%chk=000083063.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083063

0 1
 O    2.369000     -6.3999998E-03  0.7994000    
 O   -3.828600      -1.085300     -0.3337000    
 O    2.742400      4.7300000E-02  -1.510900    
 C   -1.716000     -5.1800001E-02  6.5200001E-02
 C    1.029600     -2.1299999E-02  0.5589000    
 C   -1.047700       1.163400      0.2149000    
 C   -1.011500      -1.251700      0.1625000    
 C   0.3251000       1.178600      0.4618000    
 C   0.3613000      -1.236400      0.4094000    
 C   -3.147500     -6.7500003E-02 -0.1915000    
 C   -3.849900       1.255900     -0.2846000    
 C    3.160200      3.0600000E-02 -0.3606000    
 C    4.613800      4.4500001E-02  8.9999996E-03
 H   -1.547000       2.124600      0.1491000    
 H   -1.513100      -2.209200      4.9199998E-02
 H   0.8401000       2.128500      0.5782000    
 H   0.9041000      -2.174800      0.4846000    
 H   -3.458000       1.846400      -1.117400    
 H   -3.778800       1.801100      0.6606000    
 H   -4.914100       1.085100     -0.4813000    
 H    4.833500      0.9312000      0.6086000    
 H    5.219300      7.9300001E-02 -0.9011000    
 H    4.862800     -0.8654000      0.5603000    


%chk=000083063-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000083063

0 1
O 2.425927 -0.404651 0.197044
O -3.961660 -1.091302 0.382465
O 3.191259 1.743630 -0.412679
C -1.803853 -0.061536 0.099697
C 1.019913 -0.183821 0.133998
C -1.022667 1.079533 -0.217191
C -1.137493 -1.273554 0.436514
C 0.388008 1.036942 -0.205340
C 0.263087 -1.337991 0.454649
C -3.306204 -0.045673 0.095102
C -4.029454 1.249151 -0.261880
C 3.423414 0.566175 -0.078463
C 4.780636 -0.072152 0.104227
H -1.509586 2.024585 -0.479386
H -1.749107 -2.148386 0.679417
H 0.979438 1.918875 -0.450435
H 0.792276 -2.260372 0.711244
H -3.766445 1.582694 -1.283154
H -3.755127 2.064039 0.433728
H -5.115250 1.079506 -0.207617
H 4.891192 -0.438994 1.139412
H 5.566485 0.664041 -0.116340
H 4.884212 -0.944039 -0.564413


