%chk=000001114.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001114

0 1
 O    2.963500     -0.6274000       1.773700    
 O  -0.7685000      0.6516000      -2.081500    
 O    1.815800      -2.635700      0.3780000    
 O   0.4095000      -2.092100      -1.341700    
 O   -5.347600     -5.9799999E-02  0.1143000    
 O   -3.841000     -6.5499999E-02   1.814800    
 C    3.008500     -0.2741000      0.3893000    
 C    3.619100       1.131400      0.2424000    
 C    1.603000     -0.4092000     -0.1610000    
 C   0.8154000      0.6675000     -0.3573000    
 C    2.595000       2.227300      0.2470000    
 C    1.303700       1.993900     -2.2000000E-02
 C  -0.5615000      0.5774000     -0.8722000    
 C   -1.658500      0.3863000      0.1620000    
 C   -3.054100      0.2883000     -0.4422000    
 C    1.191100      -1.791200     -0.4645000    
 C   -4.093300      3.1199999E-02  0.6208000    
 H    3.683100     -0.9834000     -0.1068000    
 H    4.167200       1.197200     -0.7056000    
 H    4.337200       1.317600       1.049600    
 H    2.926700       3.239300      0.4579000    
 H   0.5952000       2.816700     -1.9500000E-02
 H   -1.436400     -0.5282000      0.7255000    
 H   -1.619800       1.230500      0.8611000    
 H   -3.092500     -0.5334000      -1.165900    
 H   -3.305500       1.221900     -0.9573000    
 H    3.877700     -0.6319000       2.105000    
 H    1.571200      -3.571100      0.2125000    
 H   -6.015300     -0.2168000      0.8155000    


%chk=000001114-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000001114

0 1
O 3.078623 -0.539064 1.812805
O -0.910940 1.454541 -1.796352
O 1.772156 -2.627107 0.195137
O -0.151147 -1.821104 -0.834736
O -5.160050 -0.794830 0.027682
O -4.199640 0.551863 1.654344
C 3.055099 -0.234718 0.359193
C 3.756023 1.126642 0.182596
C 1.607241 -0.264042 -0.124742
C 0.876915 0.898695 -0.303684
C 2.844865 2.323320 0.119338
C 1.506959 2.209688 -0.140748
C -0.590764 0.921178 -0.698440
C -1.631037 0.463758 0.317228
C -2.903517 -0.061432 -0.365594
C 0.967095 -1.575575 -0.310375
C -4.099307 -0.046591 0.558891
H 3.634050 -1.015228 -0.169462
H 4.366093 1.116471 -0.745405
H 4.476358 1.226810 1.017346
H 3.298121 3.315724 0.234602
H 0.877010 3.098431 -0.248002
H -1.205282 -0.283680 1.005594
H -1.886460 1.346352 0.942933
H -2.741872 -1.080442 -0.756590
H -3.139887 0.570289 -1.245256
H 2.818441 -1.492738 1.915110
H 1.313470 -3.492647 0.023885
H -5.939714 -0.736263 0.644603


