%chk=000094446.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094446

0 1
 O    1.020300      -2.033400      -1.293500    
 O   -1.988400      -1.244400      -1.873300    
 C  -6.5000001E-03  0.6028000      -1.011600    
 C   2.4100000E-02   2.097200      -1.477300    
 C    1.273700      0.1343000     -0.3218000    
 C   -1.222300      0.2362000     -0.1623000    
 C    1.166800       2.355600      -2.472700    
 C   -1.295700       2.506400      -2.151000    
 C    1.710100      -1.159300     -0.5055000    
 C   -2.142000     -0.6679000     -0.6467000    
 C    1.950300       1.038700      0.4682000    
 C   -1.351600      0.8337000       1.073200    
 C    2.880900      -1.569800      0.1322000    
 C   -3.245900     -0.9907000      0.1424000    
 C    3.121100      0.6284000       1.105800    
 C   -2.455500      0.5109000       1.862300    
 C    3.586300     -0.6760000      0.9379000    
 C   -3.402700     -0.4012000       1.396800    
 C    3.395100      -2.961600     -3.5799999E-02
 C   -4.270400      -1.965100     -0.3382000    
 C    3.875500       1.584100       1.967100    
 C   -2.623200       1.140900       3.203700    
 H  -5.7700001E-02  4.7200002E-02  -1.958000    
 H   0.1462000       2.776700     -0.6266000    
 H    2.151000       2.180900      -2.030300    
 H    1.151200       3.396400      -2.815100    
 H    1.074200       1.713300      -3.355400    
 H   -2.135100       2.471200      -1.449900    
 H   -1.528400       1.852000      -2.998000    
 H   -1.237300       3.534000      -2.527000    
 H    1.606900       2.052500      0.6360000    
 H  -0.6326000       1.558600       1.439600    
 H    4.498300     -0.9928000       1.438300    
 H   -4.262900     -0.6485000       2.014600    
 H    4.321400      -3.121100      0.5272000    
 H    2.665700      -3.690100      0.3340000    
 H    3.620200      -3.166000      -1.087800    
 H   -4.742600      -1.606500      -1.258800    
 H   -3.817400      -2.946700     -0.5136000    
 H   -5.069500      -2.107600      0.3978000    
 H    4.933700       1.309900       2.036000    
 H    3.834000       2.598500       1.556000    
 H    3.452100       1.594600       2.976400    
 H   -1.652100       1.349200       3.665700    
 H   -3.176700       2.080500       3.110600    
 H   -3.167000      0.4798000       3.887000    
 H    1.450000      -2.902000      -1.318300    
 H   -2.715200      -1.854800      -2.070600    


%chk=000094446-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000094446

0 1
O 1.040927 -2.053790 -1.111011
O -2.213053 -0.877785 -2.118457
C 0.024474 0.555404 -1.084379
C -0.042350 2.038183 -1.594839
C 1.327935 0.214405 -0.348543
C -1.186231 0.191396 -0.207829
C 1.084893 2.313518 -2.620195
C -1.416449 2.368007 -2.225424
C 1.803382 -1.124578 -0.367991
C -2.281739 -0.530546 -0.748429
C 2.076519 1.155165 0.395728
C -1.257615 0.569386 1.151920
C 2.981023 -1.520987 0.319132
C -3.414000 -0.877399 0.036971
C 3.255588 0.806447 1.101874
C -2.369531 0.254037 1.971499
C 3.691171 -0.537671 1.048666
C -3.435347 -0.475638 1.393718
C 3.455507 -2.963689 0.267509
C -4.569569 -1.650316 -0.576875
C 4.022504 1.851094 1.896830
C -2.409785 0.683001 3.429330
H -0.032120 -0.091284 -1.979599
H 0.091943 2.717279 -0.726226
H 2.084633 2.094931 -2.206305
H 1.069366 3.370818 -2.945029
H 0.944278 1.682325 -3.518901
H -2.234003 2.289058 -1.487537
H -1.643275 1.673284 -3.054826
H -1.414787 3.399400 -2.625777
H 1.741456 2.199048 0.422332
H -0.407487 1.106329 1.590096
H 4.603020 -0.832428 1.583719
H -4.305602 -0.738816 2.008699
H 4.381224 -3.088434 0.853164
H 2.709808 -3.666591 0.692988
H 3.682575 -3.295920 -0.766512
H -5.043793 -1.098302 -1.413594
H -4.257689 -2.643793 -0.962365
H -5.355003 -1.836736 0.174212
H 4.974869 1.446242 2.281543
H 4.259311 2.737751 1.279241
H 3.438036 2.208777 2.766545
H -1.515832 0.332524 3.978785
H -2.438065 1.785338 3.527037
H -3.299698 0.280580 3.944285
H 1.448725 -2.953487 -1.064060
H -2.939741 -1.506537 -2.351421


