%nprocshared=24
%mem=100GB
%chk=ts4a.chk
#p opt=(calcfc,ts,noeigentest,maxstep=5) freq wb97xd/6-311g(d,p)
scrf=(smd,solvent=acetonitrile) temperature=353.15

ts4 a guess

0 1
 C                  2.90955400   -2.23142400   -0.08109400
 H                  2.55238200   -2.67416700   -1.01838400
 H                  2.62863800   -2.90549100    0.72876300
 C                  4.41503600   -2.02728100   -0.12104400
 H                  4.77702200   -1.76415600    0.87682600
 H                  4.91612500   -2.94568800   -0.43258100
 C                  4.75454100   -0.90891200   -1.09413200
 H                  5.81374300   -0.65105200   -1.02455400
 H                  4.55650100   -1.22627900   -2.12664300
 N                  2.25883400   -0.96010100    0.15147200
 H                  1.28495600   -0.91561600    0.49644900
 C                  4.45024300    1.56142700   -1.34325400
 H                  5.54133100    1.55994300   -1.29992800
 H                  4.15862100    1.64430400   -2.39891400
 C                  3.88577200    2.72236000   -0.53945400
 H                  4.19031000    3.66840500   -0.99059400
 H                  4.28841900    2.68562800    0.47659700
 C                  2.36926400    2.62349400   -0.49830300
 H                  1.95760600    3.30241500    0.25071300
 H                  1.94523100    2.90397000   -1.46991600
 C                  2.74298200    0.20563100   -0.27530100
 N                  3.98871100    0.29466800   -0.78874700
 N                  1.96561300    1.27503700   -0.15477900
 H                  1.02610400    1.05505500    0.27337100
 C                 -0.33385200    0.85127600    2.73221200
 O                 -0.15336400    0.12308700    0.87438100
 O                  0.77439100    1.21645000    2.88234600
 O                 -1.45021800    0.67996900    3.06183100
 C                 -1.50559600   -1.74851300    0.08454800
 C                 -1.14457900   -0.24914300   -0.02033800
 H                 -0.75318900   -0.13489800   -1.05314300
 C                 -2.60065200   -2.08729500   -0.93582600
 H                 -2.88267400   -3.14179500   -0.82500100
 H                 -2.16035200   -1.98066700   -1.93414700
 C                 -2.39668800    0.63352400    0.08090900
 H                 -2.07480900    1.67426700   -0.02879200
 H                 -2.81336400    0.53955900    1.08627400
 C                 -3.83701200   -1.19617500   -0.83416500
 H                 -4.54844100   -1.48409400   -1.61324500
 H                 -4.34245100   -1.34693600    0.12708500
 C                 -3.45675400    0.29024700   -0.96484500
 H                 -3.00147300    0.41212500   -1.96050100
 C                 -1.89235700   -2.15525800    1.50084800
 H                 -2.10569300   -3.23076500    1.53920100
 H                 -1.07118900   -1.93196300    2.18206900
 H                 -2.77709000   -1.62594000    1.85845900
 C                 -5.63277200    1.01690700   -2.10010400
 H                 -6.12990000    0.04181900   -2.07154300
 H                 -6.40813000    1.78591400   -2.09480200
 H                 -5.09813900    1.07367800   -3.05480000
 C                 -4.68230000    1.18398200   -0.94232000
 C                 -4.92942200    2.06872500    0.02170700
 H                 -5.82086800    2.68879100   -0.00609000
 H                 -4.26588500    2.21003900    0.86712000
 O                 -0.30910600   -2.45565100   -0.28459900
 H                 -0.46151300   -3.38591900   -0.10692100


