%chk=000076942.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076942

0 1
 O   0.3364000      0.9146000      0.9157000    
 C    1.429600      0.1928000      0.4669000    
 C    2.421100      0.8228000     -0.2637000    
 C  -0.8968000      0.5242000      0.4922000    
 C   -3.424100     -0.2744000     -0.3783000    
 C   -1.105600      0.2130000     -0.8514000    
 C   -1.951600      0.4362000       1.400500    
 C    1.496900      -1.156600      0.7680000    
 C    3.515300      8.0300003E-02 -0.7079000    
 C   -2.369300     -0.1863000      -1.286700    
 C   -3.215300      3.6800001E-02  0.9654000    
 C    2.346900       2.278400     -0.5877000    
 C    2.591100      -1.899100      0.3239000    
 C    3.600200      -1.280600     -0.4140000    
 C   -4.774900     -0.7020000     -0.8430000    
 H  -0.3081000      0.2896000      -1.585300    
 H   -1.794600      0.6767000       2.448400    
 H   0.7239000      -1.648600       1.351100    
 H    4.309800      0.5467000      -1.284300    
 H   -2.520000     -0.4241000      -2.336400    
 H   -4.028600     -3.0099999E-02   1.683100    
 H    3.247600       2.628900      -1.103000    
 H    1.491300       2.478700      -1.240700    
 H    2.245100       2.868900      0.3289000    
 H    2.658400      -2.958200      0.5547000    
 H    4.452300      -1.858700     -0.7593000    
 H   -5.564700     -0.2375000     -0.2428000    
 H   -4.947300     -0.4054000      -1.883200    
 H   -4.871000      -1.789700     -0.7681000    


%chk=000076942-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000076942

0 1
O 0.329344 0.901639 0.475607
C 1.490348 0.152034 0.147923
C 2.648787 0.920542 -0.149988
C -0.970735 0.409609 0.195107
C -3.669353 -0.327189 -0.325840
C -1.285122 -0.315010 -0.977784
C -1.986797 0.779376 1.102091
C 1.524176 -1.259258 0.209140
C 3.849730 0.214164 -0.401568
C -2.627616 -0.675924 -1.224049
C -3.323036 0.413082 0.834653
C 2.580622 2.433627 -0.182209
C 2.737781 -1.933991 -0.048774
C 3.904240 -1.198558 -0.357865
C -5.105727 -0.747310 -0.587779
H -0.499366 -0.580304 -1.692093
H -1.718520 1.353449 1.994184
H 0.618971 -1.818843 0.464551
H 4.755033 0.786639 -0.636624
H -2.868354 -1.232423 -2.138142
H -4.108877 0.706386 1.541271
H 3.536135 2.865094 -0.526049
H 1.772817 2.783160 -0.850055
H 2.353596 2.843430 0.819507
H 2.768536 -3.028007 0.000015
H 4.847461 -1.717589 -0.559038
H -5.823016 -0.017462 -0.172325
H -5.308479 -0.845804 -1.668910
H -5.328579 -1.727259 -0.121956


