%mem=42GB
%nprocshared=24
#p opt=(ts,calcfc,noeigen,nomicro) nosymm freq=noraman scrf=(solvent=n,n-DiMethylFormamide,smd) b97d/gen pseudo=read

opt

0 1
 C                 -3.58161300    2.69527800    1.56997000
 C                 -4.04397700    2.94604400    0.27176100
 C                 -3.32243300    2.49892400   -0.86904000
 C                 -2.10521200    1.80681500   -0.64942900
 C                 -1.63694900    1.55934300    0.65473100
 C                 -2.36997500    1.99409100    1.77406200
 H                 -4.16732000    3.03232300    2.42932500
 H                 -4.99056600    3.47543600    0.12377900
 H                 -1.54668900    1.45925100   -1.51888200
 H                 -0.70385900    1.00769200    0.79831200
 H                 -2.01768200    1.78235900    2.78560000
 C                 -3.86385200    2.72684300   -2.24706500
 Si                -5.22017400    1.45831800   -2.98951600
 C                 -5.79313200    2.02716500   -4.71550900
 H                 -5.04756700    1.80366400   -5.49563200
 H                 -5.96950600    3.11892600   -4.72061700
 C                 -6.86595500    1.39952700   -1.94773200
 H                 -7.65621100    0.75672300   -2.38123900
 H                 -7.28558800    2.42138300   -1.87144800
 H                 -6.74621700    1.53688400   -4.99081300
 H                 -6.69549800    1.04974500   -0.91507400
 C                 -4.57691200   -0.33259100   -2.89994900
 C                 -5.50608300   -1.38813000   -2.69742600
 C                 -3.20046400   -0.65822400   -2.80378500
 C                 -5.08607000   -2.68668500   -2.35748800
 H                 -6.57804300   -1.18609200   -2.74552700
 C                 -2.77389400   -1.94965000   -2.44846700
 H                 -2.47781800    0.14106900   -2.96439900
 C                 -3.71596400   -2.96681300   -2.20897900
 H                 -5.82816400   -3.46843600   -2.17631800
 H                 -1.70674300   -2.15864400   -2.33834800
 H                 -3.38726300   -3.96303900   -1.90551800
 Cs                -4.44772600   -0.54016300    0.46399800
 C                 -7.97679600   -0.66431800    1.02716200
 O                 -8.26897100   -1.66081600    0.34570800
 H                 -8.28336200    0.35929000    0.73502300
 N                 -7.24837800   -0.68227600    2.17737000
 C                 -6.93015100    0.54426900    2.90856200
 H                 -7.38302100    0.51836700    3.91355500
 H                 -7.31153900    1.41537600    2.35780600
 C                 -6.70589000   -1.92973100    2.71964600
 H                 -6.67730800   -2.68829500    1.92687400
 H                 -7.32062300   -2.29408900    3.55971100
 H                 -5.68632900   -1.74024600    3.08573400
 H                 -5.83719700    0.63733700    3.02235200
 O                 -3.14791900    2.31865500   -3.36219900
 H                 -4.26911500    3.77420400   -2.28342500
 C                 -2.96755800   -2.42917900    3.27539400
 O                 -2.31237100   -1.54271900    3.84879100
 N                 -2.73409400   -2.89848500    2.02044500
 H                 -3.83411400   -2.92278400    3.75909200
 C                 -1.62011800   -2.38828400    1.21474100
 H                 -1.41203900   -1.34767900    1.49630200
 H                 -0.71388100   -2.99840400    1.36752400
 H                 -1.90365100   -2.42843800    0.15359000
 C                 -3.54808600   -3.96414000    1.43455100
 H                 -2.91340100   -4.83099300    1.18673600
 H                 -4.32287300   -4.27362900    2.14909000
 H                 -4.02914700   -3.60853100    0.50918600

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

Cs 0
LANL2DZ








