# generated using pymatgen
data_Hf12Re6Ir5Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.60237910
_cell_length_b   6.49192202
_cell_length_c   13.80642226
_cell_angle_alpha   90.00000000
_cell_angle_beta   89.99996240
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf12Re6Ir5Ru
_chemical_formula_sum   'Hf12 Re6 Ir5 Ru1'
_cell_volume   412.51223566
_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  0.49999900  0.24742434  0.00000000  1.0
  Hf  Hf1  1  0.49999900  0.75257566  0.00000000  1.0
  Hf  Hf2  1  0.99999272  0.24872742  0.16512285  1.0
  Hf  Hf3  1  0.99999272  0.75127258  0.16512285  1.0
  Hf  Hf4  1  0.49999439  0.24994081  0.33297839  1.0
  Hf  Hf5  1  0.49999439  0.75005819  0.33297839  1.0
  Hf  Hf6  1  0.00000000  0.24996424  0.50000000  1.0
  Hf  Hf7  1  0.00000000  0.75003476  0.50000000  1.0
  Hf  Hf8  1  0.50000661  0.24994081  0.66702161  1.0
  Hf  Hf9  1  0.50000661  0.75005819  0.66702161  1.0
  Hf  Hf10  1  0.00000728  0.24872742  0.83487815  1.0
  Hf  Hf11  1  0.00000728  0.75127258  0.83487815  1.0
  Re  Re12  1  0.00000000  0.50000100  0.00000000  1.0
  Re  Re13  1  0.49999167  0.00000000  0.16749246  1.0
  Re  Re14  1  0.99999446  0.50000100  0.33333088  1.0
  Re  Re15  1  0.50000100  0.00000000  0.50000000  1.0
  Re  Re16  1  0.00000554  0.50000100  0.66666912  1.0
  Re  Re17  1  0.50000733  0.00000000  0.83250654  1.0
  Ir  Ir18  1  0.49998996  0.50000100  0.16694010  1.0
  Ir  Ir19  1  0.99999556  0.00000000  0.33372643  1.0
  Ir  Ir20  1  0.50000100  0.50000100  0.50000000  1.0
  Ir  Ir21  1  0.00000444  0.00000000  0.66627457  1.0
  Ir  Ir22  1  0.50000904  0.50000100  0.83305990  1.0
  Ru  Ru23  1  0.00000000  0.00000000  0.00000000  1.0