%chk=000061092.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000061092

0 1
 O    2.950800     -0.9434000     -0.8903000    
 O    3.926000      -1.916100      0.9706000    
 C   0.6260000       1.992600     -0.2259000    
 C  -0.5329000       1.463700      0.6421000    
 C    1.425100      0.8993000     -0.9595000    
 C   -1.501700      0.5527000     -0.1190000    
 C    1.546600       2.874600      0.6246000    
 C   -2.619300      4.6200000E-02  0.7995000    
 C    2.259400     -1.1800000E-02 -6.6299997E-02
 C   -3.615900     -0.8265000      7.4100003E-02
 C   -4.352800     -0.2101000      -1.080000    
 C   -3.856800      -2.088000      0.4641000    
 C    3.745400      -1.833200     -0.2341000    
 H   0.1853000       2.633800      -1.001600    
 H  -0.1273000      0.9166000       1.502400    
 H   -1.089500       2.316600       1.051500    
 H   0.7748000      0.2967000      -1.603400    
 H    2.110000       1.390700      -1.665200    
 H  -0.9755000     -0.3178000     -0.5246000    
 H   -1.916000       1.111900     -0.9655000    
 H    1.936800       2.339900       1.496400    
 H    2.393600       3.240700      3.5000000E-02
 H   0.9997000       3.748600      0.9952000    
 H   -2.173500     -0.4962000       1.643000    
 H   -3.156200      0.9005000       1.231100    
 H    1.612100     -0.5564000      0.6299000    
 H    2.995600      0.5672000      0.5007000    
 H   -3.680100     -3.8199998E-02  -1.925500    
 H   -5.167200     -0.8517000      -1.433800    
 H   -4.796000      0.7459000     -0.7828000    
 H   -3.333500      -2.529300       1.305800    
 H   -4.581700      -2.709700     -5.0900001E-02
 H    4.219500      -2.492300     -0.9776000    


%chk=000061092-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000061092

0 1
O 2.985102 -0.954888 -0.937496
O 3.821486 -2.098314 0.929029
C 0.662740 2.039626 -0.214514
C -0.479039 1.442652 0.655571
C 1.501507 0.964094 -0.965678
C -1.479615 0.547504 -0.111219
C 1.552878 2.984580 0.630945
C -2.666845 0.098269 0.784440
C 2.211185 -0.029220 -0.043762
C -3.651059 -0.837003 0.090740
C -4.397543 -0.273889 -1.107551
C -3.855120 -2.108700 0.528182
C 3.736710 -1.929134 -0.304121
H 0.181926 2.654100 -1.005899
H -0.046843 0.870727 1.503313
H -1.036117 2.285564 1.115522
H 0.851890 0.398542 -1.659169
H 2.263862 1.473097 -1.586568
H -0.970678 -0.355982 -0.500923
H -1.859759 1.102825 -0.992387
H 2.013742 2.455451 1.486326
H 2.367646 3.420054 0.022740
H 0.955648 3.818413 1.044082
H -2.262962 -0.396773 1.689051
H -3.203722 1.008187 1.129920
H 1.510292 -0.640339 0.552492
H 2.925141 0.454832 0.645137
H -3.705160 -0.028433 -1.936105
H -5.145534 -0.987829 -1.492561
H -4.920467 0.665838 -0.840570
H -3.316177 -2.511368 1.394346
H -4.564899 -2.782412 0.033307
H 4.250584 -2.532571 -1.076619


