%chk=000011961.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000011961

0 1
 O   -1.073000     -0.2420000     -4.8599999E-02
 O   -2.903700       1.165800      0.1907000    
 O  -0.4229000       1.941400      0.3674000    
 C    1.203400      0.2329000      5.9400000E-02
 C   -3.192000      -1.201900     -0.2559000    
 C    2.205800       1.063300     -0.3961000    
 C    1.441100      -1.073100      0.4335000    
 C   -4.691000     -0.9582000     -0.2501000    
 C  -0.1817000      0.7643000      0.1508000    
 C   -2.406100      6.6399999E-02 -8.1000002E-03
 C    3.505700      0.5649000     -0.4817000    
 C    2.741100      -1.571400      0.3481000    
 C    3.773300     -0.7524000     -0.1095000    
 H   -2.939100      -1.924500      0.5273000    
 H   -2.896000      -1.608700      -1.228700    
 H    2.009300       2.089500     -0.6920000    
 H   0.6592000      -1.727300      0.8071000    
 H   -4.975700     -0.2407000      -1.026900    
 H   -5.230000      -1.892900     -0.4332000    
 H   -5.020300     -0.5562000      0.7138000    
 H    4.309500       1.202200     -0.8386000    
 H    2.950700      -2.596100      0.6411000    
 H    4.785600      -1.140300     -0.1754000    


%chk=000011961-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000011961

0 1
O -1.111493 -0.325077 -0.269974
O -2.788613 0.955404 0.784805
O -0.425631 1.868088 -0.780334
C 1.250976 0.193931 -0.199336
C -3.385841 -1.111253 -0.444726
C 2.338502 1.082329 -0.417586
C 1.497181 -1.137333 0.227580
C -4.835926 -0.984316 0.053889
C -0.122871 0.714018 -0.429853
C -2.478703 -0.023320 0.095859
C 3.660035 0.641607 -0.208754
C 2.822643 -1.572826 0.435440
C 3.904314 -0.686570 0.217673
H -2.944049 -2.089920 -0.177136
H -3.334864 -1.057648 -1.550437
H 2.124678 2.105211 -0.744895
H 0.652578 -1.812249 0.389708
H -5.262403 -0.004363 -0.219068
H -5.463263 -1.776185 -0.390895
H -4.888586 -1.073721 1.152554
H 4.497634 1.326945 -0.375854
H 3.014278 -2.599277 0.765785
H 4.932624 -1.028476 0.379954


