%chk=000013446.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013446

0 1
 O   0.8945000       2.512500     -0.8085000    
 N   -1.454300       2.738900      0.4576000    
 C  -0.7388000       1.471300      0.6510000    
 C   -1.595800      0.2998000      0.2171000    
 C   0.6166000       1.524500     -9.7800002E-02
 C    1.571500      0.4349000      2.5400000E-02
 C   -2.471500     -0.2677000       1.125200    
 C   -1.482600     -0.1754000      -1.077200    
 C    1.624300     -0.3172000       1.199000    
 C    2.434800      0.1415000      -1.030300    
 C   -3.260300      -1.346600      0.7257000    
 C   -2.271600      -1.254000      -1.476700    
 C   -3.160600      -1.839600     -0.5754000    
 C    2.540100      -1.362600       1.316700    
 C    3.350500     -0.9040000     -0.9126000    
 C    3.403200      -1.656100      0.2609000    
 H  -0.5154000       1.405900       1.721600    
 H   -2.556300      0.1101000       2.139900    
 H  -0.8216000      0.2743000      -1.811100    
 H   -1.708000       2.848500     -0.5237000    
 H   -2.327600       2.727200      0.9831000    
 H   0.9807000     -0.1113000       2.048000    
 H    2.405400      0.7123000      -1.954900    
 H   -3.952800      -1.802200       1.427400    
 H   -2.198600      -1.634200      -2.491500    
 H   -3.776000      -2.678400     -0.8869000    
 H    2.583800      -1.946500       2.231500    
 H    4.021700      -1.133500      -1.735000    
 H    4.116600      -2.470000      0.3528000    


%chk=000013446-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000013446

0 1
O 0.712034 2.143194 -1.316808
N -1.336547 2.770866 0.269692
C -0.733580 1.457728 0.510039
C -1.663390 0.273936 0.153447
C 0.564009 1.359862 -0.330160
C 1.604914 0.336012 -0.000430
C -2.213578 -0.538389 1.174453
C -2.032117 0.028665 -1.195270
C 1.517116 -0.528786 1.124358
C 2.735055 0.238454 -0.859156
C -3.116870 -1.580038 0.859173
C -2.924666 -1.016671 -1.512873
C -3.471589 -1.824975 -0.486521
C 2.536829 -1.469093 1.381140
C 3.752056 -0.700272 -0.601990
C 3.655962 -1.558115 0.520623
H -0.461381 1.356134 1.581047
H -1.947250 -0.346551 2.222435
H -1.616462 0.658326 -1.991213
H -1.037756 3.193227 -0.616351
H -2.336821 2.832760 0.464815
H 0.657751 -0.477139 1.799153
H 2.788705 0.913251 -1.719780
H -3.542621 -2.195227 1.659993
H -3.195697 -1.203752 -2.558210
H -4.167570 -2.634117 -0.734458
H 2.460460 -2.131508 2.250106
H 4.617941 -0.766569 -1.269595
H 4.446962 -2.288813 0.723639


