# generated using pymatgen
data_Hf5Sc(ReGe)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.82804687
_cell_length_b   7.82758298
_cell_length_c   7.82804634
_cell_angle_alpha   126.54848461
_cell_angle_beta   128.07635001
_cell_angle_gamma   77.74921284
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf5Sc(ReGe)6
_chemical_formula_sum   'Hf5 Sc1 Re6 Ge6'
_cell_volume   294.07354739
_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  0.54963712  0.25287547  0.20323934  1.0
  Hf  Hf1  1  0.75070803  0.85495352  0.60424549  1.0
  Hf  Hf2  1  0.24901209  0.85231244  0.10330135  1.0
  Hf  Hf3  1  0.05043961  0.25342147  0.70298086  1.0
  Hf  Hf4  1  0.94985925  0.65282429  0.20296604  1.0
  Sc  Sc5  1  0.45045190  0.65458652  0.70413562  1.0
  Re  Re6  1  0.50110487  0.51197324  0.01569301  1.0
  Re  Re7  1  0.99628223  0.51197324  0.51086937  1.0
  Re  Re8  1  0.12696242  0.25064418  0.11882508  1.0
  Re  Re9  1  0.87559840  0.99642893  0.12875392  1.0
  Re  Re10  1  0.36767501  0.99642893  0.62083053  1.0
  Re  Re11  1  0.63181910  0.25064418  0.62368276  1.0
  Ge  Ge12  1  0.25307274  0.25920344  0.50613071  1.0
  Ge  Ge13  1  0.74924206  0.25210752  0.00286646  1.0
  Ge  Ge14  1  0.33282255  0.58681938  0.25495741  1.0
  Ge  Ge15  1  0.66659088  0.91779145  0.25093167  1.0
  Ge  Ge16  1  0.16685878  0.91779145  0.75120056  1.0
  Ge  Ge17  1  0.83186196  0.58681938  0.75399683  1.0