%chk=000099452.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099452

0 1
 O    3.460200      -1.133800     -0.3385000    
 O   -3.988400      6.7699999E-02  -1.248200    
 N   -2.726200      7.4999998E-03  0.7401000    
 C    1.402200     -4.4399999E-02  3.7099998E-02
 C   0.7341000       1.171900      0.1777000    
 C   0.6953000      -1.243300      0.1303000    
 C   -1.347900     -9.4999997E-03  0.5046000    
 C  -0.6410000       1.189300      0.4115000    
 C  -0.6797000      -1.225800      0.3640000    
 C    2.835500     -6.2199999E-02 -0.2089000    
 C    3.613500       1.244900     -0.3143000    
 C   -3.357800      3.7599999E-02 -0.2553000    
 H    1.245100       2.127400      0.1127000    
 H    1.193500      -2.203400      2.4499999E-02
 H   -1.151100       2.142900      0.5219000    
 H   -1.219800      -2.166300      0.4371000    
 H    3.548500       1.800600      0.6248000    
 H    3.242300       1.839500      -1.153100    
 H    4.668400       1.019400     -0.5010000    


%chk=000099452-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000099452

0 1
O 3.612895 -1.187679 -0.051641
O -5.138239 0.004505 0.139889
N -2.710767 -0.005428 0.085689
C 1.512733 -0.013930 -0.015134
C 0.790921 1.210198 -0.014895
C 0.784983 -1.235578 0.019049
C -1.330012 -0.009017 0.051771
C -0.615272 1.219982 0.018117
C -0.617796 -1.242169 0.052569
C 3.013346 -0.071594 -0.049939
C 3.802546 1.233726 -0.081678
C -3.918391 -0.002555 0.107887
H 1.324324 2.165802 -0.041055
H 1.352385 -2.172022 0.018568
H -1.170811 2.162881 0.018324
H -1.175620 -2.183397 0.079460
H 3.582896 1.855232 0.806457
H 3.549092 1.831559 -0.977169
H 4.877485 0.999483 -0.099268


