%nprocshared=24
%mem=123GB
%chk=T_scis_strans_Cinn.chk
#p opt=(calcfc,ts,noeigentest,maxcyc=500) freq=noraman scrf=(smd,solvent=dichloroethane,read) nosymm pop=full geom=connectivity
def2svp empiricaldispersion=gd3 iop(6/80=1) rm062x scf=(maxcycle=250,xqc)

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0 1
 C                 -0.00944400    0.06450100   -0.03235700
 C                 -0.00384400    0.06758900    1.46378400
 O                 -0.01676700    1.06405100   -0.69932700
 C                 -1.13438700    0.01814100    2.17678700
 C                 -1.25017400    0.03331400    3.64705700
 C                 -0.14206800    0.19164000    4.49433500
 C                 -2.51826900   -0.11756100    4.22627300
 C                 -0.30042100    0.19154200    5.87592300
 H                  0.85593000    0.32148800    4.07205200
 C                 -2.67792200   -0.11748100    5.61085500
 H                 -3.38898600   -0.23756000    3.57767400
 C                 -1.56898300    0.03607800    6.44037700
 H                  0.57174000    0.31638000    6.51977800
 H                 -3.67305100   -0.23675500    6.04258000
 H                 -1.69021300    0.03790600    7.52472300
 H                  0.98243000    0.10958700    1.93936600
 H                 -2.08762900   -0.04314400    1.63899300
 H                  0.00283300   -0.94081300   -0.51967700

 1 2 1.0 3 2.0 18 1.0
 2 4 2.0 16 1.0
 3
 4 5 1.0 17 1.0
 5 6 1.5 7 1.5
 6 8 1.5 9 1.0
 7 10 1.5 11 1.0
 8 12 1.5 13 1.0
 9
 10 12 1.5 14 1.0
 11
 12 15 1.0
 13
 14
 15
 16
 17
 18

alpha=1.2


