%nprocshared=20
%mem=41GB
%chk=Ph-TS2b-8cisoid.chk
#p opt=(maxstep=17,modredundant) B3LYP genecp SCRF=(PCM,Solvent=Dichloromethane) EmpiricalDispersion=GD3  nosymm scf(xqc,maxcyc=512)

opt freq

1 1
 C                 -0.58510903   -0.77108327   -0.56598837
 C                  0.09020892    0.37564235   -0.29059792
 C                 -0.62231747    1.67824026   -0.36815166
 C                 -1.81108013    1.79803840   -1.12616477
 C                 -0.13246358    2.83222922    0.27083440
 H                  0.77255500    2.75508845    0.86864379
 C                 -1.93298975    4.17368235   -0.62349734
 H                 -2.43655242    5.13022565   -0.73203507
 C                 -2.38135489    0.55569650   -1.76755720
 H                 -1.92100820    0.40922266   -2.75503429
 H                 -3.45904740    0.66297935   -1.93243485
 C                 -2.09082320   -0.71213202   -0.95170091
 H                 -2.30892943   -1.58471034   -1.57781850
 C                 -2.85169358   -0.87492185    0.33554729
 C                 -3.05820934   -2.26632452    0.84998530
 H                 -2.15269356   -2.57533934    1.38966464
 H                 -3.21672484   -2.98749746    0.04299500
 H                 -3.88626833   -2.31311779    1.56203044
 C                 -3.40851192    0.18572345    1.04140725
 H                 -3.76212411   -0.01017863    2.05445036
 H                 -3.04374202    1.19451537    0.85786413
 Au                 2.14197742    0.39253824    0.09766821
 P                  4.46014449    0.44870714    0.50955692
 C                  5.09726008    2.09362748    1.02836781
 H                  4.87466334    2.83112892    0.25177999
 H                  6.17936602    2.05285786    1.19145172
 H                  4.60214008    2.40067626    1.95415456
 C                  5.50489205    0.00466511   -0.93725118
 H                  5.26249380   -1.01053913   -1.26455446
 H                  6.56694653    0.05809721   -0.67534992
 H                  5.29859854    0.69561387   -1.75979193
 C                  5.02769215   -0.69085862    1.83625312
 H                  4.52294681   -0.43766283    2.77316013
 H                  6.11126729   -0.61344597    1.97413784
 H                  4.76866680   -1.71895056    1.56689957
 C                 -0.78011814    4.06319167    0.15641500
 H                 -0.37947960    4.93396895    0.66832766
 C                 -2.44072422    3.03712846   -1.26016279
 H                 -3.34274905    3.11183096   -1.86433597
 H                 -4.53718201    0.27944802    0.32595272
 O                 -5.62845806    0.58581565   -0.33503203
 H                 -6.36236444   -0.03767707   -0.02495040
 C                 -6.02617145    1.94699561   -0.04251823
 O                 -7.54236945   -0.88887176    0.66076320
 H                 -6.34839271    2.04469368    0.99854358
 H                 -5.15790399    2.58171423   -0.22550723
 H                 -6.83870902    2.22796543   -0.71612286
 H                 -7.95638494   -1.53177044    0.06199312
 C                 -7.13153159   -1.56267803    1.86362570
 H                 -6.64237950   -0.81088626    2.48620521
 H                 -7.99961161   -1.96271153    2.39729420
 H                 -6.42415697   -2.37308809    1.65139281
 C                  0.03741255   -2.17915252   -0.60350984
 C                  0.47338896   -2.71700293   -1.81475421
 C                  0.16550284   -2.91674323    0.57339328
 C                  1.03669855   -3.99243411   -1.84909596
 H                  0.37156081   -2.13555493   -2.74254246
 C                  0.72986446   -4.19218343    0.53936164
 H                 -0.17789929   -2.49291432    1.52815663
 C                  1.16532458   -4.73015940   -0.67162694
 H                  1.37978837   -4.41669130   -2.80386908
 H                  0.83110648   -4.77334475    1.46751885
 H                  1.60955919   -5.73574670   -0.69894239

19 40 F
40 41 F

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

Au 0
SDD


--link1--
%nproc=20
%Mem=41GB
%chk=Ph-TS2b-8cisoid.chk
#p opt=(ts,noeigentest,calcfc,modredundant,maxstep=9) freq=noraman geom=checkpoint guess=read SCRF=(PCM,Solvent=Dichloromethane) B3LYP genecp EmpiricalDispersion=GD3 nosymm scf(xqc,maxcyc=512) gfinput gfprint

opt freq

1 1

19 40 A
40 41 A

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

Au 0
SDD









