474  1.0
  Al  Al1  1  0.49997459  0.75742617  0.99534466  1.0
  Al  Al2  1  0.00011646  0.25740929  0.17132437  1.0
  Al  Al3  1  0.00011628  0.74258936  0.17132425  1.0
  Al  Al4  1  0.50006184  0.25549062  0.33881564  1.0
  Al  Al5  1  0.50006139  0.74451420  0.33881607  1.0
  Al  Al6  1  0.99999499  0.24972210  0.50055274  1.0
  Al  Al7  1  0.99998256  0.75027600  0.50055402  1.0
  Al  Al8  1  0.49992011  0.25025429  0.66615734  1.0
  Al  Al9  1  0.49991958  0.74974944  0.66615762  1.0
  Al  Al10  1  0.99992919  0.24447916  0.82786404  1.0
  Al  Al11  1  0.99992919  0.75552109  0.82786421  1.0
  Cr  Cr12  1  0.99997501  0.49999998  0.99995038  1.0
  Cr  Cr13  1  0.50013501  0.99999803  0.16666588  1.0
  Ir  Ir14  1  0.99998187  0.99999815  0.00519685  1.0
  Ir  Ir15  1  0.50009939  0.49999873  0.16136959  1.0
  Ir  Ir16  1  0.00004936  0.99999968  0.32843782  1.0
  Ir  Ir17  1  0.50000294  0.50000233  0.50136973  1.0
  Ir  Ir18  1  0.99993332  0.00000128  0.66533123  1.0
  Ir  Ir19  1  0.49992214  0.49999968  0.83821020  1.0
  Ru  Ru20  1  0.00004379  0.50000188  0.33334632  1.0
  Ru  Ru21  1  0.49999423  0.00000203  0.49954207  1.0
  Ru  Ru22  1  0.99994230  0.50000086  0.66716005  1.0
  Ru  Ru23  1  0.49994195  0.99999993  0.83330015  1.0