%nprocshared=8 %mem=20000MB #p pbepbe cc-pVTZ opt=(calcfc,ts,noeigentest,maxstep=2) freq scrf=(smd,solvent=dichloromethane) empiricaldispersion=gd3 nosymm TS1_SD180 0 1 C -1.575766000 -0.681368000 -0.206077000 C -0.200372000 -0.425609000 -0.127099000 C 0.238506000 0.876455000 0.148705000 C -0.684547000 1.910459000 0.328287000 C -2.057683000 1.650541000 0.241420000 C -2.501977000 0.350431000 -0.023203000 H -1.922818000 -1.691804000 -0.408663000 H 1.304985000 1.062334000 0.234890000 H -2.775585000 2.453152000 0.386794000 C 0.806131000 -1.539008000 -0.359005000 H 0.309430000 -2.516571000 -0.241296000 O 2.022982000 -1.425517000 0.292492000 N 1.395321000 -1.506721000 -1.786710000 H 2.350409000 -1.460638000 -1.001407000 C -0.267839000 -2.698225000 -3.241111000 C 1.158291000 -2.651624000 -2.691518000 H 1.883816000 -2.574383000 -3.508467000 H 1.389152000 -3.560895000 -2.125835000 H -0.477506000 -1.760749000 -3.775349000 H -0.976176000 -2.749376000 -2.404739000 H 1.203452000 -0.619175000 -2.256403000 C -0.494681000 -3.889973000 -4.178934000 H 0.224152000 -3.842490000 -5.008406000 H -0.282197000 -4.821276000 -3.636316000 H -3.566370000 0.138891000 -0.081124000 H -0.334943000 2.916697000 0.543969000 C -1.920791000 -3.936302000 -4.737136000 H -2.064761000 -4.801579000 -5.394144000 H -2.658828000 -4.003860000 -3.928206000 H -2.146792000 -3.033619000 -5.318192000