# generated using pymatgen
data_HfSc2(SnIr)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.53875663
_cell_length_b   7.57442617
_cell_length_c   3.42534964
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.15663263
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfSc2(SnIr)3
_chemical_formula_sum   'Hf1 Sc2 Sn3 Ir3'
_cell_volume   169.12093574
_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  0.00000000  0.60918248  0.50000000  1.0
  Sc  Sc1  1  0.38977910  0.39098157  0.50000000  1.0
  Sc  Sc2  1  0.61022090  0.00120247  0.50000000  1.0
  Sn  Sn3  1  0.71646963  0.72344133  0.00000000  1.0
  Sn  Sn4  1  0.28353037  0.00697071  0.00000000  1.0
  Sn  Sn5  1  0.00000000  0.26877107  0.00000000  1.0
  Ir  Ir6  1  0.67880699  0.34392773  0.00000000  1.0
  Ir  Ir7  1  0.32119301  0.66512074  0.00000000  1.0
  Ir  Ir8  1  0.00000000  0.99040089  0.50000000  1.0