%chk=000056794.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056794

0 1
 O  -0.6004000       2.427800      0.3552000    
 O   -5.836900      -1.100500     -0.1061000    
 N    2.921000      0.1523000     -0.3119000    
 C   0.5120000      0.2898000      0.1900000    
 C    1.753600       1.033400     -0.2976000    
 C    3.207900     -0.3429000       1.041800    
 C    4.083700      0.8489000     -0.8801000    
 C   0.2450000     -0.9302000     -0.6905000    
 C    4.396800      -1.305400       1.037000    
 C    5.301100     -7.4400000E-02 -0.9477000    
 C    5.631800     -0.6576000      0.4215000    
 C  -0.9781000      -1.690700     -0.1927000    
 C  -0.7018000       1.213100      0.2069000    
 C   -2.179300     -0.7913000     -9.0000004E-02
 C   -2.049500      0.5920000      0.1056000    
 C   -3.463800      -1.351100     -0.1488000    
 C   -3.188000       1.400800      0.2116000    
 C   -4.596600     -0.5441000     -4.0500000E-02
 C   -4.458400      0.8302000      0.1363000    
 H   0.6174000     -1.3800000E-02   1.238100    
 H    1.940000       1.913100      0.3334000    
 H    1.563600       1.413600      -1.310500    
 H    2.377900     -0.9218000       1.455200    
 H    3.408000      0.4883000       1.730600    
 H    4.331500       1.741300     -0.2904000    
 H    3.854600       1.184700      -1.898800    
 H    1.093700      -1.622800     -0.6961000    
 H   7.9800002E-02 -0.6144000      -1.729700    
 H    4.137000      -2.208500      0.4698000    
 H    4.620100      -1.624500       2.061500    
 H    6.165100      0.4797000      -1.331800    
 H    5.104400     -0.8904000      -1.654600    
 H    5.994000      0.1402000       1.081400    
 H    6.438200      -1.393600      0.3324000    
 H  -0.7776000      -2.125600      0.7939000    
 H   -1.184000      -2.515500     -0.8854000    
 H   -3.575200      -2.425000     -0.2829000    
 H   -3.107100       2.474500      0.3580000    
 H   -5.337300       1.463500      0.2214000    
 H   -5.746100      -2.060800     -0.2303000    


%chk=000056794-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000056794

0 1
O -0.600865 2.356195 0.661658
O -6.017233 -0.984687 -0.246091
N 2.971557 0.144556 -0.129680
C 0.473900 0.204152 0.179665
C 1.755514 0.998657 -0.166482
C 3.446166 -0.105195 1.256129
C 4.066231 0.688557 -0.975690
C 0.179265 -0.921465 -0.839660
C 4.618131 -1.107820 1.273517
C 5.260000 -0.286123 -1.034339
C 5.779575 -0.605579 0.386121
C -1.057274 -1.735649 -0.412774
C -0.740977 1.131510 0.353755
C -2.268139 -0.840977 -0.190800
C -2.095776 0.529100 0.173891
C -3.576358 -1.353471 -0.336166
C -3.242072 1.346864 0.389232
C -4.700954 -0.524017 -0.114301
C -4.538645 0.836080 0.252154
H 0.617167 -0.281621 1.172860
H 1.832782 1.878534 0.512780
H 1.648399 1.399486 -1.193065
H 2.607050 -0.501698 1.857450
H 3.772251 0.853357 1.742248
H 4.424084 1.680064 -0.588469
H 3.665440 0.859252 -1.992476
H 1.074548 -1.563395 -0.917010
H 0.005267 -0.473943 -1.839310
H 4.257836 -2.083913 0.894139
H 4.958948 -1.257063 2.316324
H 6.064135 0.154965 -1.654618
H 4.930584 -1.221886 -1.526627
H 6.212704 0.313071 0.833777
H 6.590468 -1.357275 0.343395
H -0.825014 -2.272694 0.532023
H -1.294038 -2.513838 -1.162535
H -3.715912 -2.403796 -0.628167
H -3.075546 2.392029 0.669599
H -5.426964 1.452182 0.416275
H -6.038136 -1.940204 -0.503533


