%chk=000094331.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094331

0 1
 O   -1.604100     -0.8290000      -1.746500    
 O    2.803800      -1.588100      8.0799997E-02
 O   -2.698600      -2.013900     -0.1634000    
 O    3.904400      0.8289000     -0.7375000    
 N   -3.788700      0.3447000      0.8236000    
 C   -2.482200      0.3973000      0.1504000    
 C   -1.386500      0.6427000       1.215800    
 C   3.2000002E-02  0.6893000      0.6927000    
 C   -2.563600       1.547900     -0.8648000    
 C   -2.291200     -0.9352000     -0.5797000    
 C   0.7677000     -0.4816000      0.6287000    
 C   0.5645000       1.901800      0.2895000    
 C    2.076000     -0.4386000      0.1467000    
 C    1.872600       1.944800     -0.1923000    
 C    2.628400      0.7747000     -0.2639000    
 C    2.165500      -2.785700      0.5199000    
 H   -1.590800       1.578400       1.756000    
 H   -1.440700     -0.1425000       1.984300    
 H   -3.375500       1.387900      -1.585800    
 H   -1.646300       1.654800      -1.453100    
 H   -2.746900       2.507800     -0.3672000    
 H   -4.535100      0.2623000      0.1338000    
 H   -3.958900       1.219300       1.319400    
 H   0.2855000      -1.392900      0.9639000    
 H  -1.4000000E-02   2.819300      0.3444000    
 H    2.290700       2.896800     -0.5084000    
 H   -1.489500      -1.699500      -2.183800    
 H    4.115700       1.748400     -0.9737000    
 H    1.914800      -2.742400       1.585400    
 H    2.887900      -3.599400      0.3968000    
 H    1.299300      -3.033500     -0.1033000    


%chk=000094331-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000094331

0 1
O -3.395091 -1.339603 -1.400883
O 2.954924 -1.467424 0.069707
O -1.865207 -2.005891 0.200466
O 4.118653 0.914325 -0.340675
N -3.853914 0.638418 0.560037
C -2.494149 0.425744 -0.007056
C -1.468180 0.726425 1.133840
C 0.000769 0.792440 0.735819
C -2.215230 1.274752 -1.277222
C -2.495478 -1.079516 -0.351684
C 0.770249 -0.393799 0.592574
C 0.634992 2.037340 0.522590
C 2.134452 -0.345672 0.232633
C 2.002071 2.098491 0.163238
C 2.758939 0.919204 0.012032
C 2.339477 -2.777929 0.297621
H -1.760042 1.709348 1.555675
H -1.627798 -0.028044 1.924899
H -2.985306 1.081892 -2.043207
H -1.223821 1.053570 -1.710421
H -2.236968 2.347280 -1.008480
H -4.609743 0.531045 -0.123442
H -3.937992 1.484014 1.131887
H 0.276424 -1.353957 0.763165
H 0.067697 2.967672 0.641568
H 2.484507 3.072380 0.004660
H -3.435718 -2.321777 -1.557339
H 4.438696 1.843045 -0.463440
H 1.978234 -2.877652 1.339645
H 3.143185 -3.504746 0.109571
H 1.497569 -2.956576 -0.399081


