Atoms H -0.53160922 -0.11494253 0.00000000 I 1.07807178 -0.11494253 0.00000000 End charge 0 Basis Type TZP Core none End integration 7 7 7 Symmetry Nosym XC HYBRID PBE0 End Relativistic SpinOrbit ZORA SAVE TAPE10 End Input