%nprocshared=20
%mem=41GB
%chk=tsj3cis
#p opt=(modredundant,maxstep=9) nosymm b3lyp genecp scrf=(pcm,solvent=dichloromethane) empiricaldispersion=gd3 scf=(xqc,maxcyc=1024)

preopt ts

1 1
 C                 -0.82529633    0.31143019   -1.82284118
 C                 -0.77344467   -1.09426431   -1.49961743
 C                  0.67657656   -3.02772797   -1.66262477
 H                  1.75129546   -3.13527655   -1.82171955
 H                  0.18611455   -3.93083693   -2.03901745
 C                  0.10618068   -1.82097300   -2.37279663
 H                 -0.03795687   -1.84574923   -3.44880769
 C                  0.69534339   -0.28181515   -2.02869758
 C                 -0.77439391   -1.71510265   -0.13771337
 H                 -1.75231497   -2.20739927   -0.02969022
 H                 -0.68916616   -0.98565850    0.67039824
 C                 -0.46694882   -3.22487940   -0.34967942
 O                 -0.04927805   -3.75335549    1.91185926
 O                 -1.48492169   -5.17886205    0.47236874
 C                  0.79359731   -4.15201412    3.01883979
 H                  1.61242121   -3.43898769    3.14033410
 H                  0.14304776   -4.14830199    3.89186235
 H                  1.19818457   -5.15043144    2.83910741
 C                 -2.59110291   -6.09568921    0.64152025
 H                 -3.41528949   -5.59526415    1.15504690
 H                 -2.92957493   -6.45837767   -0.33173601
 H                 -2.19860413   -6.91319158    1.24429339
 H                 -1.15094276    0.51157727   -2.84502986
 C                  0.53943528   -3.69381623    0.71355281
 C                 -1.73682381   -4.07723846   -0.24266958
 O                 -2.79961777   -3.81337119   -0.76216505
 O                  1.71318365   -3.92941612    0.50984710
 H                  0.72653002    0.34697015   -2.91078530
 C                  1.92018240   -0.00092590   -1.18928047
 C                  2.78159332    0.99581265   -1.65809470
 C                  2.22352876   -0.64406455    0.01870957
 C                  3.93840405    1.33977786   -0.95466501
 H                  2.54898523    1.51966480   -2.58107300
 C                  3.36858474   -0.30801274    0.72770157
 H                  1.56780526   -1.40960289    0.42338661
 C                  4.23943191    0.68459218    0.24652274
 H                  4.58529355    2.11295291   -1.35113791
 H                  3.61084205   -0.80404213    1.66188378
 O                  5.33239844    0.93219220    1.01450723
 C                  6.25276303    1.93346112    0.58227330
 H                  7.03940521    1.95996831    1.33739792
 H                  6.68969825    1.67960321   -0.39147078
 H                  5.77191566    2.91758060    0.52127528
 Au                -1.22152463    1.82736516   -0.44773981
 P                 -1.64028411    3.56710749    1.06991573
 C                 -2.45144685    5.03595801    0.32323522
 C                 -2.73382542    3.09836359    2.46929846
 C                 -0.12865305    4.23329279    1.87289175
 H                 -3.41209175    4.74131499   -0.10865874
 H                 -2.61559143    5.80822769    1.08196367
 H                 -1.81691779    5.43653812   -0.47252921
 H                 -3.69855536    2.75944881    2.08114378
 H                 -2.88905167    3.95560565    3.13242369
 H                 -2.27525459    2.28107658    3.03338319
 H                 -0.39001737    5.03120841    2.57553806
 H                  0.38261282    3.42952573    2.41032757
 H                  0.54565464    4.62890965    1.10806855

1 8 F
2 8 F
6 8 F
1 2 F
2 6 F

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

Au 0
SDD


--link1--
%nprocshared=20
%mem=41GB
%chk=tsj3cis
#p opt=(maxstep=3,calcfc,ts,noeigentest) geom=checkpoint guess=check freq=noraman nosymm b3lyp genecp scrf=(pcm,solvent=dichloromethane) empiricaldispersion=gd3 scf=(xqc,maxcyc=1024)

opt freq ts

1 1

1 8 A
2 8 A
6 8 A
1 2 A
2 6 A

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

Au 0
SDD




