# generated using pymatgen
data_Hf2Sc(AlNi)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.93153271
_cell_length_b   6.93153272
_cell_length_c   3.34508785
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.02536053
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2Sc(AlNi)3
_chemical_formula_sum   'Hf2 Sc1 Al3 Ni3'
_cell_volume   139.15078914
_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  0.59131508  0.00088275  0.50000000  1.0
  Hf  Hf1  1  0.00088275  0.59131508  0.50000000  1.0
  Sc  Sc2  1  0.40900426  0.40900426  0.50000000  1.0
  Al  Al3  1  0.74586660  0.74586660  0.00000000  1.0
  Al  Al4  1  0.25131135  0.00082493  0.00000000  1.0
  Al  Al5  1  0.00082493  0.25131135  0.00000000  1.0
  Ni  Ni6  1  0.67346888  0.33287133  0.00000000  1.0
  Ni  Ni7  1  0.33287133  0.67346888  0.00000000  1.0
  Ni  Ni8  1  0.99445382  0.99445382  0.50000000  1.0