%chk=000088397.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088397

0 1
 O    2.834700     -0.5342000       1.195300    
 O    2.719700      0.6066000     -0.7592000    
 N   0.8420000     -0.4091000      0.1694000    
 C  -0.1396000     -3.6600001E-02 -0.8554000    
 C   -1.175400      -1.152700     -0.9301000    
 C  -0.7179000       1.320100     -0.4692000    
 C   -2.121500      -1.183400      0.2705000    
 C   -1.670100       1.255800      0.7252000    
 C   -2.739300      0.1846000      0.5395000    
 C    2.167400     -5.1100001E-02  0.1140000    
 H   0.3903000      4.7100000E-02  -1.811200    
 H  -0.6882000      -2.129800      -1.035700    
 H   -1.778000      -1.004000      -1.835600    
 H   -1.276800       1.712600      -1.328700    
 H   7.8800000E-02   2.044400     -0.2604000    
 H   -1.586400      -1.526000       1.163900    
 H   -2.917900      -1.913800      8.6099997E-02
 H   -2.148200       2.232200      0.8645000    
 H   -1.101500       1.049800       1.640100    
 H   -3.393900      0.4615000     -0.2960000    
 H   -3.369000      0.1341000       1.434900    
 H   0.5282000     -0.9188000      0.9898000    
 H    3.784700     -0.2902000       1.177100    


%chk=000088397-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000088397

0 1
O 2.866495 -0.556411 1.272149
O 2.642472 0.842816 -0.607869
N 0.873961 -0.504232 0.159882
C -0.117511 -0.085376 -0.858856
C -1.228982 -1.158485 -0.964409
C -0.721253 1.308455 -0.531530
C -2.147645 -1.190598 0.283495
C -1.626857 1.272076 0.720765
C -2.742547 0.208086 0.578638
C 2.142041 0.004981 0.188486
H 0.425740 -0.013934 -1.819942
H -0.775880 -2.152123 -1.147179
H -1.844558 -0.915935 -1.852468
H -1.315666 1.636448 -1.408717
H 0.101091 2.036647 -0.408665
H -1.582586 -1.541233 1.173741
H -2.956772 -1.929286 0.126730
H -2.071064 2.271263 0.891350
H -1.011120 1.042810 1.614294
H -3.416912 0.496766 -0.254298
H -3.361792 0.173587 1.495612
H 0.611399 -1.174704 0.882767
H 3.780044 -0.172518 1.254823


