%chk=000107935.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000107935

0 1
 O  -0.7283000      -1.135400      -1.048300    
 O    1.783700      -2.448900      -1.050200    
 O   -4.667900      0.7808000      0.9559000    
 O   0.6261000       2.611700      -1.977500    
 O    4.559600       1.740300       1.226800    
 O    5.035300     -0.8859000       1.994400    
 C    1.098700      0.2554000      -1.948900    
 C   0.1765000     -0.9468000      -2.144100    
 C    2.141500     -3.1099999E-02 -0.8928000    
 C    1.026900      -2.208000      -2.241600    
 C   0.2518000       1.480000      -1.686600    
 C   -1.476700     -3.2600001E-02 -0.7332000    
 C   -1.054300       1.266100      -1.030900    
 C    2.422700      -1.356000     -0.5236000    
 C   -2.689600     -0.2384000     -5.0400000E-02
 C   -5.215100     -0.5175000       1.262100    
 C    2.890700      0.9981000     -0.3021000    
 C   -3.474500      0.8672000      0.2950000    
 C   -1.843900       2.363700     -0.6826000    
 C   -3.158800      -1.571800      0.3070000    
 C    3.382800      -1.635200      0.4547000    
 C   -3.053300       2.161000     -2.2500001E-02
 C   -4.338800      -1.695400      0.9181000    
 C    3.857400      0.7164000      0.6657000    
 C    4.098400     -0.5991000       1.048900    
 C   -6.537600     -0.6265000      0.4941000    
 C   -5.492900     -0.5187000       2.770000    
 C    4.013900       2.331300       2.404400    
 C    6.365600      -1.124800       1.538100    
 H    1.630400      0.4265000      -2.895600    
 H  -0.4162000     -0.8371000      -3.062500    
 H   0.3798000      -3.081700      -2.377000    
 H    1.713200      -2.166900      -3.096000    
 H    2.730200       2.033300     -0.5919000    
 H   -1.532100       3.380100     -0.9059000    
 H   -2.561600      -2.445200      7.4600004E-02
 H    3.577700      -2.664500      0.7469000    
 H   -3.662700       3.019300      0.2497000    
 H   -4.692500      -2.690500       1.176800    
 H   -7.068200      -1.558100      0.7197000    
 H   -6.365700     -0.5822000     -0.5882000    
 H   -7.199300      0.2138000      0.7348000    
 H   -6.135800      0.3243000       3.049500    
 H   -4.562600     -0.3978000       3.338300    
 H   -5.978200      -1.444600       3.098200    
 H    4.688400       3.126700       2.732700    
 H    3.931300       1.589700       3.205200    
 H    3.032600       2.768600       2.194500    
 H    6.392500      -1.994200      0.8735000    
 H    6.994500      -1.330200       2.408600    
 H    6.760000     -0.2441000       1.021500    


%chk=000107935-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000107935

0 1
O -0.850932 -1.225662 -1.220836
O 1.718522 -2.589543 -1.195709
O -4.427250 0.798473 1.338344
O 0.652659 2.562675 -2.245516
O 4.432586 1.774519 1.146427
O 4.959614 -0.987939 1.960195
C 1.041576 0.151704 -2.158174
C 0.111659 -1.063362 -2.344498
C 2.080615 -0.121983 -1.062178
C 0.904144 -2.367561 -2.399714
C 0.221308 1.427808 -1.874838
C -1.492155 -0.065429 -0.779094
C -1.025961 1.239741 -1.115437
C 2.360528 -1.454506 -0.654455
C -2.631224 -0.256837 0.043573
C -5.187107 -0.520990 1.419843
C 2.793804 0.928447 -0.438147
C -3.324433 0.900857 0.500890
C -1.751347 2.366185 -0.628958
C -3.080903 -1.571435 0.505130
C 3.323905 -1.724041 0.341337
C -2.886950 2.211577 0.172747
C -4.250631 -1.697762 1.191233
C 3.746217 0.677715 0.565962
C 4.028233 -0.668308 0.947588
C -6.281056 -0.461019 0.328759
C -5.782905 -0.515071 2.836738
C 4.085634 2.011584 2.567195
C 6.354196 -0.568535 1.681948
H 1.564512 0.329282 -3.119117
H -0.485650 -0.944613 -3.272176
H 0.230955 -3.237710 -2.448768
H 1.561528 -2.353637 -3.292855
H 2.603594 1.968018 -0.724322
H -1.377337 3.359531 -0.897458
H -2.436936 -2.433470 0.310709
H 3.534974 -2.755755 0.634257
H -3.446437 3.068385 0.556749
H -4.583745 -2.667515 1.578545
H -6.900289 -1.376209 0.357525
H -5.825536 -0.387026 -0.673989
H -6.934603 0.414296 0.491200
H -6.396048 0.389674 2.987451
H -4.982163 -0.528229 3.594743
H -6.423940 -1.403059 2.982807
H 4.702412 2.866986 2.882983
H 4.314233 1.121521 3.182176
H 3.012638 2.265995 2.659915
H 6.750595 -1.131420 0.815555
H 6.922056 -0.827513 2.588504
H 6.408441 0.516266 1.482511


