%chk=000099557.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099557

0 1
 O    1.872700      2.1600001E-02 -0.7984000    
 O    3.536800      -2.291400     -0.4408000    
 O    3.553200       2.317700     -0.4074000    
 O    1.408800     -6.4400002E-02   1.462700    
 O   -6.723900      3.0500000E-02 -0.7883000    
 N    3.233400      1.4300000E-02 -0.4208000    
 C    5.313100     -0.7625000      0.1641000    
 C    5.318600      0.7676000      0.1752000    
 C    3.925300      -1.145700     -0.2736000    
 C    3.933500       1.167100     -0.2569000    
 C   -1.370100     -2.8100001E-02  0.9904000    
 C  -0.3853000     -1.2900000E-02 -0.1782000    
 C   -2.799800     -1.2400000E-02  0.5150000    
 C    1.051500     -2.3300000E-02  0.2930000    
 C   -3.440900       1.202200      0.3216000    
 C   -3.452800      -1.213300      0.2790000    
 C   -4.764900       1.216400     -0.1177000    
 C   -4.776600      -1.199200     -0.1604000    
 C   -5.432600      1.5699999E-02 -0.3586000    
 H    5.512700      -1.167800       1.160300    
 H    6.047400      -1.156800     -0.5443000    
 H    6.055800       1.166900     -0.5274000    
 H    5.520900       1.157000       1.177100    
 H   -1.190500      0.8324000       1.648700    
 H   -1.199600     -0.9126000       1.618400    
 H  -0.5416000     -0.8929000     -0.8131000    
 H  -0.5383000      0.8876000     -0.7847000    
 H   -2.928900       2.142600      0.5048000    
 H   -2.949800      -2.164500      0.4289000    
 H   -5.270400       2.165900     -0.2710000    
 H   -5.285500      -2.141400     -0.3451000    
 H   -7.027800     -0.8862000     -0.9040000    


%chk=000099557-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099557

0 1
O 1.900828 0.034817 -0.765663
O 3.516713 -2.340304 -0.376084
O 3.541875 2.371734 -0.257583
O 1.489693 -0.045337 1.564308
O -6.798684 0.064462 -0.965145
N 3.282751 0.019655 -0.428332
C 5.437466 -0.780867 0.063676
C 5.446293 0.771873 0.099407
C 3.999892 -1.197319 -0.265202
C 4.012566 1.219590 -0.204936
C -1.413436 -0.017561 1.108474
C -0.396833 0.003708 -0.062779
C -2.845232 -0.017675 0.593972
C 1.034708 -0.007138 0.417861
C -3.524364 1.200110 0.323589
C -3.525902 -1.232385 0.332061
C -4.834477 1.212708 -0.193828
C -4.839527 -1.240829 -0.186545
C -5.491355 -0.012651 -0.450882
H 5.719925 -1.233676 1.028944
H 6.112196 -1.198284 -0.703004
H 6.123202 1.216166 -0.650094
H 5.737278 1.176899 1.083162
H -1.230019 0.860847 1.753532
H -1.220587 -0.910701 1.729912
H -0.545596 -0.867130 -0.729388
H -0.545340 0.896499 -0.699242
H -3.023762 2.154476 0.528798
H -3.028909 -2.187433 0.542301
H -5.361897 2.149067 -0.397985
H -5.350181 -2.193956 -0.376816
H -7.174884 -0.839264 -1.107993


