%chk=000078314.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078314

1 1
 O    2.320700      0.9212000     -0.3718000    
 O    2.590700      -1.114600      0.6970000    
 N   -1.885200      0.6112000      9.7000003E-02
 C   -2.302800     -0.5818000     -0.7711000    
 C  -0.3690000      0.8546000     -6.4900003E-02
 C   -1.516000      -1.845100     -0.4136000    
 C   -2.241100      0.3785000       1.565600    
 C   -2.641400       1.853300     -0.3766000    
 C   0.4636000     -0.3875000     -5.4200001E-02
 C  -4.8999999E-02  -1.615800     -0.2022000    
 C    1.908200     -0.2636000      0.1468000    
 C    3.721500       1.189700     -0.2520000    
 H   -2.113500     -0.2974000      -1.813800    
 H   -3.380000     -0.7351000     -0.6396000    
 H  -7.8800000E-02   1.542600      0.7380000    
 H  -0.2364000       1.366200      -1.026400    
 H   -1.649000      -2.574600      -1.221200    
 H   -1.932100      -2.305600      0.4901000    
 H   -1.651500     -0.4542000       1.955600    
 H   -2.009500       1.290500       2.124200    
 H   -3.309900      0.1546000       1.628600    
 H   -2.417300       2.016300      -1.435000    
 H   -3.712300       1.679000     -0.2369000    
 H   -2.308200       2.707600      0.2201000    
 H   0.5824000      -2.499400     -0.1709000    
 H    4.010900       1.226100      0.8026000    
 H    3.920600       2.164600     -0.7047000    
 H    4.299600      0.4294000     -0.7857000    


%chk=000078314-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000078314

1 1
O 2.291358 1.023169 -0.053039
O 2.713722 -1.276506 0.040312
N -1.874812 0.618779 0.035112
C -2.368528 -0.627156 -0.737006
C -0.376593 0.842019 -0.269474
C -1.625669 -1.900804 -0.306752
C -2.081686 0.441733 1.538692
C -2.662152 1.838592 -0.434533
C 0.425645 -0.440365 -0.155836
C -0.139823 -1.678343 -0.173919
C 1.915294 -0.319696 -0.042741
C 3.757645 1.289348 0.030128
H -2.186540 -0.410803 -1.803722
H -3.455920 -0.704187 -0.569524
H -0.005408 1.606459 0.432984
H -0.311929 1.269002 -1.286780
H -1.819759 -2.679283 -1.069198
H -2.035404 -2.314840 0.636400
H -1.401716 -0.334969 1.914495
H -1.860144 1.397189 2.038269
H -3.128333 0.156238 1.725874
H -2.600954 1.910053 -1.531170
H -3.713303 1.731705 -0.125252
H -2.229940 2.742642 0.021657
H 0.517083 -2.551004 -0.075046
H 4.159622 0.869806 0.966257
H 3.845882 2.383429 0.009753
H 4.267564 0.828494 -0.830942


