%mem=42GB
%nprocshared=20
#p opt=(ts,calcfc,noeigen,nomicro) IOP(1/8=4) nosymm freq=noraman scrf=(solvent=n,n-DiMethylFormamide,smd) b97d/gen pseudo=read

opt

0 1
 C                 -3.85497400    3.23953400    1.28721700
 C                 -4.21873700    3.22283800   -0.06702100
 C                 -3.48464200    2.47179100   -1.01750300
 C                 -2.36568600    1.74097400   -0.55946900
 C                 -1.99641700    1.75196500    0.79961300
 C                 -2.73793500    2.49905400    1.73282500
 H                 -4.44400600    3.82023100    2.00028200
 H                 -5.08532200    3.79806500   -0.40459400
 H                 -1.79192100    1.17297100   -1.29338200
 H                 -1.13595000    1.16609900    1.13432000
 H                 -2.46323600    2.49757900    2.79001300
 C                 -3.87540900    2.46124100   -2.49749300
 Si                -5.54053200    1.48454100   -2.77277700
 C                 -6.11346400    1.73783400   -4.57237100
 H                 -5.41099611    1.27844571   -5.28747865
 H                 -6.19295253    2.81292725   -4.81587101
 C                 -7.00132000    2.00256000   -1.64175800
 H                 -7.91306400    1.42071100   -1.87047800
 H                 -7.24802400    3.06893400   -1.79603300
 H                 -7.10903615    1.28417884   -4.73321975
 H                 -6.79397200    1.87110100   -0.56829700
 C                 -5.23177800   -0.35867800   -2.41357300
 C                 -6.30013300   -1.20628700   -2.02162800
 C                 -3.91314400   -0.86661300   -2.28969800
 C                 -6.06400000   -2.48966200   -1.49637200
 H                 -7.32978600   -0.84243900   -2.07153000
 C                 -3.67107500   -2.14474700   -1.75722600
 H                 -3.08447100   -0.21642800   -2.57768500
 C                 -4.74541800   -2.95782500   -1.35188300
 H                 -6.90397600   -3.11138200   -1.17620800
 H                 -2.64419200   -2.49965200   -1.63879400
 H                 -4.55766800   -3.94403000   -0.92209800
 Cs                -4.97334300   -0.07190100    0.94543500
 O                 -2.95214000    1.97496800   -3.37695100
 H                 -4.17931600    3.53378500   -2.70429300
 Si                -1.70975500    4.41074100   -4.75000200
 C                 -1.44642100    4.83765300   -2.92854800
 H                 -2.06232500    5.70206500   -2.62113300
 H                 -1.70548000    3.97827900   -2.29399700
 H                 -0.38782700    5.10008000   -2.74502900
 C                 -0.66287700    2.97493700   -5.39272800
 H                  0.40598600    3.11798400   -5.14920200
 H                 -1.01007600    2.03845800   -4.92930600
 H                 -0.74573200    2.88019500   -6.49107200
 C                 -3.49790500    4.41464800   -5.35602900
 H                 -4.05198500    5.30167900   -5.00037400
 H                 -3.53097400    4.41846300   -6.46143900
 H                 -3.99593700    3.50517500   -4.99102600
 F                 -1.03778900    5.76499900   -5.54561100
 C                 -7.94154463    1.60238097    2.07893171
 O                 -8.82333662    1.03917298    1.40842073
 N                 -7.22840100    1.01598200    3.07682600
 H                 -7.64325574    2.65480017    1.89869603
 C                 -3.59477900   -1.69759800    3.98058000
 O                 -2.70041700   -0.95396500    4.41877100
 N                 -3.56425500   -2.36912100    2.80004300
 H                 -4.53819500   -1.87155300    4.53747700
 C                 -2.40490900   -2.28233400    1.90703500
 H                 -1.68505100   -3.09430700    2.10816500
 H                 -2.75610300   -2.36422200    0.86955000
 H                 -1.91066800   -1.31235200    2.05015000
 C                 -4.68686700   -3.23904800    2.41423500
 H                 -4.53827520   -4.26836747    2.78008145
 H                 -5.62544937   -2.82695323    2.81486921
 H                 -4.74295073   -3.24970368    1.31874649
 C                 -6.22156564    1.75028583    3.84563041
 H                 -5.74729791    2.50423417    3.20425218
 H                 -6.68960034    2.24489734    4.71301553
 H                 -5.44940497    1.05554742    4.21317385
 C                 -7.46567620   -0.38453366    3.43886309
 H                 -8.22479879   -0.46336191    4.23513630
 H                 -7.81177887   -0.94771982    2.56031213
 H                 -6.51932612   -0.80886067    3.79553741

C F N H O Si 0
6-31+g(d)
****
Cs 0
LANL2DZ
****

Cs 0
LANL2DZ




