# generated using pymatgen
data_Hf3Sc4TiIr4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.42533690
_cell_length_b   6.63066364
_cell_length_c   7.99050152
_cell_angle_alpha   89.93874749
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf3Sc4TiIr4
_chemical_formula_sum   'Hf3 Sc4 Ti1 Ir4'
_cell_volume   234.46451662
_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  0.25000000  0.35282013  0.57769704  1.0
  Hf  Hf1  1  0.25000000  0.85029496  0.92402299  1.0
  Hf  Hf2  1  0.75000000  0.65043886  0.42410449  1.0
  Sc  Sc3  1  0.25000000  0.99283941  0.31499058  1.0
  Sc  Sc4  1  0.25000000  0.47986130  0.17764957  1.0
  Sc  Sc5  1  0.75000000  0.01538087  0.67754356  1.0
  Sc  Sc6  1  0.75000000  0.50540122  0.82995828  1.0
  Ti  Ti7  1  0.75000000  0.14244280  0.07400189  1.0
  Ir  Ir8  1  0.25000000  0.24041297  0.91319000  1.0
  Ir  Ir9  1  0.25000000  0.74925294  0.59157974  1.0
  Ir  Ir10  1  0.75000000  0.76396820  0.09528911  1.0
  Ir  Ir11  1  0.75000000  0.25688635  0.39997174  1.0