# Saddle/wB97XD/def2svpp -1 1 C -4.177045230303 -2.884145187997 10.103339175137 H -4.261414969295 -1.847853003477 9.739223376729 H -4.188719587135 -2.853699832865 11.207996770248 H -5.053232840644 -3.472722691799 9.766968396910 C -2.875443599387 -3.487706668163 9.587264381197 H -2.714608902865 -4.500078281471 10.010234797793 H -2.032593584569 -2.853782091210 9.912873894836 C -2.821824212958 -3.597477977299 8.065915318714 H -3.671563582834 -4.206864803161 7.702034783475 H -1.878485642237 -4.073608385576 7.750975439912 C -1.778921973228 -1.670411302828 7.141169632660 C -0.969954814599 0.479805156954 6.093554578230 H 0.025188830476 0.054079060493 6.313915317452 H -0.940449897765 1.530066446342 6.458687258785 C -1.174397299000 0.535739301022 4.567118376334 H -0.369719733047 1.150207325777 4.111620888416 H -2.124521909934 1.064783203881 4.357212320597 C -1.217566169129 -0.827023732294 3.871065256817 H -1.424993053477 -0.673343555717 2.791956145850 H -2.069090633049 -1.405273320031 4.276353688043 C 0.057236285337 -1.657645996341 4.026048572398 H 0.216397831965 -1.870988950197 5.097061274866 H 0.925729599910 -1.065926860370 3.673060129794 C -0.004953149561 -2.979940308569 3.265450730236 H -0.161387531937 -2.822214175826 2.180842111155 H 0.924276041804 -3.564179122665 3.392119327319 H -0.839807250008 -3.600231304596 3.638433235239 O -0.694578804434 -2.257262671083 7.219088593409 C -2.005079276433 -0.303018624281 6.851428960910 H -3.054520932010 -0.036584307687 6.679995749029 O -2.944981005089 -2.342297992153 7.446450913896 C 1.255347550771 0.288470715911 11.103761940550 H 1.447655812155 0.521488052672 12.167869992021 H 1.960069685173 0.885365114288 10.495139863273 H 1.502136615853 -0.776153143159 10.939280223688 C -0.192380762395 0.574177497181 10.711693906500 H -0.882542367208 -0.012460775682 11.342640505449 H -0.425172174504 1.639407978746 10.908909775982 C -0.497983156011 0.239203292233 9.250363077754 H -0.244758338685 -0.818625050469 9.051004626911 H 0.133185520589 0.851554899641 8.580712564194 C -1.978107813448 0.469116444156 8.937759411845 O -2.845335617530 -0.061469143084 9.640329765547 H -2.179449740061 1.468912088605 8.463447800833 Options END MinFC=-1 DownDC=999 MaxIRCSTEP=30 Saddle+IRC SaddleFC=99999 Gauproc=20 GauMem=4000 MaxStepSize=0.3 DownFC=9999999 Opt=Cartesian