%chk=ts_rad_reac_b_rad_CH3.chk
%mem=120GB
%nprocshared=24
#p opt=(calcall,ts,noeigentest,modredundant) freq ub3lyp
scrf=(smd,solvent=dichloroethane) pop=full def2svp
empiricaldispersion=gd3bj gfinput iop(6/7=3) scf=(save,xqc)

Title Card Required

1 3
 C                  0.62127300    0.61605400    0.12469000
 C                 -0.79343000    0.63387300   -0.18568600
 H                  2.36458900    1.80477900    0.45537400
 C                  1.29361400    1.82199500    0.24920800
 C                 -1.45921000    1.89273900   -0.34262000
 C                 -0.75794100    3.06937200   -0.20863100
 C                  0.62224200    3.04451100    0.08871300
 H                 -2.52156000    1.92554400   -0.57011800
 H                 -1.27122900    4.02361400   -0.33671200
 H                  1.17351000    3.98150500    0.19076300
 N                 -1.48561200   -0.53668100   -0.27777500
 C                 -2.95942700   -0.57204700   -0.37586000
 H                 -3.27522500    0.21279500   -1.07224300
 H                 -3.21474100   -1.53860500   -0.82083300
 C                 -3.62458000   -0.42093200    0.98890500
 H                 -3.38256800    0.54664500    1.45329500
 H                 -4.71552600   -0.47996500    0.85750700
 H                 -3.31376500   -1.22903700    1.66706000
 C                  0.65538300   -1.82192600   -0.42110700
 H                  0.80565100   -1.70941200   -1.51134300
 H                  1.04564400   -2.80082100   -0.12064700
 C                  1.30943000   -0.67941400    0.31168200
 H                  2.48329200   -0.51513600   -0.17042700
 H                  1.54314200   -0.89062700    1.36765100
 C                 -0.83354600   -1.82854200   -0.21078400
 O                 -1.50632800   -2.81214700   -0.04915700
 C                  3.73618023   -0.31471196   -0.14366683
 H                  3.88960494    0.33836525   -0.97724407
 H                  4.48009535   -0.12313471    0.60117439
 H                  3.81047099   -1.33143015   -0.46872838

B 27 23 B



