%chk=000101788.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101788

0 1
 O  -0.2319000       2.046900      -1.308300    
 O   -5.542900      0.1379000     -0.4966000    
 O    6.045600      5.0999999E-02   1.212300    
 C   -1.413300      -1.060300      0.2905000    
 C   -2.309300      0.1607000      3.5000001E-03
 C  -3.5799999E-02 -0.9768000     -0.3808000    
 C   0.7029000      0.2956000      0.1502000    
 C    2.183300      0.4212000     -0.3975000    
 C   -1.605400       1.404100      0.5761000    
 C   -3.573200     -0.2719000      0.7843000    
 C  -0.1702000       1.585100      3.4100000E-02
 C   -2.324200      -2.244900     -1.5100000E-02
 C   0.7854000      -2.238600     -7.4199997E-02
 C   -3.703200      -1.781700      0.4904000    
 C    2.913700     -0.9118000     -0.1851000    
 C   -2.641500      0.3530000      -1.499200    
 C    2.191000      -2.152600     -0.6496000    
 C    2.897200       1.552000      0.3992000    
 C    2.259100      0.7461000      -1.906600    
 C   -4.810800      0.4916000      0.4265000    
 C    4.411600       1.525000      0.2681000    
 C    4.143500      -1.021000      0.3447000    
 C    4.945000      0.1784000      0.6800000    
 C   -5.116500       1.711100       1.253400    
 H   -1.225500      -1.100400       1.377300    
 H  -0.1528000     -0.9174000      -1.467200    
 H   0.8033000      0.1306000       1.236500    
 H   -1.552400       1.326000       1.669700    
 H   -2.191200       2.301500      0.3468000    
 H   -3.410900     -0.1618000       1.865500    
 H   0.2931000       2.390700      0.6133000    
 H   -2.002400      -3.158900      0.4940000    
 H   -2.359400      -2.455400      -1.089800    
 H   0.2887000      -3.121300     -0.4939000    
 H   0.8443000      -2.394900       1.011000    
 H   -4.473300      -2.031500     -0.2467000    
 H   -3.966800      -2.314400       1.412100    
 H   -1.781900      0.2589000      -2.160500    
 H   -3.354900     -0.3952000      -1.862000    
 H   -3.093400       1.335500      -1.676700    
 H    2.140100      -2.148400      -1.745300    
 H    2.740200      -3.060900     -0.3727000    
 H    2.649100       1.461200       1.466100    
 H    2.535100       2.536800      8.0600001E-02
 H    3.271200      0.5832000      -2.298400    
 H    1.591000      0.1176000      -2.503300    
 H    2.023300       1.793900      -2.115700    
 H    4.843100       2.286700      0.9270000    
 H    4.736700       1.735900     -0.7556000    
 H  -0.1883000       1.291200      -1.911500    
 H    4.622900      -1.983400      0.4886000    
 H   -5.162400       1.439700       2.311100    
 H   -4.357100       2.477400       1.092200    
 H   -6.089200       2.115500      0.9587000    


%chk=000101788-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000101788

0 1
O -0.125261 2.265725 -1.209344
O -5.614987 0.255879 -0.526651
O 6.150593 0.204041 1.247570
C -1.422355 -1.110946 0.249008
C -2.304233 0.155260 0.003111
C -0.023604 -1.031622 -0.399958
C 0.719245 0.237657 0.129398
C 2.195622 0.391752 -0.428389
C -1.572080 1.368620 0.624026
C -3.619008 -0.298048 0.768890
C -0.122992 1.556824 0.091349
C -2.360007 -2.290672 -0.099670
C 0.800938 -2.294862 -0.049141
C -3.765917 -1.811988 0.397008
C 2.949396 -0.916748 -0.126530
C -2.632895 0.369038 -1.503443
C 2.264585 -2.205300 -0.542039
C 2.875674 1.587946 0.306294
C 2.256552 0.615988 -1.976370
C -4.855810 0.543367 0.440147
C 4.414793 1.588616 0.205881
C 4.203073 -0.939704 0.430358
C 5.008547 0.269583 0.696165
C -5.133560 1.747832 1.330192
H -1.249391 -1.147931 1.350627
H -0.128816 -0.984137 -1.504263
H 0.849144 0.049643 1.222646
H -1.518077 1.226383 1.723847
H -2.109661 2.318593 0.440075
H -3.406429 -0.188007 1.851918
H 0.375756 2.293419 0.743974
H -2.049928 -3.233158 0.384234
H -2.367104 -2.471780 -1.191515
H 0.321669 -3.192671 -0.482882
H 0.795258 -2.424939 1.053134
H -4.537000 -1.926326 -0.384208
H -4.102652 -2.388607 1.276731
H -1.750372 0.206713 -2.152029
H -3.412389 -0.328209 -1.853787
H -3.017871 1.389181 -1.684110
H 2.263258 -2.258645 -1.651621
H 2.845614 -3.075995 -0.187069
H 2.600359 1.545344 1.380762
H 2.475571 2.535608 -0.097150
H 3.304073 0.576221 -2.326230
H 1.699207 -0.160316 -2.530681
H 1.827872 1.597739 -2.229700
H 4.859010 2.416164 0.786527
H 4.734492 1.732718 -0.846487
H -0.653167 1.748099 -1.866520
H 4.694216 -1.895945 0.654787
H -5.472026 1.398842 2.325925
H -4.216802 2.342120 1.497315
H -5.919821 2.380140 0.889387


