%nproc=12
%Mem=20000MB
%Chk=IE9_Cy_OMe_4+2_D_TS100_200_enan
#p SCRF=(PCM,Solvent=Dichloromethane) BP86/genecp opt=(modredundant) EmpiricalDispersion=GD3 freq=noraman nosymm 
# scf(maxcyc=100) gfinput gfprint

opt freq

1 1
 Au                -1.25210700    6.48090200    7.00744300
 C                 -2.00332700    3.03969100    7.62338000
 C                 -2.40104700    2.01989200    8.52134900
 C                 -2.90319900    0.78978500    8.07857900
 C                 -3.00562900    0.54139500    6.70271700
 C                 -2.60027500    1.52783000    5.79629600
 C                 -2.10293300    2.78240200    6.22218500
 C                 -1.68231800    3.71577500    5.13652000
 C                 -0.66054300    3.32379800    4.24528500
 C                 -0.28212900    4.14877200    3.17764500
 C                 -0.89521900    5.40343200    2.99233200
 C                 -1.91629800    5.79882200    3.87640900
 C                 -2.32313900    4.95635200    4.92381000
 C                 -0.27002800    7.61792000    1.98234400
 C                 -0.10284300    8.08669500    0.49780000
 C                 -0.74292100    6.96456800   -0.36912300
 C                 -1.41720100    6.01520500    0.64018400
 C                  0.54523500    4.11125400    8.73015300
 C                 -2.30059800    5.07747100    9.89674900
 P                 -1.26286400    4.58256800    8.34485600
 N                 -0.52005000    6.17486300    1.83950500
 H                 -1.14315100    8.14831200    2.43358900
 H                  0.96713300    8.20074000    0.26118500
 H                 -0.57432600    9.07263300    0.35048100
 H                  0.04000600    6.40933300   -0.90913900
 H                 -1.45416700    7.34765600   -1.11899400
 H                 -1.36975000    4.95873400    0.32454000
 H                 -2.30679200    2.17742500    9.59684400
 H                 -3.20466500    0.03253900    8.80938500
 H                 -3.39541400   -0.41357300    6.33523300
 H                 -2.67585200    1.34330000    4.71932200
 H                 -0.16331700    2.35880300    4.39150200
 H                  0.49514700    3.83259500    2.47351100
 H                 -3.20733300    5.20640000    5.51935400
 H                 -2.42232400    6.75293900    3.72135200
 C                 -1.12142700    8.52416200    6.42211300
 C                  0.05400400    9.11326400    7.07642700
 C                  1.33781700    8.58833000    6.80219700
 C                 -0.08046100   10.11630800    8.06359000
 C                  2.46669100    9.08619600    7.46200700
 H                  1.43414400    7.78081700    6.07237400
 C                  1.05419000   10.60904800    8.72602200
 H                 -1.07491700   10.48953300    8.32559000
 C                  2.33081300   10.10280800    8.42374800
 H                  3.44966900    8.66129200    7.23498700
 H                  0.93763200   11.38807900    9.48720400
 H                  3.21233900   10.48872000    8.94637400
 C                 -2.21009700    8.87164300    5.81413500
 C                 -4.40720200   10.69072700    5.96178200
 H                 -4.86077000   10.98239100    4.99791000
 H                 -4.92368000   11.25622200    6.75661900
 C                 -2.92831200   11.01013900    5.97919900
 H                 -2.50516200   11.26520500    6.95756300
 C                 -2.09865700   11.18295500    4.88614400
 C                 -2.53331800   10.99715400    3.45702100
 H                 -3.60036500   10.77171500    3.33960900
 H                 -2.30882200   11.91053800    2.87608900
 H                 -1.95502300   10.17872700    2.98503200
 C                 -2.03952300    6.57981700   10.18847400
 H                 -0.97297900    6.80785400   10.34689900
 H                 -2.40887900    7.22276000    9.37150400
 H                 -2.58683500    6.85476700   11.10977900
 C                 -1.99160800    4.29280900   11.19142300
 H                 -2.14662900    3.20624000   11.10787000
 H                 -0.96147500    4.47019500   11.54222400
 H                 -2.67474600    4.65305500   11.98299500
 C                 -3.78595800    4.91810700    9.49441700
 H                 -4.00388800    5.44502500    8.54675200
 H                 -4.08421800    3.86386800    9.37674500
 H                 -4.41817500    5.36934600   10.28174300
 C                  1.22014400    5.27935700    9.48308000
 H                  1.12696300    6.23414600    8.93307800
