%chk=000034427.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034427

0 1
 O  -5.0799999E-02  0.1141000     -0.7233000    
 O   -3.231600     -0.5656000       1.805900    
 O  -0.5854000     -1.6400000E-02   1.541600    
 O   0.8922000      -3.825400     -0.6984000    
 O  -0.6001000      -2.236800     -0.9936000    
 N    1.834700       2.000200     -0.1349000    
 N   0.5614000      -2.617000     -0.7169000    
 C    2.175600      0.6977000     -0.1192000    
 C    3.484300      0.2744000      0.1939000    
 C    1.226100     -0.2759000     -0.4170000    
 C    1.544700      -1.636100     -0.4101000    
 C    3.805100      -1.093700      0.2007000    
 C    2.835700      -2.045900     -0.1010000    
 C    4.440500       1.254000      0.4937000    
 C   -2.257900      0.6337000     -2.8600000E-02
 C  -0.8955000      0.2071000      0.3811000    
 C   -3.354700      0.2262000      0.7035000    
 C    4.092300       2.596900      0.4785000    
 C    2.787300       2.914100      0.1605000    
 C   -2.378900       1.436200      -1.146000    
 C   -4.625600      0.6377000      0.3020000    
 C   -3.649700       1.847700      -1.547500    
 C   -4.773100       1.448400     -0.8234000    
 C   -3.276800      -1.975700       1.598700    
 H    4.813000      -1.424600      0.4416000    
 H    3.127500      -3.092500     -8.3700001E-02
 H    5.462400      0.9755000      0.7411000    
 H    4.818900       3.367400      0.7078000    
 H    2.457100       3.947400      0.1328000    
 H   -1.521300       1.774800      -1.719600    
 H   -5.505300      0.3315000      0.8616000    
 H   -3.764700       2.482000      -2.421600    
 H   -5.762600       1.769800      -1.135300    
 H   -2.431100      -2.306700      0.9911000    
 H   -4.218400      -2.265500       1.121500    
 H   -3.215900      -2.465900       2.574300    


%chk=000034427-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000034427

0 1
O -0.180912 -0.307573 -0.638825
O -3.890522 -0.620520 1.619035
O -0.711520 -0.190147 1.640242
O 1.342521 -4.080063 -1.251499
O -0.422006 -3.012127 -0.280562
N 1.499617 1.784590 -0.002910
N 0.803725 -3.054639 -0.675908
C 2.047859 0.514375 -0.077015
C 3.457679 0.249372 0.106033
C 1.155685 -0.583646 -0.350353
C 1.678103 -1.883442 -0.435258
C 3.948690 -1.091623 -0.013107
C 3.077222 -2.138493 -0.289735
C 4.302206 1.370130 0.396140
C -2.357588 0.500842 -0.052363
C -1.075857 -0.019841 0.462842
C -3.614605 0.284477 0.599806
C 3.742533 2.645659 0.484063
C 2.333647 2.803980 0.272427
C -2.307260 1.391439 -1.167594
C -4.751786 1.026236 0.179462
C -3.442091 2.100033 -1.589177
C -4.667514 1.927358 -0.893713
C -3.080483 -1.838672 1.822434
H 5.018493 -1.286089 0.118795
H 3.426258 -3.168696 -0.395935
H 5.375988 1.211753 0.545494
H 4.357021 3.523105 0.706487
H 1.876807 3.798473 0.332182
H -1.341236 1.540613 -1.657623
H -5.694971 0.843624 0.702762
H -3.376413 2.790162 -2.435918
H -5.560227 2.481592 -1.203922
H -2.237259 -1.630124 2.499326
H -2.694629 -2.227796 0.862416
H -3.777773 -2.561222 2.273271


