%chk=000033731.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000033731

0 1
 O   -1.680700       1.738700      0.1072000    
 O    3.641600       1.939700      -2.398000    
 O    1.826700      0.8062000      -1.636900    
 C   -2.360700      0.5461000      0.4611000    
 C   -2.863900     -0.2070000     -0.7812000    
 C   -3.616400      0.8733000       1.257500    
 C   -4.291300     -0.6637000     -0.4379000    
 C   -4.480800     -0.3547000       1.043200    
 C   -1.994600      -1.353700      -1.089100    
 C   -1.290800       2.481800       1.255800    
 C  -0.5107000       3.721700      0.8354000    
 C   0.7593000       3.430500      2.7100001E-02
 C   -1.284700      -2.289300      -1.339600    
 C  -0.4174000      -3.434200      -1.648900    
 C    1.772100       2.498600      0.6981000    
 C   0.4434000      -3.814100     -0.4441000    
 C    1.314900      -2.641800      9.8999999E-03
 C    2.200200      -3.032600       1.194400    
 C    3.039700       2.283500     -0.1283000    
 C    3.094900      -1.871200       1.626700    
 C    3.952400      -2.244700       2.825200    
 C    2.747000       1.586900      -1.437800    
 H   -1.690100     -8.6700000E-02   1.059500    
 H   -2.889800      0.4545000      -1.656100    
 H   -3.415200       1.030000       2.322000    
 H   -4.115300       1.771000      0.8714000    
 H   -5.006000     -6.7699999E-02  -1.019800    
 H   -4.491900      -1.717600     -0.6584000    
 H   -4.114700      -1.189700       1.652300    
 H   -5.529300     -0.1779000       1.299000    
 H   -2.170400       2.832600       1.805400    
 H  -0.6934000       1.857500       1.929400    
 H   -1.158300       4.361200      0.2229000    
 H  -0.2435000       4.295300       1.730700    
 H   0.4611000       3.016100     -0.9431000    
 H    1.249000       4.388200     -0.1905000    
 H   0.2249000      -3.192400      -2.503600    
 H   -1.029500      -4.294700      -1.941100    
 H    2.054300       2.918900       1.670800    
 H    1.309200       1.524600      0.8946000    
 H  -0.1989000      -4.135700      0.3856000    
 H    1.076400      -4.668200     -0.7124000    
 H    1.946000      -2.309900     -0.8238000    
 H   0.6974000      -1.787100      0.3083000    
 H    1.569200      -3.344700       2.035600    
 H    2.823600      -3.892700      0.9213000    
 H    3.507600       3.253000     -0.3327000    
 H    3.753000       1.666000      0.4276000    
 H    2.478800      -1.001500       1.883800    
 H    3.745200      -1.572500      0.7962000    
 H    4.604300      -3.092600       2.592100    
 H    3.329900      -2.515100       3.684100    
 H    4.584600      -1.400100       3.116500    
 H    3.455900       1.493700      -3.251700    


%chk=000033731-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000033731

0 1
O -1.827260 2.234885 0.144258
O 1.078899 0.694227 -1.647987
O 1.287261 0.641902 0.664864
C -2.108832 0.827936 0.471527
C -2.489450 0.120088 -0.884302
C -3.332758 0.638464 1.414692
C -3.958900 -0.390197 -0.685693
C -4.083495 -0.589781 0.844349
C -1.564710 -0.977513 -1.235736
C -1.209871 2.989361 1.249853
C -0.682117 4.309289 0.666081
C 0.426331 4.100071 -0.396489
C -0.829316 -1.922821 -1.553996
C 0.002080 -3.095723 -1.898886
C 1.781789 3.607362 0.193347
C 0.664837 -3.774361 -0.664381
C 1.706224 -2.879623 0.041307
C 2.332724 -3.546494 1.285968
C 2.408759 2.428543 -0.604794
C 3.393046 -2.655084 1.973607
C 3.990995 -3.299594 3.242558
C 1.561241 1.178390 -0.440641
H -1.194773 0.376241 0.906898
H -2.441878 0.893346 -1.674110
H -3.041171 0.516952 2.472599
H -3.974248 1.537948 1.333199
H -4.661704 0.397215 -1.017837
H -4.167857 -1.303555 -1.267034
H -3.577968 -1.527275 1.146246
H -5.131940 -0.648003 1.186608
H -1.963543 3.190220 2.041485
H -0.389477 2.384452 1.692615
H -1.534195 4.850386 0.210882
H -0.304806 4.937832 1.498376
H 0.044846 3.370330 -1.134713
H 0.584046 5.047063 -0.947350
H 0.792874 -2.794714 -2.615617
H -0.634401 -3.832348 -2.429077
H 2.511831 4.437998 0.221448
H 1.647783 3.271171 1.239495
H -0.126117 -4.065906 0.054447
H 1.149152 -4.711353 -1.006954
H 2.511347 -2.619428 -0.678746
H 1.236502 -1.923351 0.344102
H 1.530313 -3.785855 2.015335
H 2.795218 -4.515820 1.001715
H 2.500581 2.675126 -1.675156
H 3.417353 2.208431 -0.205691
H 2.933364 -1.678794 2.226973
H 4.205374 -2.435973 1.250371
H 4.478492 -4.265017 3.007121
H 3.203526 -3.497418 3.994519
H 4.748082 -2.644334 3.711767
H 0.430217 -0.069092 -1.507718


