# generated using pymatgen
data_Sc(PaIr)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.63372137
_cell_length_b   7.63372137
_cell_length_c   3.67459216
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc(PaIr)2
_chemical_formula_sum   'Sc2 Pa4 Ir4'
_cell_volume   214.13208857
_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
  Sc  Sc0  1  0.00000000  0.00000000  0.00000000  1.0
  Sc  Sc1  1  0.49999900  0.49999900  0.00000000  1.0
  Pa  Pa2  1  0.32793389  0.17206611  0.50000100  1.0
  Pa  Pa3  1  0.82793389  0.32793389  0.50000100  1.0
  Pa  Pa4  1  0.17206611  0.67206711  0.50000100  1.0
  Pa  Pa5  1  0.67206711  0.82793389  0.50000100  1.0
  Ir  Ir6  1  0.63675034  0.13674934  0.00000000  1.0
  Ir  Ir7  1  0.13674934  0.36324966  0.00000000  1.0
  Ir  Ir8  1  0.86325066  0.63675034  0.00000000  1.0
  Ir  Ir9  1  0.36324966  0.86325066  0.00000000  1.0