%chk=000107066.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000107066

0 1
 O   -1.769500     -0.6515000     -0.2013000    
 O   -3.339600      5.2200001E-02   1.336000    
 C    2.735500      0.9514000      0.1451000    
 C    1.666700     -6.6000000E-02  0.6384000    
 C    1.138600      -1.073400     -0.4143000    
 C   0.1254000      -2.062300      0.1960000    
 C    2.718200       2.247900      0.9685000    
 C    2.525200       1.288700      -1.342000    
 C    4.124700      0.2983000      0.2975000    
 C    2.300900      -1.871500      -1.021400    
 C   -1.088400      -1.376500      0.8152000    
 C   -2.891600      2.5800001E-02  0.1980000    
 C   -3.491600      0.7387000     -0.9912000    
 C   -4.754700       1.498200     -0.6247000    
 H   0.8097000      0.5269000      0.9807000    
 H    2.029900     -0.6014000       1.525400    
 H   0.6321000     -0.5364000      -1.224700    
 H   0.6158000      -2.677500      0.9603000    
 H  -0.2225000      -2.740200     -0.5940000    
 H    3.503100       2.941600      0.6475000    
 H    2.872400       2.037200       2.032700    
 H    1.756800       2.763700      0.8666000    
 H    3.170200       2.132200      -1.622200    
 H    1.495800       1.619600      -1.522800    
 H    2.763900      0.5085000      -2.058400    
 H    4.912200       1.038800      0.1076000    
 H    4.279100     -7.1000002E-02   1.317800    
 H    4.323400     -0.5219000     -0.3904000    
 H    2.931100      -1.340900      -1.727900    
 H    1.899900      -2.715100      -1.598100    
 H    2.928800      -2.310000     -0.2377000    
 H   -1.761200      -2.146900       1.211000    
 H  -0.8094000     -0.7157000       1.642000    
 H   -2.747900       1.439000      -1.385800    
 H   -3.726600     -5.9000002E-03  -1.758900    
 H   -4.550200       2.255900      0.1390000    
 H   -5.165700       2.001800      -1.505000    
 H   -5.519400      0.8217000     -0.2288000    


%chk=000107066-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000107066

0 1
O -1.845563 -0.605495 -0.207308
O -3.457772 0.324286 1.195412
C 2.942194 0.936117 0.201376
C 1.958799 -0.167281 0.731529
C 1.173627 -1.055628 -0.275830
C 0.099432 -1.892352 0.482428
C 3.146465 1.963591 1.352692
C 2.351645 1.677991 -1.026547
C 4.336500 0.350635 -0.157683
C 2.066815 -2.012570 -1.101800
C -1.104730 -1.101404 0.995759
C -3.027091 0.100414 0.040960
C -3.671051 0.530784 -1.269433
C -5.001619 1.275383 -1.062519
H 1.210269 0.356318 1.362400
H 2.524700 -0.832530 1.419881
H 0.630383 -0.396760 -0.981424
H 0.571829 -2.397470 1.351195
H -0.279091 -2.692857 -0.182803
H 3.893630 2.729540 1.071143
H 3.504531 1.462093 2.272289
H 2.199919 2.482813 1.595702
H 3.003956 2.523629 -1.316604
H 1.347537 2.086155 -0.802352
H 2.259206 1.011036 -1.903361
H 5.027530 1.161056 -0.459487
H 4.781719 -0.164669 0.714959
H 4.288140 -0.373414 -0.987907
H 2.740092 -1.468091 -1.785597
H 1.443668 -2.685440 -1.720928
H 2.693342 -2.643253 -0.441369
H -1.793291 -1.730834 1.588643
H -0.824736 -0.228854 1.613310
H -2.940827 1.160034 -1.814199
H -3.807970 -0.372901 -1.893456
H -4.857438 2.178606 -0.445623
H -5.427596 1.578421 -2.035317
H -5.736051 0.636902 -0.542431


