%chk=000093929.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093929

0 1
 O    4.065300      -2.333500     -0.3200000    
 O   -4.072200      -1.313000     -0.6264000    
 N    1.788500      0.5307000      1.1200000E-02
 N   -3.614600     -0.7884000      0.3986000    
 C    2.801800     -0.4258000      0.4102000    
 C   0.4199000      0.2026000      0.1061000    
 C    2.198900       1.833600     -0.4733000    
 C  -0.5487000       1.134800     -0.2661000    
 C    3.044900      -1.423000     -0.7099000    
 C   3.5200000E-02  -1.054100      0.5736000    
 C   -1.902000      0.8102000     -0.1708000    
 C    2.296700       2.812800      0.6806000    
 C   -2.286600     -0.4466000      0.2967000    
 C   -1.318000      -1.378600      0.6688000    
 C   -2.909200       1.838300     -0.5792000    
 H    2.576100     -0.9180000       1.364100    
 H    3.748700      9.2600003E-02  0.6157000    
 H    3.199400       1.747600     -0.9187000    
 H    1.585900       2.219100      -1.294100    
 H  -0.2993000       2.129600     -0.6174000    
 H    3.383400     -0.9112000      -1.617200    
 H    2.155900      -2.001600     -0.9754000    
 H   0.7371000      -1.821100      0.8815000    
 H    1.326600       2.970900       1.162200    
 H    2.993600       2.456500       1.446800    
 H    2.656900       3.782900      0.3234000    
 H   -1.599000      -2.363300       1.036500    
 H   -2.437700       2.782600     -0.8729000    
 H   -3.490300       1.485600      -1.437700    
 H   -3.587400       2.064500      0.2505000    
 H    3.749700      -2.804900      0.4698000    


%chk=000093929-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000093929

0 1
O 4.381600 -2.252954 -0.223921
O -4.166873 -1.841665 0.497977
N 1.758862 0.488640 -0.001769
N -3.811675 -0.640664 0.150884
C 2.781483 -0.474490 0.451649
C 0.398302 0.195751 0.043070
C 2.264772 1.805102 -0.456988
C -0.589308 1.187321 -0.278180
C 3.241069 -1.443743 -0.668772
C -0.065193 -1.117395 0.413709
C -1.966304 0.911899 -0.246724
C 2.321403 2.862044 0.669634
C -2.396462 -0.404467 0.129726
C -1.427720 -1.398886 0.456502
C -2.974503 1.990471 -0.593700
H 2.412453 -1.045189 1.324608
H 3.668986 0.086158 0.796288
H 3.279450 1.647255 -0.866824
H 1.644752 2.165568 -1.297059
H -0.278635 2.201427 -0.544353
H 3.621161 -0.871444 -1.531153
H 2.396807 -2.073816 -1.015181
H 0.649731 -1.910309 0.650443
H 1.319018 3.053843 1.089511
H 2.975955 2.524738 1.493313
H 2.724332 3.815130 0.281069
H -1.797190 -2.393526 0.732466
H -2.468909 2.942525 -0.830693
H -3.591351 1.691055 -1.459070
H -3.679427 2.157714 0.238877
H 4.072915 -2.946295 0.411861


