%chk=000127844.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127844

0 1
 O  -0.9746000      -1.994900     -0.4317000    
 O  -0.5493000       2.574000       1.205600    
 O    4.136100      -1.434200     -4.0199999E-02
 C   -3.094200     -0.9657000      0.3110000    
 C   -2.348800      0.2760000      0.8701000    
 C   -2.164600      -2.210000      0.3457000    
 C   -3.651400     -0.6548000      -1.097200    
 C  -0.9207000      0.3266000      0.3507000    
 C   -4.612200      0.5356000      -1.081200    
 C   -3.124000       1.553300      0.6340000    
 C   -4.148000       1.679100     -0.2256000    
 C  -0.3379000     -0.7943000     -0.2594000    
 C   -2.846500      -3.441500     -0.2778000    
 C   -1.763900      -2.600000       1.784200    
 C  -0.1252000       1.473900      0.5190000    
 C   0.9717000     -0.7418000     -0.7513000    
 C   -4.905800       2.965600     -0.3740000    
 C    1.731400      0.4151000     -0.6034000    
 C    1.186000       1.520000      4.0300000E-02
 C    3.129500      0.4629000      -1.118600    
 C    4.170300     -8.5000005E-03 -8.1799999E-02
 C    5.582200      0.4608000     -0.4614000    
 C    6.640800      4.3900002E-02  0.5639000    
 C    8.019400      0.5587000      0.1790000    
 H   -3.960000      -1.166200      0.9600000    
 H   -2.279700      0.1544000       1.960100    
 H   -4.198800      -1.512600      -1.501500    
 H   -2.832100     -0.4484000      -1.797000    
 H   -5.590600      0.2033000     -0.7118000    
 H   -4.759000      0.8761000      -2.113200    
 H   -2.887900       2.405700       1.265100    
 H   -3.820700      -3.639000      0.1811000    
 H   -2.976200      -3.328400      -1.359300    
 H   -2.222900      -4.335500     -0.1554000    
 H   -1.171600      -1.825500       2.280800    
 H   -2.645800      -2.805300       2.400100    
 H   -1.129900      -3.494700       1.779800    
 H    1.396500      -1.616000      -1.239900    
 H   -5.963400       2.812000     -0.1361000    
 H   -4.830400       3.333800      -1.402300    
 H   -4.525500       3.749900      0.2888000    
 H    1.790600       2.413500      0.1797000    
 H    3.203600     -0.1453000      -2.030000    
 H    3.350400       1.493500      -1.426100    
 H    3.925900      0.3682000      0.9190000    
 H   0.1496000       3.249700       1.214800    
 H    5.855500      3.6699999E-02  -1.436000    
 H    5.588900       1.552800     -0.5637000    
 H    6.677400      -1.048200      0.6463000    
 H    6.373900      0.4357000       1.552200    
 H    3.300900      -1.698300      0.3808000    
 H    8.329000      0.1614000     -0.7929000    
 H    8.760200      0.2509000      0.9236000    
 H    8.028600       1.651800      0.1227000    


%chk=000127844-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000127844

0 1
O -0.933777 -1.892664 -0.517837
O -0.727571 2.527106 1.550581
O 3.968675 -1.145581 0.329720
C -3.104212 -0.998535 0.277383
C -2.430326 0.268215 0.894980
C -2.137523 -2.216775 0.332668
C -3.609603 -0.695256 -1.155411
C -0.961479 0.388673 0.446499
C -4.687968 0.406383 -1.139618
C -3.255865 1.522670 0.602642
C -4.287146 1.594682 -0.281205
C -0.316893 -0.657818 -0.269138
C -2.703757 -3.489802 -0.314666
C -1.652617 -2.519894 1.768679
C -0.161165 1.529335 0.725333
C 0.997952 -0.528950 -0.783478
C -5.099533 2.862483 -0.463146
C 1.738564 0.651264 -0.555527
C 1.153028 1.675761 0.230118
C 3.169534 0.777948 -1.052042
C 4.205382 0.269981 -0.004295
C 5.649273 0.357905 -0.521249
C 6.701017 -0.019063 0.545209
C 8.143196 0.026907 -0.002789
H -3.984237 -1.245237 0.906685
H -2.426671 0.157497 2.001416
H -4.027723 -1.606103 -1.619489
H -2.756181 -0.373821 -1.781797
H -5.651674 -0.005943 -0.768130
H -4.890570 0.749622 -2.174977
H -2.977736 2.408027 1.183179
H -3.666105 -3.764488 0.153905
H -2.860830 -3.353401 -1.396172
H -1.997330 -4.327037 -0.180666
H -1.115658 -1.666046 2.213750
H -2.514116 -2.762684 2.417686
H -0.968312 -3.385754 1.758393
H 1.410557 -1.352861 -1.373974
H -6.178018 2.674305 -0.287531
H -5.011650 3.246614 -1.499451
H -4.774942 3.660373 0.227033
H 1.725498 2.586610 0.454290
H 3.305741 0.188823 -1.978450
H 3.404190 1.834220 -1.286454
H 4.102256 0.889778 0.916925
H -0.082977 3.266559 1.679035
H 5.745830 -0.318408 -1.394246
H 5.835704 1.389991 -0.884241
H 6.467368 -1.030421 0.925008
H 6.609193 0.672299 1.408415
H 3.010012 -1.255508 0.567734
H 8.268035 -0.679216 -0.845492
H 8.879225 -0.245248 0.776013
H 8.400737 1.038281 -0.372205


