%chk=000138887.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000138887

0 1
 O  -0.2604000       2.242100     -0.6616000    
 N    1.402300     -0.2599000      0.3989000    
 C   0.4349000     -5.5100001E-02 -0.6742000    
 C  -0.3977000      -1.309000     -0.9449000    
 C   -1.378800      -1.631700      0.1820000    
 C   -2.300500     -0.4452000      0.4492000    
 C   -1.516500      0.8124000      0.7944000    
 C  -0.4558000       1.098100     -0.2495000    
 C    2.202300      0.9477000      0.6077000    
 C    2.270300      -1.399300      9.8099999E-02
 H   0.9357000      0.2296000      -1.609800    
 H   0.2056000      -2.187600      -1.191600    
 H  -0.9917000      -1.121800      -1.851400    
 H  -0.8359000      -1.900000       1.095700    
 H   -1.981800      -2.502800     -9.8899998E-02
 H   -2.987300     -0.6874000       1.267900    
 H   -2.915400     -0.2593000     -0.4405000    
 H   -1.023200      0.7097000       1.766900    
 H   -2.198200       1.667800      0.8509000    
 H    2.689800       1.289700     -0.3127000    
 H    2.988400      0.7602000       1.349400    
 H    1.613400       1.769500       1.026900    
 H    3.090800      -1.458100      0.8239000    
 H    2.716900      -1.334500     -0.9007000    
 H    1.743800      -2.353000      0.2009000    


%chk=000138887-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000138887

0 1
O -0.625118 2.162903 -1.085724
N 1.386457 -0.264395 0.377874
C 0.442008 -0.021850 -0.751115
C -0.452795 -1.258877 -1.064505
C -1.343477 -1.639932 0.140058
C -2.255547 -0.459262 0.549342
C -1.424278 0.835546 0.815010
C -0.530640 1.121250 -0.383222
C 2.190573 0.944246 0.677348
C 2.256164 -1.444323 0.181349
H 0.985522 0.286215 -1.679654
H 0.171930 -2.111608 -1.387520
H -1.091895 -0.996710 -1.931975
H -0.700328 -1.918191 0.996495
H -1.961220 -2.522798 -0.114114
H -2.834606 -0.712438 1.457261
H -2.988099 -0.256785 -0.257610
H -0.779270 0.657938 1.697068
H -2.077731 1.704385 1.003413
H 2.843422 1.258260 -0.174435
H 2.832445 0.749971 1.554828
H 1.529660 1.794715 0.920348
H 2.945737 -1.525143 1.040368
H 2.872281 -1.389663 -0.751345
H 1.659804 -2.371354 0.147456


