%chk=000059486.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059486

0 1
 O    1.541900      -1.669500      -1.430400    
 N    2.279100       2.829000      0.2257000    
 N    2.297700      -2.441800      0.5968000    
 C   0.7995000      0.8799000     -0.2400000    
 C    1.823500     -8.7399997E-02  0.3931000    
 C  -0.6336000      0.3847000     -7.9999998E-02
 C   0.9201000       2.307100      0.3376000    
 C   -1.562800      0.7177000      -1.042600    
 C  -0.9533000     -0.3802000       1.021500    
 C    1.850800      -1.459700     -0.2611000    
 C   -2.873900      0.2645000     -0.8965000    
 C   -2.264400     -0.8334000       1.167400    
 C   -3.224600     -0.5110000      0.2083000    
 H    1.018800      0.9251000      -1.317000    
 H    1.717200     -0.1643000       1.480200    
 H    2.839100      0.2962000      0.2294000    
 H   0.2431000       2.986200     -0.1937000    
 H   0.6209000       2.326400       1.392400    
 H   -1.297700       1.322000      -1.904700    
 H  -0.2532000     -0.6332000       1.807600    
 H    2.634300       2.673100     -0.7164000    
 H    2.902300       2.330500      0.8580000    
 H   -3.621800      0.5161000      -1.642800    
 H   -2.540000      -1.431800       2.030900    
 H   -4.245800     -0.8626000      0.3229000    
 H    2.563900      -2.248900       1.557100    
 H    2.375300      -3.405500      0.2890000    


%chk=000059486-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000059486

0 1
O 2.323127 -1.163994 -1.773836
N 2.314853 2.975252 0.360889
N 1.866559 -2.567955 0.014924
C 0.860732 0.898605 -0.114225
C 1.911659 -0.122221 0.408553
C -0.563728 0.367879 0.031635
C 1.032449 2.297289 0.582914
C -1.343377 0.064746 -1.113904
C -1.147734 0.172623 1.313095
C 2.049828 -1.314413 -0.544777
C -2.665322 -0.420136 -0.987906
C -2.468965 -0.309201 1.443848
C -3.234580 -0.607989 0.292320
H 1.076838 1.039149 -1.192062
H 1.663579 -0.444932 1.437609
H 2.900905 0.378410 0.436667
H 0.219329 2.955848 0.223172
H 0.885822 2.191406 1.675215
H -0.903488 0.199282 -2.109501
H -0.570529 0.402545 2.217940
H 2.527971 3.197232 -0.615053
H 3.118922 2.596505 0.865843
H -3.248264 -0.651990 -1.886654
H -2.903417 -0.448191 2.440755
H -4.259876 -0.981630 0.392319
H 1.577340 -2.688833 0.983413
H 1.935768 -3.386087 -0.590491


