# generated using pymatgen
data_YTh(ScIr)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.38989459
_cell_length_b   7.08992297
_cell_length_c   8.69943485
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YTh(ScIr)2
_chemical_formula_sum   'Y2 Th2 Sc4 Ir4'
_cell_volume   270.76133626
_cell_formula_units_Z   2
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
  Y  Y0  1  0.75000000  0.98376865  0.67545199  1.0
  Y  Y1  1  0.75000000  0.48376865  0.82454801  1.0
  Th  Th2  1  0.25000000  0.01245101  0.32487505  1.0
  Th  Th3  1  0.25000000  0.51245101  0.17512495  1.0
  Sc  Sc4  1  0.25000000  0.14000057  0.92439958  1.0
  Sc  Sc5  1  0.25000000  0.64000057  0.57560042  1.0
  Sc  Sc6  1  0.75000000  0.86611071  0.05865167  1.0
  Sc  Sc7  1  0.75000000  0.36611071  0.44134833  1.0
  Ir  Ir8  1  0.25000000  0.25361802  0.59438924  1.0
  Ir  Ir9  1  0.25000000  0.75361802  0.90561076  1.0
  Ir  Ir10  1  0.75000000  0.74405204  0.39734787  1.0
  Ir  Ir11  1  0.75000000  0.24405204  0.10265213  1.0