%chk=000018401.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018401

0 1
 O    1.509500      0.1615000     -0.3718000    
 O    2.912000       1.044700       1.226000    
 N    3.043400       1.703800     -0.9730000    
 C  -0.2330000      -1.513100     -3.8000001E-03
 C   -1.344100     -0.6518000     -0.6679000    
 C   -2.039600      0.3577000      0.2539000    
 C   0.8856000     -0.6481000      0.6162000    
 C   0.3752000      -2.415500      -1.099300    
 C  -0.8229000      -2.418400       1.092200    
 C   -3.069400       1.187200     -0.5170000    
 C   -3.737500       2.218300      0.3787000    
 C    2.520800      0.9737000      6.5800004E-02
 H   -2.106400      -1.317600      -1.094600    
 H  -0.9123000     -0.1046000      -1.516800    
 H   -2.539800     -0.1635000       1.077300    
 H   -1.304200       1.039000      0.6940000    
 H   0.4912000     -1.3900000E-02   1.418500    
 H    1.647600      -1.302600       1.060200    
 H   0.7886000      -1.826700      -1.925700    
 H    1.183200      -3.036900     -0.6965000    
 H  -0.3811000      -3.088000      -1.520100    
 H   -1.650400      -3.022300      0.7037000    
 H   -1.200700      -1.834800       1.938000    
 H  -6.6000000E-02  -3.106900       1.485100    
 H   -2.583100       1.702300      -1.353600    
 H   -3.835000      0.5278000     -0.9421000    
 H   -4.470400       2.797500     -0.1915000    
 H   -4.259400       1.735300       1.211100    
 H   -3.001400       2.915000      0.7922000    
 H    2.685000       1.609900      -1.917300    
 H    3.803600       2.359700     -0.8281000    


%chk=000018401-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000018401

0 1
O 1.506385 0.161078 -0.401414
O 2.963791 1.038896 1.232908
N 3.018504 1.747689 -1.005950
C -0.219271 -1.548852 -0.011967
C -1.301926 -0.635095 -0.669044
C -2.011942 0.386320 0.249207
C 0.903111 -0.713272 0.639674
C 0.383989 -2.468338 -1.106931
C -0.836945 -2.426361 1.110635
C -3.071817 1.213727 -0.514912
C -3.798212 2.241120 0.379649
C 2.544208 0.995307 0.049417
H -2.068204 -1.298090 -1.123821
H -0.824597 -0.085404 -1.504293
H -2.506411 -0.131857 1.095597
H -1.270325 1.081532 0.692157
H 0.523184 -0.074129 1.457219
H 1.695696 -1.365069 1.053821
H 0.860019 -1.869833 -1.903423
H 1.149144 -3.145656 -0.682237
H -0.405559 -3.092292 -1.565969
H -1.671973 -3.028097 0.706790
H -1.231516 -1.817014 1.944126
H -0.087170 -3.125382 1.527346
H -2.581169 1.738534 -1.360167
H -3.814145 0.524162 -0.967207
H -4.548326 2.818139 -0.192189
H -4.323293 1.739790 1.214748
H -3.082034 2.960836 0.819355
H 2.619681 1.644454 -1.935476
H 3.776125 2.401856 -0.833849


