%chk=000127684.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127684

0 1
 O  -0.1740000      -2.132400      0.4618000    
 O   -6.371900       2.140400     -0.2722000    
 O  -0.2769000       2.636100     -0.5475000    
 C   -2.423800      -1.174900      0.2128000    
 C   -1.854500      0.1487000     -0.3488000    
 C   -1.476700      -2.358000     -0.1163000    
 C   -3.877500      -1.364800     -0.2494000    
 C   -2.732700       1.327700      0.1208000    
 C   -4.200100       1.146200     -0.2970000    
 C   -4.754300     -0.1941000      0.1922000    
 C  -0.3892000      0.2678000      1.6799999E-02
 C   0.3442000     -0.8680000      0.3882000    
 C   -1.298300      -2.637400      -1.618000    
 C   -1.971000      -3.653600      0.5521000    
 C   -5.055100       2.302400      0.2196000    
 C   0.2904000       1.494700     -6.4199999E-02
 C    1.698300     -0.7650000      0.7294000    
 C    2.346500      0.4651000      0.6709000    
 C    1.644100       1.594000      0.2663000    
 C    3.790700      0.5679000       1.025900    
 C    4.753900      0.3494000     -0.1558000    
 C    6.226800      0.3976000      0.2620000    
 C    7.149300      0.1510000     -0.9323000    
 C    8.611900      0.1592000     -0.5173000    
 H   -2.438800      -1.080000       1.310900    
 H   -1.901400      0.1226000      -1.446400    
 H   -4.301500      -2.283000      0.1695000    
 H   -3.923500      -1.456800      -1.340800    
 H   -2.659000       1.437400       1.211100    
 H   -2.417200       2.276800     -0.3140000    
 H   -4.254500       1.144000      -1.394700    
 H   -5.769200     -0.3533000     -0.1908000    
 H   -4.826500     -0.1921000       1.287500    
 H  -0.8609000      -1.785500      -2.147600    
 H  -0.6013000      -3.470000      -1.772100    
 H   -2.245200      -2.895700      -2.101300    
 H   -1.219500      -4.447600      0.4638000    
 H   -2.129500      -3.501700       1.626000    
 H   -2.901200      -4.022600      0.1101000    
 H   -4.668000       3.262400     -0.1373000    
 H   -5.085200       2.320100       1.314200    
 H    2.246400      -1.655800       1.028900    
 H    2.160600       2.548700      0.1930000    
 H   -6.898100       2.884900      6.5499999E-02
 H    3.988000       1.550400       1.475000    
 H    4.019600     -0.1584000       1.817200    
 H   0.3661000       3.364900     -0.5282000    
 H    4.565500       1.110600     -0.9237000    
 H    4.541200     -0.6220000     -0.6205000    
 H    6.450300       1.374400      0.7074000    
 H    6.412000     -0.3601000       1.032900    
 H    6.985700      0.9219000      -1.694300    
 H    6.913300     -0.8156000      -1.392500    
 H    8.815000     -0.6243000      0.2198000    
 H    9.253500     -1.7400000E-02  -1.386200    
 H    8.889900       1.123300     -7.9899997E-02


%chk=000127684-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000127684

0 1
O -0.296318 -2.149755 0.653779
O -6.415512 2.253969 -0.226139
O -0.287456 2.476216 -0.934969
C -2.510402 -1.199213 0.177766
C -1.910850 0.135296 -0.354511
C -1.581700 -2.407892 -0.103328
C -3.966866 -1.356798 -0.319240
C -2.753940 1.306280 0.230232
C -4.232893 1.190412 -0.216663
C -4.837858 -0.178328 0.176195
C -0.417549 0.226761 -0.046624
C 0.293366 -0.886292 0.484608
C -1.230340 -2.603992 -1.592736
C -2.090093 -3.712095 0.527622
C -5.058082 2.353789 0.345015
C 0.356317 1.394683 -0.283867
C 1.651898 -0.800320 0.875671
C 2.372877 0.397050 0.694444
C 1.714083 1.495882 0.087010
C 3.842688 0.495572 1.076718
C 4.801782 0.293359 -0.129363
C 6.290843 0.405559 0.265763
C 7.254738 0.214372 -0.927451
C 8.741250 0.328523 -0.525251
H -2.547016 -1.119464 1.287084
H -2.045431 0.167515 -1.458736
H -4.399443 -2.308251 0.043685
H -3.987926 -1.391994 -1.428094
H -2.685626 1.277081 1.338232
H -2.330853 2.268029 -0.102820
H -4.263681 1.277226 -1.323970
H -5.864959 -0.255189 -0.223168
H -4.916516 -0.229053 1.283535
H -0.711512 -1.722816 -2.006857
H -0.567903 -3.479087 -1.710995
H -2.145419 -2.778231 -2.187004
H -1.277705 -4.459287 0.531059
H -2.410651 -3.545476 1.571098
H -2.938801 -4.124664 -0.044500
H -4.586678 3.320152 0.062194
H -5.096252 2.289135 1.455865
H 2.127718 -1.689062 1.302162
H 2.265069 2.429423 -0.095076
H -6.966701 3.006771 0.103571
H 4.049706 1.486864 1.528585
H 4.079594 -0.261733 1.848952
H 0.358479 3.211728 -1.078616
H 4.567432 1.042632 -0.912664
H 4.607524 -0.699711 -0.582022
H 6.475244 1.397841 0.729610
H 6.522158 -0.348756 1.047091
H 7.022193 0.967636 -1.707862
H 7.070338 -0.777059 -1.389265
H 9.004982 -0.431122 0.234833
H 9.408929 0.182806 -1.394372
H 8.960422 1.323578 -0.093717


