%chk=000097713.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097713

0 1
 O    2.560000      0.1235000     -0.2769000    
 O    1.179200      0.8577000       1.414200    
 C   0.3293000     -0.6553000     -0.3097000    
 C   0.4118000      -2.111200      0.1922000    
 C   -1.058200     -4.2599998E-02 -0.1944000    
 C    1.374300      0.1998000      0.4005000    
 C  -0.5117000      -3.056100     -0.5666000    
 C   -1.855200     -0.3913000      0.8773000    
 C   -1.479500      0.8443000      -1.164500    
 C   -3.127500      0.1706000      0.9833000    
 C   -2.751800       1.406200      -1.058400    
 C   -3.575800       1.069200      1.5600000E-02
 C    3.637100      0.8884000      0.2737000    
 C    4.868100      0.6968000     -0.5864000    
 H   0.5887000     -0.6623000      -1.378700    
 H    1.442100      -2.465800      5.2299999E-02
 H   0.2318000      -2.188500       1.270300    
 H  -0.3285000      -3.000200      -1.644500    
 H  -0.3268000      -4.088000     -0.2502000    
 H   -1.568600      -2.844400     -0.3860000    
 H   -1.532500      -1.065700       1.662000    
 H  -0.8442000       1.114700      -2.002500    
 H   -3.767200     -8.6900003E-02   1.822500    
 H   -3.100700       2.106800      -1.811400    
 H   -4.565800       1.507900      9.8800004E-02
 H    3.359900       1.948200      0.2925000    
 H    3.842200      0.5475000       1.294700    
 H    5.712900       1.269100     -0.1932000    
 H    5.147000     -0.3612000     -0.6297000    
 H    4.672600       1.016400      -1.615400    


%chk=000097713-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097713

0 1
O 2.470890 0.207707 -0.237119
O 1.632830 -0.543237 1.802175
C 0.427358 -1.073344 -0.302122
C 0.154574 -2.539590 0.155198
C -0.825474 -0.189576 -0.217303
C 1.541237 -0.468330 0.553367
C -0.872767 -3.260434 -0.739859
C -1.433336 0.090245 1.034604
C -1.405954 0.343384 -1.394646
C -2.601375 0.880615 1.101888
C -2.576658 1.133503 -1.328660
C -3.179451 1.403560 -0.079051
C 3.582495 0.893185 0.495832
C 4.472522 1.539991 -0.560065
H 0.781541 -1.080380 -1.348530
H 1.112558 -3.095703 0.148059
H -0.190802 -2.523831 1.205294
H -0.524723 -3.312304 -1.789083
H -1.036914 -4.295159 -0.388329
H -1.846463 -2.739190 -0.732228
H -0.978281 -0.297206 1.953669
H -0.939792 0.139034 -2.366283
H -3.059080 1.092194 2.075012
H -3.014776 1.536901 -2.248705
H -4.086139 2.016657 -0.025063
H 3.134907 1.631038 1.185994
H 4.117171 0.138020 1.100027
H 5.312549 2.066085 -0.070714
H 4.889325 0.780684 -1.243662
H 3.905028 2.273081 -1.158297


