# generated using pymatgen
data_HfSc5(TiP)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.73488896
_cell_length_b   7.75101060
_cell_length_c   7.73488920
_cell_angle_alpha   127.99456815
_cell_angle_beta   122.80562498
_cell_angle_gamma   80.88999408
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfSc5(TiP)6
_chemical_formula_sum   'Hf1 Sc5 Ti6 P6'
_cell_volume   296.22954610
_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  0.95118123  0.65591585  0.20473462  1.0
  Sc  Sc1  1  0.45169829  0.65664928  0.70495200  1.0
  Sc  Sc2  1  0.54806980  0.25236086  0.20429006  1.0
  Sc  Sc3  1  0.74972607  0.84872808  0.59900202  1.0
  Sc  Sc4  1  0.25028795  0.85027415  0.09998420  1.0
  Sc  Sc5  1  0.04869928  0.25453158  0.70583330  1.0
  Ti  Ti6  1  0.50085931  0.49649446  0.99751898  1.0
  Ti  Ti7  1  0.99897548  0.49649446  0.49563414  1.0
  Ti  Ti8  1  0.12033798  0.25326241  0.13058701  1.0
  Ti  Ti9  1  0.88072696  0.01166814  0.13412224  1.0
  Ti  Ti10  1  0.37754590  0.01166814  0.63094118  1.0
  Ti  Ti11  1  0.62267539  0.25326241  0.63292442  1.0
  P  P12  1  0.25169782  0.25673104  0.50503521  1.0
  P  P13  1  0.74937785  0.25205490  0.00267705  1.0
  P  P14  1  0.33106437  0.58694272  0.25357136  1.0
  P  P15  1  0.66838888  0.91780941  0.25249134  1.0
  P  P16  1  0.16531807  0.91780941  0.74941953  1.0
  P  P17  1  0.83337136  0.58694272  0.75587935  1.0