 H                  0.81286800    5.41554400   10.49907100
 H                  2.29834000    5.05571000    9.58652800
 C                  0.66776300    2.79910500    9.53213200
 H                  1.74075500    2.58211000    9.68900400
 H                  0.19312700    2.85964200   10.52418300
 H                  0.23047400    1.94573400    8.98684400
 C                  1.22839800    3.92968600    7.35272900
 H                  2.28405700    3.64349900    7.51598300
 H                  0.74962100    3.13331300    6.75708600
 H                  1.21991200    4.86134500    6.76023000
 C                 -3.55183700    8.45348800    5.34621700
 H                 -3.66108600    7.36393800    5.45994000
 H                 -3.70204600    8.68257200    4.27426200
 C                 -4.63402200    9.16375300    6.18729100
 C                 -0.66394300   11.59637300    5.07351900
 H                 -0.38162800   12.37922700    4.34851000
 H                 -0.44829100   11.94989800    6.09316500
 H                  0.00071100   10.73628600    4.88479700
 C                 -6.02904800    8.74348300    5.71215400
 H                 -6.79593100    9.25446400    6.33262000
 H                 -6.18085500    9.04960300    4.65605400
 C                 -4.43725600    8.78742000    7.68153300
 H                 -4.40652300    7.68395200    7.77451300
 H                 -3.46311300    9.17003000    8.03908900
 O                 -6.13390400    7.32240200    5.83263900
 O                 -5.46019200    9.35117700    8.50353700
 C                 -7.43883300    6.84974100    5.50109000
 H                 -7.73748900    7.15309500    4.47563200
 H                 -7.40202800    5.75175200    5.54687100
 H                 -8.20125600    7.23109700    6.21283300
 C                 -6.34821700    8.36913700    9.04826700
 H                 -6.81698500    7.75236500    8.25623400
 H                 -5.81971800    7.69281200    9.75303600
 H                 -7.13030400    8.91791700    9.59763100
 C                  0.96997845    7.97116773    2.82448416
 C                  2.11176822    7.04370755    2.46130005
 C                  1.34531201    9.42097015    2.59266352
 H                  0.69850637    7.82412463    3.90283966
 C                  3.37862399    7.40947610    3.20751450
 H                  2.30045569    7.10000478    1.35694887
 H                  1.82713523    5.98624552    2.70086270
 C                  2.61173709    9.78694004    3.33954905
 H                  1.49578340    9.59617726    1.49493509
 H                  0.50647527   10.08453684    2.92803445
 C                  3.75369414    8.85923778    2.97796402
 H                  4.21753875    6.74666907    2.87077381
 H                  3.22895358    7.23246581    4.30507761
 H                  2.89665296   10.84420957    3.09965328
 H                  2.42206564    9.73134884    4.44381557
 H                  4.65507821    9.11577211    3.59301909
 H                  4.02759597    9.00731700    1.90028306
 C                 -2.87275261    6.36723156    0.99941488
 C                 -3.32308359    7.56124252    0.18252517
 C                 -3.76206487    5.16548292    0.75148940
 H                 -2.89699987    6.63048578    2.08949682
 C                 -4.77851879    7.89140257    0.44377011
 H                 -3.18095980    7.34121498   -0.90823264
 H                 -2.68608131    8.44906177    0.43279948
 C                 -5.21742270    5.49544297    1.01352833
 H                 -3.64201734    4.82567914   -0.31080475
 H                 -3.44364615    4.31930095    1.41408059
 C                 -5.66826174    6.69008759    0.19804717
 H                 -5.09693358    8.73663387   -0.22006833
 H                 -4.89839994    8.23309457    1.50549218
 H                 -5.85448106    4.60783268    0.76282830
 H                 -5.35899957    5.71443739    2.10461385
 H                 -6.72707463    6.94683990    0.46184510
 H                 -5.64672970    6.42700075   -0.89221317

48 52 F

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

Au 0
SDD

--link--
%nproc=12
%Mem=20000MB
%Chk=IE9_Cy_OMe_4+2_D_TS100_200_enan
#p SCRF=(PCM,Solvent=Dichloromethane) BP86/genecp opt=(ts, noeigentest,calcfc,modredundant) EmpiricalDispersion=GD3 freq=noraman nosymm 
# scf(maxcyc=100) gfinput gfprint

opt freq

1 1

48 52 A

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

Au 0
SDD


