%chk=000085994.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085994

0 1
 O   0.1159000       1.620400      0.3023000    
 O  -0.9133000       2.737100      -1.433800    
 C    2.378500      0.7392000      0.3241000    
 C    1.783900     -0.5682000      0.8889000    
 C    3.679500      0.5436000     -0.4866000    
 C    1.403700      -1.585800     -0.1916000    
 C    1.298300       1.486900     -0.4746000    
 C   0.7991000      -2.872000      0.3782000    
 C    4.835200     -7.8800000E-02  0.2849000    
 C   -2.544500      0.9105000       1.102800    
 C   -2.112200       2.300900      0.6373000    
 C   -2.944600      7.9999998E-04 -6.3100003E-02
 C   0.3956000      -3.876000     -0.6906000    
 C  -0.9268000       2.273100     -0.3020000    
 C   -3.403400      -1.369300      0.4364000    
 C   -3.844700      -2.262200     -0.7125000    
 H    2.620200       1.361800       1.197200    
 H    2.510700      -1.028900       1.569100    
 H   0.9065000     -0.3515000       1.510400    
 H    3.484800     -4.8300002E-02  -1.388000    
 H    4.009200       1.528600     -0.8417000    
 H    2.286400      -1.854600     -0.7820000    
 H   0.6756000      -1.148000     -0.8828000    
 H    1.671900       2.487100     -0.7275000    
 H    1.072200      0.9665000      -1.412300    
 H    1.521900      -3.344300       1.054100    
 H  -8.2999997E-02  -2.623100      0.9798000    
 H    5.740900     -7.9800002E-02 -0.3299000    
 H    5.045100      0.4862000       1.198300    
 H    4.619100      -1.115400      0.5592000    
 H   -3.393600       1.020600       1.788100    
 H   -1.736800      0.4370000       1.673800    
 H   -2.942700       2.793800      0.1185000    
 H   -1.851300       2.929400       1.496100    
 H   -3.752000      0.4740000     -0.6350000    
 H   -2.098400     -0.1335000     -0.7472000    
 H  -0.3571000      -3.449800      -1.361500    
 H    1.260400      -4.176300      -1.290500    
 H  -2.8400000E-02  -4.773200     -0.2290000    
 H   -4.237800      -1.250400       1.137400    
 H   -2.588600      -1.858700      0.9820000    
 H   -4.682300      -1.815600      -1.257700    
 H   -3.023800      -2.427200      -1.417800    
 H   -4.167100      -3.236800     -0.3328000    


%chk=000085994-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000085994

0 1
O 0.131550 1.814104 0.029015
O -0.573598 2.417140 -2.109040
C 2.259591 0.710837 0.547799
C 1.535605 -0.622050 0.886613
C 3.727329 0.531230 0.063820
C 1.407710 -1.639541 -0.271802
C 1.497844 1.534791 -0.503191
C 0.642116 -2.914352 0.151590
C 4.638709 -0.187651 1.081356
C -2.656110 1.264413 0.630177
C -2.171074 2.470346 -0.216378
C -2.875652 -0.020686 -0.198761
C 0.477605 -3.932639 -0.996905
C -0.828336 2.243421 -0.894365
C -3.376898 -1.205292 0.658795
C -3.598504 -2.492979 -0.163446
H 2.287823 1.312243 1.481497
H 2.062406 -1.107515 1.732378
H 0.521442 -0.375309 1.258019
H 3.740998 -0.021532 -0.897104
H 4.151982 1.533137 -0.152159
H 2.412428 -1.929392 -0.642468
H 0.879363 -1.177263 -1.131068
H 1.992934 2.505608 -0.692979
H 1.399682 1.005588 -1.468395
H 1.171983 -3.392755 1.000843
H -0.357570 -2.623953 0.536007
H 5.683334 -0.217698 0.721356
H 4.632780 0.332490 2.057900
H 4.315694 -1.230182 1.253148
H -3.606501 1.548283 1.125060
H -1.919210 1.069040 1.431976
H -2.898186 2.711407 -1.010954
H -2.075247 3.360058 0.436387
H -3.603904 0.179828 -1.011809
H -1.925989 -0.309470 -0.695492
H -0.079649 -3.488931 -1.843826
H 1.461781 -4.261184 -1.381017
H -0.072691 -4.832281 -0.664849
H -4.323551 -0.917202 1.160316
H -2.643983 -1.401009 1.468556
H -4.339723 -2.326458 -0.967789
H -2.657240 -2.826260 -0.640688
H -3.966872 -3.320576 0.470277


