%chk=000080479.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080479

0 1
 O    2.678600      -1.720000      0.7994000    
 N  -0.3562000       2.111200      0.1427000    
 C  -7.2700001E-02 -0.2659000     -0.1336000    
 C    1.311500     -8.1100002E-02 -0.2502000    
 C  -0.8805000      0.8734000      6.4700000E-02
 C  -0.6536000      -1.543200     -0.2099000    
 C    2.253900      -1.224300     -0.4624000    
 C    1.854700       1.193100     -0.1703000    
 C   -2.255500      0.6892000      0.1806000    
 C   -2.031700      -1.698400     -9.0800002E-02
 C   0.9846000       2.246500      2.5200000E-02
 C   -2.833300     -0.5806000      0.1046000    
 H  -6.7599997E-02  -2.446500     -0.3463000    
 H    1.842000      -2.037800      -1.065400    
 H    3.147000     -0.8886000      -1.002500    
 H    2.921200       1.371200     -0.2537000    
 H   -2.905300       1.548700      0.3344000    
 H   -2.477300      -2.686900     -0.1467000    
 H    1.351700       3.265100      9.6500002E-02
 H   -3.909500     -0.6925000      0.1996000    
 H    1.887800      -1.960700       1.311400    


%chk=000080479-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000080479

0 1
O 2.575520 -1.942550 0.834922
N -0.388021 2.174766 0.117862
C -0.040194 -0.283016 -0.152050
C 1.382573 -0.066214 -0.288734
C -0.887124 0.876477 0.058909
C -0.654726 -1.578762 -0.208568
C 2.338318 -1.235411 -0.443139
C 1.855145 1.248776 -0.227414
C -2.299144 0.700512 0.214116
C -2.036367 -1.721412 -0.053944
C 0.940842 2.331690 -0.028417
C -2.865068 -0.575403 0.163001
H -0.042859 -2.468404 -0.400379
H 1.975081 -1.946409 -1.214056
H 3.336664 -0.880833 -0.743068
H 2.925937 1.458667 -0.320879
H -2.904221 1.598545 0.371602
H -2.492086 -2.716390 -0.104555
H 1.313498 3.361994 0.017830
H -3.946202 -0.703484 0.283108
H 1.702234 -2.161238 1.251152


