%chk=000039524.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039524

0 1
 O   -3.464100     -0.8323000       1.701600    
 O    3.234200       1.872000      0.2851000    
 O    4.790100      6.3900001E-02 -5.7399999E-02
 C   -3.952800      0.4673000     -0.3268000    
 C   -3.060600     -0.6240000      0.3459000    
 C   -5.436700      5.0299998E-02 -0.2360000    
 C   -3.791900       1.817300      0.3997000    
 C   -3.606400      0.6569000      -1.816800    
 C   -1.588100     -0.3017000      0.3833000    
 C  -0.6464000      -1.094300     -0.1531000    
 C   0.8004000     -0.8234000     -0.1336000    
 C    1.242500      0.4750000      8.2800001E-02
 C    2.606900      0.6797000      9.2200004E-02
 C    1.691500      -1.881400     -0.3337000    
 C    3.495500     -0.3527000     -0.1035000    
 C    3.068600      -1.646800     -0.3193000    
 C    4.617200       1.474100      0.1896000    
 H   -3.212300      -1.577000     -0.1782000    
 H   -5.786200      9.3999999E-03  0.8012000    
 H   -5.596100     -0.9358000     -0.6863000    
 H   -6.080700      0.7633000     -0.7639000    
 H   -4.491800       2.559900     -1.8000000E-03
 H   -3.994500       1.727400       1.472400    
 H   -2.786600       2.232900      0.2764000    
 H   -2.577700       1.009400      -1.948100    
 H   -4.267300       1.392900      -2.288400    
 H   -3.709800     -0.2858000      -2.365500    
 H   -1.314300      0.5966000      0.9277000    
 H  -0.9482000      -2.012800     -0.6514000    
 H   -4.280000      -1.360500       1.689800    
 H   0.5828000       1.323500      0.2205000    
 H    1.332600      -2.894100     -0.5008000    
 H    3.771900      -2.457300     -0.4730000    
 H    5.121700       1.730600       1.128200    
 H    5.087700       2.033700     -0.6271000    


%chk=000039524-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000039524

0 1
O -3.520151 -0.444065 1.986471
O 3.497811 1.719216 0.887965
O 4.877140 0.196047 -0.348859
C -4.009671 0.370161 -0.357542
C -3.118746 -0.551840 0.563655
C -5.504554 0.023905 -0.111612
C -3.766984 1.865739 -0.035162
C -3.662585 0.076251 -1.839238
C -1.649923 -0.209293 0.553944
C -0.698072 -0.926860 -0.105672
C 0.748349 -0.642192 -0.172705
C 1.335024 0.494247 0.476455
C 2.710774 0.660362 0.362228
C 1.584174 -1.532654 -0.904961
C 3.526872 -0.235584 -0.367036
C 2.987157 -1.345295 -1.018727
C 4.904571 1.329167 0.615393
H -3.263434 -1.598087 0.207886
H -5.851181 0.371199 0.880443
H -5.687627 -1.066320 -0.192295
H -6.140341 0.522452 -0.865897
H -4.499955 2.500661 -0.567074
H -3.868583 2.049347 1.050205
H -2.756062 2.184668 -0.347550
H -2.595047 0.269132 -2.045934
H -4.263707 0.719396 -2.508481
H -3.878196 -0.978071 -2.102610
H -1.388735 0.677192 1.147040
H -1.020005 -1.824923 -0.655161
H -4.456392 -0.756380 2.075185
H 0.731504 1.206420 1.044263
H 1.127098 -2.399146 -1.396331
H 3.615403 -2.034969 -1.587623
H 5.374632 0.987334 1.556999
H 5.430543 2.178986 0.154040


