%chk=000097838.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097838

0 1
 O  -0.1986000     -0.4395000     -0.5340000    
 O   1.5000000E-03  -2.634600      0.2814000    
 C   -1.478500      -1.082400     -0.5790000    
 C   0.7181000      -1.475500     -0.1604000    
 C   -1.345100      -2.191000      0.4427000    
 C    1.617900     -0.9693000      0.9513000    
 C   -2.598600     -0.1224000     -0.2841000    
 C    2.731600     -9.8800004E-02  0.4253000    
 C   -3.875200     -0.3633000     -0.7918000    
 C   -2.360500       1.008100      0.4975000    
 C    3.936900     -0.6807000      6.2600002E-02
 C    2.531600       1.268700      0.3128000    
 C   -4.913900      0.5267000     -0.5183000    
 C   -3.399300       1.898000      0.7712000    
 C   -4.675900       1.657200      0.2632000    
 C    4.966900      0.1242000     -0.4240000    
 C    3.561800       2.073500     -0.1740000    
 C    4.779300       1.501200     -0.5424000    
 H   -1.582300      -1.493400      -1.591400    
 H    1.292700      -1.766900      -1.047100    
 H   -1.459900      -1.832200       1.472400    
 H   -2.043900      -3.016300      0.2788000    
 H    2.053400      -1.815000       1.499700    
 H    1.035300     -0.4114000       1.696500    
 H   -4.072500      -1.241900      -1.400300    
 H   -1.378000       1.213300      0.9138000    
 H    4.091900      -1.752400      0.1488000    
 H    1.587100       1.724100      0.5964000    
 H   -5.908100      0.3390000     -0.9131000    
 H   -3.215000       2.777000       1.381700    
 H   -5.484900       2.349700      0.4768000    
 H    5.914700     -0.3214000     -0.7115000    
 H    3.415700       3.145800     -0.2665000    
 H    5.581200       2.127800     -0.9215000    


%chk=000097838-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000097838

0 1
O -0.232702 -0.348675 -0.068423
O -0.072138 -2.560701 0.716487
C -1.528276 -0.996396 -0.410883
C 0.707797 -1.461972 0.084856
C -1.507593 -2.253997 0.511921
C 1.872552 -1.070379 0.992727
C -2.670248 -0.038018 -0.161462
C 2.910874 -0.169710 0.332132
C -3.743392 0.045373 -1.080976
C -2.698940 0.757544 1.012041
C 4.277686 -0.547256 0.317519
C 2.540191 1.065932 -0.262926
C -4.839826 0.901052 -0.827736
C -3.788118 1.619387 1.260570
C -4.864956 1.690222 0.344408
C 5.255832 0.286923 -0.271444
C 3.515686 1.899493 -0.853148
C 4.877328 1.515248 -0.859192
H -1.507671 -1.308303 -1.476408
H 1.046463 -1.808850 -0.916094
H -1.970023 -2.037336 1.491571
H -2.001391 -3.123885 0.044746
H 2.345868 -2.010676 1.328475
H 1.433953 -0.588051 1.887225
H -3.721949 -0.555357 -1.999050
H -1.853478 0.714719 1.707144
H 4.578771 -1.499489 0.772123
H 1.485643 1.362001 -0.265659
H -5.665682 0.957159 -1.545513
H -3.798431 2.238073 2.164937
H -5.710982 2.358608 0.539570
H 6.307746 -0.021113 -0.271256
H 3.214014 2.849943 -1.308442
H 5.632793 2.164388 -1.316341


