%chk=000097808.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097808

0 1
 O   0.4325000      0.9957000     -0.3126000    
 O    2.354100       2.064500      0.3651000    
 O   -3.407400     -0.1073000      0.8421000    
 O   -2.433600      0.9279000     -0.9356000    
 C   3.5500001E-02 -0.3753000     -0.4756000    
 C    1.257500      -1.132900     -0.1074000    
 C   -1.161500     -0.6461000      0.4225000    
 C    2.246000     -0.3125000      0.2410000    
 C    1.320700      -2.616900     -0.1670000    
 C    1.725200       1.049500      0.1203000    
 C   -2.368900      0.1534000      7.1999999E-03
 H  -0.2147000     -0.5297000      -1.531700    
 H   -1.434100      -1.706600      0.3842000    
 H  -0.9292000     -0.3693000       1.458400    
 H    3.246100     -0.5663000      0.5475000    
 H   0.6247000      -3.063700      0.5493000    
 H    2.324400      -2.985900      6.8400003E-02
 H    1.061700      -2.969100      -1.170300    
 H   -4.210400      0.3998000      0.5964000    


%chk=000097808-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097808

0 1
O 0.417785 1.072346 -0.176415
O 2.374886 2.173808 0.508649
O -3.299815 0.347443 0.967150
O -2.727010 0.147192 -1.275648
C 0.035188 -0.343075 -0.417286
C 1.290105 -1.152783 -0.108432
C -1.182330 -0.681567 0.463243
C 2.284193 -0.295259 0.257054
C 1.334472 -2.647867 -0.242228
C 1.797868 1.108203 0.240164
C -2.445282 -0.023688 -0.070110
H -0.250933 -0.423217 -1.484931
H -1.355607 -1.775908 0.449913
H -1.006481 -0.377378 1.507124
H 3.309691 -0.542603 0.530476
H 0.665840 -3.138958 0.491613
H 2.352702 -3.037199 -0.082237
H 0.994464 -2.967018 -1.245986
H -4.121135 0.766727 0.590087


