# Saddle/wB97XD/def2svpp -1 1 C -5.328665756217 -3.778369433691 7.534232974075 H -4.927662198785 -2.988533900297 6.877392991579 H -6.378041462789 -3.970903216467 7.244146460997 H -4.731866157878 -4.685936104304 7.343096916335 C -5.226943826111 -3.353734693624 8.996978501080 H -5.691316590926 -4.118873337616 9.649920025176 H -5.795688448986 -2.417054390373 9.150975416628 C -3.788179274856 -3.139004058696 9.465165490111 H -3.215799965794 -4.077543075224 9.369118687561 H -3.787486583003 -2.825401174804 10.526741116401 C -2.193826500887 -2.525367053595 7.777843066057 C -0.729206255143 -1.639326690818 5.948648557897 H -1.332780040882 -2.136377147141 5.156712615944 H 0.119029843826 -2.316389993968 6.166984988351 C -0.150963571331 -0.333809142498 5.403369540071 H 0.477852789402 0.101569715083 6.198245552700 H -0.972401818883 0.383581715956 5.194480574949 C 0.684652989600 -0.522665813355 4.138387985178 H 0.081487231325 -1.059806104809 3.380360969218 H 1.540325897114 -1.183686004555 4.376140750882 C 1.208819837894 0.775530988006 3.515785082476 H 0.349632867907 1.410857381176 3.223734993611 H 1.745443040212 0.536028006638 2.577254194252 C 2.136990170000 1.576184175445 4.428959485371 H 2.983924691732 0.954270979551 4.770711387240 H 2.548518126058 2.461017790750 3.909405399928 H 1.609724875299 1.928265827557 5.331413159861 O -1.992166980020 -3.720856427945 7.592544291928 C -1.517688802818 -1.421195803184 7.211344564259 H -2.018910226614 -0.451255944627 7.319908691029 O -3.151323195594 -2.132205046775 8.729886645984 C -1.358309501577 -0.763012952772 11.395635010554 H -2.264136333743 -0.626033395663 12.014515492878 H -0.477138733804 -0.552573525358 12.031844944568 H -1.316904872494 -1.825350132248 11.103017632803 C -1.390619477851 0.144090451845 10.165220216507 H -2.265405318910 -0.131633838682 9.555845629296 H -1.537636972674 1.190879480730 10.496516796685 C -0.127138520518 0.078641202425 9.306488321796 H 0.751388183088 0.353165165331 9.929651611714 H -0.172696994854 0.832171809983 8.501010076495 C 0.232086443530 -1.269396665453 8.666376454897 O 1.269330981113 -1.363102433116 8.001727232961 H -0.146665371723 -2.167469865146 9.214632348079 Options END MinFC=-1 DownDC=999 MaxIRCSTEP=30 Saddle+IRC SaddleFC=99999 Gauproc=20 GauMem=4000 MaxStepSize=0.3 DownFC=9999999 Opt=Cartesian