%nprocshared=20
%mem=41GB
%chk=ts2-6
#p opt=(modredundant,loose,maxstep=7) bp86 genecp scrf=(solvent=dichloromethane,pcm) nosymm empiricaldispersion=gd3 scf=(xqc,maxcyc=1024)

preopt

1 1
 Au                 0.32035300   -0.43722500   -0.04817800
 C                  0.91826600    1.51449600   -0.15759400
 C                  0.13807200    2.52877300   -0.59319900
 C                 -0.24728000    4.51271300    0.15614300
 C                  0.66237400    3.98788800   -0.85568200
 H                  1.73146000    4.16137000   -0.66840500
 C                 -1.37650400    2.61731700   -0.75177300
 H                 -1.89718400    1.77406700   -0.27128400
 H                 -1.67372000    2.65149300   -1.81635800
 C                 -1.63558100    3.96738100   -0.02166500
 P                 -0.34918200   -2.67556200    0.13727000
 C                 -1.77408600   -2.93842300    1.27538700
 C                 -0.88310600   -3.43191000   -1.45606200
 C                  0.96194500   -3.80317400    0.77319600
 H                  1.28410000   -3.46140800    1.77048100
 H                  0.57710400   -4.83517800    0.84285000
 H                  1.82780600   -3.77754200    0.09168600
 H                 -1.50780700   -2.58041800    2.28324700
 H                 -2.03145300   -4.01060300    1.32106700
 H                 -2.64280400   -2.36510600    0.91259600
 H                 -1.72512500   -2.85277400   -1.86897900
 H                 -1.19623300   -4.47842400   -1.29858500
 H                 -0.04586400   -3.40070400   -2.17226500
 H                  0.39214300    4.26192400   -1.89477700
 H                 -2.24423200    4.69389500   -0.60088300
 H                 -2.13776000    3.84480900    0.95331300
 H                  0.05389842    5.06889596    1.01919113
 H                  1.92733508    1.76009851    0.10000842

3 4 F
3 5 F

C H P 0
6-31G*
****
Au 0
SDD
****

Au 0
SDD


--link1--
%nprocshared=20
%mem=41GB
%chk=ts2-6
#p opt=(calcfc,ts,noeigentest,modredundant,maxstep=4) freq=noraman bp86 genecp guess=read geom=checkpoint scrf=(solvent=dichloromethane,pcm) nosymm empiricaldispersion=gd3 scf=(xqc,maxcyc=1024)

ts opt freq

1 1

3 4 A
3 5 A

C H P 0
6-31G*
****
Au 0
SDD
****

Au 0
SDD







