%chk=000097975.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097975

0 1
 O    1.479100      -1.346400     -0.3659000    
 N    1.614300       3.560000       1.070600    
 C   0.9268000     -5.0999999E-02 -0.1186000    
 C    1.408600      0.9101000      -1.220300    
 C  -0.5755000     -0.1919000     -4.1499998E-02
 C    2.752100      -1.486400      0.2432000    
 C   0.8515000       2.332500      -1.125700    
 C   -1.221800      7.8699999E-02   1.153500    
 C   -1.277500     -0.5890000      -1.167900    
 C    2.573700      -1.999300       1.664000    
 C    3.607700      -2.424300     -0.5948000    
 C   -3.330100     -0.4505000      9.9200003E-02
 C   -2.608800     -5.1600002E-02   1.224300    
 C   -2.664500     -0.7192000      -1.096900    
 C   -4.813100     -0.5888000      0.1748000    
 C    1.277500       3.017000      0.1021000    
 H    1.280700      0.3277000      0.8492000    
 H    2.505500      0.9549000      -1.209900    
 H    1.160000      0.5000000      -2.207900    
 H    3.282200     -0.5263000      0.2819000    
 H  -0.2416000       2.328900      -1.192200    
 H    1.209300       2.904000      -1.990500    
 H  -0.6725000      0.3900000       2.037200    
 H  -0.7750000     -0.8116000      -2.104200    
 H    3.540400      -2.150100       2.154400    
 H    1.988100      -1.302400       2.271800    
 H    2.029400      -2.950300       1.668000    
 H    4.603000      -2.554500     -0.1590000    
 H    3.719300      -2.031500      -1.611200    
 H    3.133700      -3.407600     -0.6878000    
 H   -3.116100      0.1624000       2.161200    
 H   -3.215600      -1.030900      -1.980300    
 H   -5.173200      -1.363300     -0.5109000    
 H   -5.132100     -0.8792000       1.181500    
 H   -5.292400      0.3602000     -8.5000001E-02


%chk=000097975-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000097975

0 1
O 2.010110 -0.845781 -0.728775
N 1.481661 3.954605 1.017359
C 1.217982 0.317796 -0.287965
C 1.413393 1.353262 -1.423358
C -0.254554 -0.022837 -0.060766
C 2.630473 -1.656160 0.353146
C 0.669069 2.696741 -1.191376
C -0.966400 0.515996 1.037614
C -0.945770 -0.860687 -0.972150
C 1.601854 -2.514113 1.114991
C 3.696437 -2.504859 -0.352038
C -3.037278 -0.605156 0.310014
C -2.338960 0.228223 1.219535
C -2.313656 -1.147866 -0.786154
C -4.516823 -0.899505 0.490207
C 1.114353 3.399932 0.026075
H 1.648075 0.731384 0.651677
H 2.496524 1.533001 -1.541396
H 1.043850 0.910895 -2.366889
H 3.123245 -0.953244 1.063205
H -0.419900 2.518395 -1.111508
H 0.830040 3.364034 -2.058858
H -0.446446 1.158973 1.759744
H -0.392723 -1.306352 -1.806765
H 2.117635 -3.135530 1.871072
H 0.851551 -1.893449 1.633170
H 1.069472 -3.182578 0.415187
H 4.253586 -3.115067 0.381585
H 4.409651 -1.859139 -0.892136
H 3.220412 -3.183046 -1.082588
H -2.871242 0.650645 2.080559
H -2.830842 -1.806976 -1.494972
H -4.757477 -1.944514 0.224528
H -4.839493 -0.729135 1.532102
H -5.134708 -0.247591 -0.157674


