%chk=im180-p67-end_TD-wB97XD_6-31plGdp_CPCM-CCl3_ener_opt_freq4.chk %mem=120gb %nproc=16 #p td=(nstates=30,root=2) guess=(always,mix) uwb97xD/6-31+G(d,p) nosymm SCRF=(CPCM,solvent=chloroform) density=current opt=(CalcFC,maxstep=3) freq Title Card Required 2 1 C 0.43300000 -2.11600600 0.12729400 C -0.82353200 -1.51076200 -0.10044600 C -1.10392900 -0.23325600 0.40654200 C -0.10726900 0.41070600 1.13744900 C 1.12235800 -0.21062300 1.35043200 C 1.42226000 -1.49500000 0.84927300 C -0.80799400 -3.56954600 -1.05069900 C -1.62271700 -2.41400900 -0.84602900 H -2.06836500 0.22713600 0.22425500 H -0.28440500 1.39993100 1.54231300 H 1.88558000 0.30692400 1.92074300 H 2.38591900 -1.95209200 1.02520700 N 0.38973500 -3.40851000 -0.47964700 H -1.07120400 -4.45366400 -1.61024500 C 1.44832100 -4.38859600 -0.42071200 O 2.55366400 -4.01081200 -0.12946100 C 1.05284300 -5.82720600 -0.62159600 H 0.48989100 -5.97392600 -1.54790000 H 1.99109000 -6.37279100 -0.72298100 C 0.26524700 -6.37106800 0.60222800 H 0.72053000 -5.99382000 1.52363900 H 0.40486600 -7.45655400 0.60228800 C -1.20977100 -6.08149400 0.59196800 H -1.78711600 -6.58508400 -0.18485700 C -1.84158600 -5.29986800 1.47102600 H -1.30596500 -4.78398200 2.26427400 H -2.92195100 -5.18027400 1.44844100 C -3.00667300 -2.25504700 -1.24486800 H -3.28667400 -2.06044100 -2.27066400 N -3.97344000 -2.72141900 -0.38324100 H -3.68872200 -3.14150400 0.48796400 C -5.22570700 -3.53125700 2.63828500 C -5.85265300 -3.96258100 1.46549200 C -6.09172500 -5.33033200 1.28538600 C -5.70346000 -6.24544100 2.25860200 C -5.06634900 -5.80815800 3.41948400 C -4.82869900 -4.44976300 3.60882800 H -5.05069700 -2.47091800 2.79998300 H -6.58501800 -5.69558500 0.39041800 H -5.90006000 -7.30158200 2.10891800 H -4.76268700 -6.52473500 4.17519700 H -4.33976800 -4.10029700 4.51178300 C -6.23675800 -2.92642500 0.42902800 H -6.13865400 -1.93382200 0.87625400 C -5.32440500 -2.94495700 -0.83841800 H -5.59354000 -2.07616500 -1.44878300 C -5.48571900 -4.18655300 -1.70981900 C -6.46192600 -4.21275200 -2.71024800 C -4.68331100 -5.31459700 -1.52413600 C -6.66610800 -5.35917800 -3.47757300 H -7.04592400 -3.32164200 -2.92790000 C -4.87771900 -6.45730700 -2.29341000 H -3.91081300 -5.30369400 -0.76315600 C -5.87756700 -6.48673400 -3.26500800 H -7.42724700 -5.36194800 -4.25048700 H -4.25153900 -7.32852900 -2.13057500 H -6.03129200 -7.37898700 -3.86248900 C -8.62855300 -3.23939700 1.22546600 C -8.22564300 -1.82997600 -0.73271300 C -9.91014400 -2.54204600 0.80803300 H -8.16862400 -2.74627900 2.08337900 H -8.71689600 -4.30474100 1.42908700 C -9.38288500 -1.29407900 0.10273400 H -8.56866400 -2.19432600 -1.70084900 H -7.41886400 -1.11541800 -0.88528600 H -10.49042000 -3.16774900 0.12307400 H -10.53040900 -2.31539200 1.67612200 H -10.12409300 -0.80529400 -0.53052000 H -9.02395900 -0.56468100 0.83446400 N -7.69111500 -3.03879300 0.04108600 H -7.78106100 -3.85760300 -0.56953800