%chk=000121548.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121548

0 1
 O  -0.7973000       2.421900      0.3170000    
 N   -3.483200      -1.500900     -0.7119000    
 C  -0.9184000       1.026300      0.5997000    
 C   -2.107200      0.4595000     -0.1932000    
 C   0.4036000      0.3692000      0.2782000    
 C   -2.354100      -1.024500      7.9599999E-02
 C   0.8041000     -0.7399000       1.005200    
 C    1.189700      0.8886000     -0.7373000    
 C    2.024800      -1.346300      0.7084000    
 C    2.410200      0.2819000      -1.034300    
 C    2.827800     -0.8356000     -0.3114000    
 H   -1.112700      0.9434000       1.676300    
 H   -1.938700      0.6197000      -1.267200    
 H   -3.006500       1.039700      5.2999999E-02
 H   -2.556700      -1.187900       1.143500    
 H   -1.485800      -1.626700     -0.1992000    
 H   0.1895000      -1.143400       1.804700    
 H   0.8815000       1.747400      -1.326100    
 H   -1.634400       2.846400      0.5710000    
 H    2.350400      -2.215900       1.272000    
 H    3.034000      0.6772000      -1.830800    
 H   -4.323100     -0.9821000     -0.4584000    
 H   -3.669700      -2.476000     -0.4815000    
 H    3.777700      -1.308400     -0.5430000    


%chk=000121548-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000121548

0 1
O -0.783110 2.485053 0.460840
N -3.551686 -1.446546 -0.749783
C -0.936931 1.031010 0.689037
C -2.104019 0.479624 -0.172196
C 0.400482 0.387451 0.351408
C -2.382582 -1.023064 0.042519
C 0.905881 -0.675492 1.138506
C 1.136364 0.817879 -0.780756
C 2.121645 -1.310908 0.795413
C 2.353920 0.188896 -1.121619
C 2.848784 -0.881019 -0.338086
H -1.169211 0.845286 1.761745
H -1.891036 0.656468 -1.242142
H -3.025352 1.051200 0.080364
H -2.484439 -1.218332 1.140766
H -1.506284 -1.602384 -0.300393
H 0.353796 -1.002881 2.028759
H 0.759761 1.663270 -1.365287
H -1.676308 2.910316 0.523299
H 2.503500 -2.131243 1.413844
H 2.920162 0.534499 -1.994200
H -4.432772 -0.999299 -0.479459
H -3.649377 -2.458622 -0.864782
H 3.794313 -1.367560 -0.603498


