%chk=000079594.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079594

0 1
 O   -2.966900     -0.6829000     -0.5677000    
 O   -1.373900      2.2000000E-02  -2.006900    
 C  -0.9072000      0.1707000      0.4020000    
 C   -1.266600       1.645100      0.8104000    
 C   -1.318300     -0.7757000       1.576500    
 C   0.6092000      1.8500000E-02  0.1432000    
 C   -1.748000     -0.1495000     -0.8528000    
 C  -0.9050000       2.727800     -0.2062000    
 C   -1.112100      -2.272000       1.343300    
 C    1.013800     -0.9007000     -0.7864000    
 C    1.466200      0.8114000      0.8571000    
 C    2.382000      -1.038000      -1.020200    
 C    2.834500      0.6740000      0.6232000    
 C    3.292300     -0.2507000     -0.3154000    
 H   -2.355600       1.701000      0.9536000    
 H  -0.8491000       1.906800       1.789500    
 H  -0.7569000     -0.4992000       2.479500    
 H   -2.374900     -0.6158000       1.828900    
 H   0.1659000       2.780200     -0.4135000    
 H   -1.430100       2.577600      -1.154000    
 H   -1.210200       3.706500      0.1797000    
 H  -4.9600001E-02  -2.526900       1.293900    
 H   -1.596900      -2.624400      0.4294000    
 H   -1.537400      -2.835000       2.181100    
 H   0.3406000      -1.562800      -1.318600    
 H    1.161700       1.516600       1.619100    
 H    2.739600      -1.766000      -1.742700    
 H    3.544600       1.280700       1.177900    
 H    4.357900     -0.3607000     -0.4942000    
 H   -3.473500     -0.8901000      -1.381600    


%chk=000079594-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000079594

0 1
O -3.128085 -0.475254 -0.432937
O -1.511915 -0.161158 -2.044168
C -0.925846 0.159296 0.381395
C -1.342793 1.640274 0.748162
C -1.285450 -0.753769 1.611072
C 0.586336 0.033306 0.088345
C -1.805286 -0.190214 -0.828398
C -1.014323 2.701705 -0.320838
C -1.078483 -2.264991 1.387384
C 1.114601 -0.813078 -0.921214
C 1.508735 0.699749 0.939948
C 2.509839 -0.975773 -1.079131
C 2.902503 0.539994 0.785020
C 3.413516 -0.300645 -0.229737
H -2.428723 1.635081 0.959416
H -0.845678 1.901088 1.701664
H -0.652406 -0.414597 2.454216
H -2.337261 -0.562235 1.890047
H 0.069918 2.744974 -0.523786
H -1.522686 2.489674 -1.278471
H -1.339448 3.701379 0.020636
H -0.036571 -2.493887 1.102281
H -1.748255 -2.646937 0.595268
H -1.307896 -2.823232 2.313191
H 0.441213 -1.333471 -1.606125
H 1.144243 1.354762 1.739544
H 2.887852 -1.631684 -1.871660
H 3.587019 1.071403 1.456126
H 4.494819 -0.426066 -0.355126
H -3.673390 -0.617195 -1.254025


