TITLE R7 Transition state BASIS TZ2P ATOMS O 8 0.0000000000 0.0000000000 0.0000000000 H 1 2.5213054571 0.0000000000 0.5752770481 N 7 0.0000000000 0.0000000000 2.6919495103 N2 7 2.2717468495 0.0000000000 2.9375437651 END UHF MULTIPLICITY 2 DFT KOHNSHAM MOBASIS OFF VFOCK OFF EM LEBEDEV QUAD 1 functional END CONVERGE 6 SECDER START FCM CONVERGE 6 OPTIMISE SADDLE START CONVERGE 6 SECDER START FINISH