# generated using pymatgen
data_HfSc6Sb5Ru12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.50278778
_cell_length_b   6.37167576
_cell_length_c   13.50415597
_cell_angle_alpha   89.99995639
_cell_angle_beta   89.99993313
_cell_angle_gamma   90.00005804
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfSc6Sb5Ru12
_chemical_formula_sum   'Hf1 Sc6 Sb5 Ru12'
_cell_volume   387.43833647
_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  0.00000011  0.49999654  0.00000836  1.0
  Sc  Sc1  1  0.99999973  0.99999624  0.00001739  1.0
  Sc  Sc2  1  0.49996184  0.49999725  0.16964117  1.0
  Sc  Sc3  1  0.99994673  0.00000741  0.33307053  1.0
  Sc  Sc4  1  0.50000094  0.49999988  0.49997558  1.0
  Sc  Sc5  1  0.00005529  0.99999978  0.66691152  1.0
  Sc  Sc6  1  0.50003908  0.49999792  0.83036794  1.0
  Sb  Sb7  1  0.49997468  0.00000362  0.16514696  1.0
  Sb  Sb8  1  0.99989089  0.50001630  0.33307000  1.0
  Sb  Sb9  1  0.50001112  0.99999453  0.49998304  1.0
  Sb  Sb10  1  0.00011009  0.49999776  0.66691345  1.0
  Sb  Sb11  1  0.50002472  0.99999631  0.83487701  1.0
  Ru  Ru12  1  0.49999730  0.25216224  0.00001484  1.0
  Ru  Ru13  1  0.50000166  0.74783100  0.00001543  1.0
  Ru  Ru14  1  0.99996817  0.25132998  0.16686142  1.0
  Ru  Ru15  1  0.99996905  0.74866906  0.16686109  1.0
  Ru  Ru16  1  0.49994741  0.24889144  0.33477618  1.0
  Ru  Ru17  1  0.49994679  0.75111620  0.33477644  1.0
  Ru  Ru18  1  0.00000103  0.24975671  0.49999260  1.0
  Ru  Ru19  1  0.00000397  0.75024768  0.49999331  1.0
  Ru  Ru20  1  0.50005447  0.24890410  0.66521273  1.0
  Ru  Ru21  1  0.50005347  0.75109428  0.66521268  1.0
  Ru  Ru22  1  0.00002614  0.25131241  0.83315019  1.0
  Ru  Ru23  1  0.00002730  0.74868237  0.83315014  1.0