%nproc=12
%mem=21000MB
#p opt=(ts,noeigentest,calcfc) freq b97d scrf=(solvent=benzene,SMD) gen  
pseudo=read scfcyc=300  

TS3_insertion  Energy= -939.494458133

+1 1
 C                 -0.11800624    2.48216665   -0.78280921
 C                 -0.98251084    3.31966227    0.12100329
 O                 -2.15150110    2.66708126    0.35864556
 O                 -0.70157448    4.41242507    0.60298939
 H                  0.54679000    4.43780500   -1.82990200
 C                 -3.05586370    3.31785363    1.28659842
 H                 -3.39362299    4.28219771    0.87898709
 H                 -3.90008330    2.62686859    1.39307859
 H                 -2.56135095    3.48181970    2.25361417
 C                  0.90185700    3.42371900   -1.57378600
 C                  1.64677400    2.78183500   -2.67175900
 C                  1.43933910    3.33139878   -0.29385084
 C                  2.82590800    2.10181900   -2.44968100
 H                  1.19844700    2.80781900   -3.66626800
 C                  2.74702700    2.70703900   -0.05158900
 C                  3.37537200    2.07471700   -1.14459800
 H                  3.34007200    1.59374300   -3.26442700
 H                  4.30330900    1.52947700   -0.97231500
 H                  3.19191500    2.63916900    0.93920000
 H                  1.41662707    4.01061204    0.55636045
 H                 -0.74935831    2.00726724   -1.54981597
 Au                 0.41593276    0.82497744    0.43782625
 C                  0.74359978   -0.81341452    1.60587339
 N                 -0.21880327   -1.47507963    2.30910766
 N                  1.89820684   -1.47254113    1.89658732
 C                  0.32554669   -2.52731245    3.03650291
 C                  1.66777869   -2.52784682    2.77478117
 H                 -0.28735270   -3.16641231    3.66073939
 H                  2.47152725   -3.16582403    3.12210979
 C                 -1.59545552   -1.03720203    2.32696261
 C                 -1.91963184    0.09462259    3.10634112
 C                 -2.52598968   -1.71441093    1.50853374
 C                 -3.25917945    0.52547131    3.08061286
 C                 -0.89613462    0.82544213    3.97009033
 C                 -3.84944920   -1.23918575    1.51593355
 C                 -2.09258955   -2.84184103    0.57535656
 H                 -3.54954117    1.38942068    3.67976271
 C                 -4.21434051   -0.13480162    2.29874911
 H                  0.10440201    0.44067388    3.73345600
 C                 -0.87357516    2.33973665    3.68170565
 C                 -1.16448246    0.55730783    5.46759206
 H                 -4.59848353   -1.73345674    0.89734894
 H                 -1.18751803   -3.31093017    0.99038808
 C                 -1.71542236   -2.24399708   -0.80135958
 C                 -3.15236481   -3.94952438    0.41735196
 H                 -5.24902017    0.21398570    2.29414382
 H                 -0.09150078    2.82386312    4.28797620
 H                 -0.66471810    2.54069668    2.62167280
 H                 -1.83514527    2.80998995    3.94170230
 H                 -2.15441035    0.94286950    5.76109582
 H                 -0.40356741    1.06011203    6.08723600
 H                 -1.13910447   -0.52135387    5.69207895
 H                 -1.34995366   -3.03623972   -1.47599179
 H                 -0.93318285   -1.47657450   -0.69872218
 H                 -2.59728520   -1.77172283   -1.26517483
 H                 -4.05081671   -3.57975585   -0.10187440
 H                 -3.46088390   -4.35297895    1.39517833
 H                 -2.73806006   -4.77395432   -0.18459652
 C                  3.18932459   -1.02980229    1.43470792
 C                  3.71228988   -1.58686841    0.24760933
 C                  3.85356401   -0.03969952    2.19032319
 C                  4.98112965   -1.13796738   -0.16494229
 C                  2.91496340   -2.58048816   -0.59137486
 C                  5.11725098    0.37872691    1.73234650
 C                  3.24312367    0.58339907    3.44167025
 H                  5.42535571   -1.55461608   -1.06942269
 C                  5.68231608   -0.17442959    0.57561006
 H                  2.10646032   -2.98986222    0.03200637
 C                  2.25697817   -1.84580446   -1.78246308
 C                  3.76700163   -3.76571582   -1.08969500
 H                  5.66406502    1.13387659    2.29899924
 H                  2.29953706    0.06807049    3.66746188
 C                  2.90658787    2.07042194    3.19742433
 C                  4.16722989    0.41648673    4.66663525
 H                  6.67234050    0.14819877    0.24628872
 H                  1.62571352   -2.54295747   -2.35727219
 H                  1.63230278   -1.00752591   -1.43777636
 H                  3.03248358   -1.44947733   -2.45887968
 H                  4.54335273   -3.43433104   -1.79808633
 H                  3.12312384   -4.48829499   -1.61581504
 H                  4.26310459   -4.28459838   -0.25411821
 H                  3.82085239    2.64381222    2.96961613
 H                  2.44859890    2.50733139    4.09902501
 H                  2.20276939    2.18177758    2.35884429
 H                  5.12357358    0.94451846    4.52284868
 H                  4.38946669   -0.64621406    4.85404684
 H                  3.68199682    0.83370036    5.56374223

-C -N -O -H 
6-31g(d)
*****
-Au 0
lanl2dz 
F  1  1.0
1.050    1.0000
*****

-Au 0    
lanl2dz  
 
 


