%chk=000121524.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121524

0 1
 O   0.5349000      0.8025000     -0.9179000    
 O    1.216300      -1.134600      -1.958400    
 N   -1.894600      -2.900500      0.4763000    
 C   -1.768000       1.660200     -0.5968000    
 C   -1.915300       1.536700      0.9532000    
 C   -2.383000      5.6299999E-02  0.8306000    
 C   -1.203200     -0.6113000      6.4900003E-02
 C  -0.8413000      0.4640000     -0.9886000    
 C   -3.185700       1.257600      -1.099700    
 C   -3.609400      0.1655000     -0.1029000    
 C   -1.314800       3.007400      -1.128500    
 C  -0.6273000       1.738600       1.776300    
 C   -2.959900       2.480200       1.591200    
 C   -1.499100      -1.973200     -0.5518000    
 C    1.415100     -0.1993000      -1.198700    
 C  -0.8338000      -3.067800       1.480800    
 C   -2.245000      -4.210400     -9.2399999E-02
 C    2.682900     -1.5100000E-02 -0.4481000    
 C    3.410600      -1.129700     -8.4799998E-02
 C    3.094200       1.264900     -0.1378000    
 C    4.601800     -0.9567000      0.6202000    
 C    4.285500       1.437800      0.5670000    
 C    5.039200      0.3268000      0.9460000    
 H   -2.612400     -0.4244000       1.785100    
 H  -0.3517000     -0.7158000      0.7440000    
 H   -1.058600      0.1413000      -2.015100    
 H   -3.172500      0.8785000      -2.127700    
 H   -3.888600       2.097600      -1.079400    
 H   -4.497500      0.4818000      0.4557000    
 H   -3.884800     -0.7663000     -0.6004000    
 H   -1.229000       2.983900      -2.220200    
 H   -2.027000       3.797600     -0.8694000    
 H  -0.3399000       3.295200     -0.7227000    
 H   0.2314000       1.150800       1.455800    
 H  -0.3114000       2.787800       1.746800    
 H  -0.8055000       1.476700       2.826000    
 H   -2.590100       3.512000       1.605500    
 H   -3.925500       2.507900       1.082900    
 H   -3.156300       2.183100       2.628000    
 H  -0.6164000      -2.352600      -1.076000    
 H   -2.274800      -1.889500      -1.320700    
 H   -1.080100      -3.894100       2.159100    
 H   0.1392000      -3.290300       1.027600    
 H  -0.7406000      -2.193900       2.132500    
 H   -2.609700      -4.885200      0.6899000    
 H   -3.057900      -4.106100     -0.8197000    
 H   -1.391600      -4.683500     -0.5915000    
 H    3.077800      -2.134200     -0.3290000    
 H    2.531900       2.146100     -0.4317000    
 H    5.188200      -1.821700      0.9162000    
 H    4.627800       2.437400      0.8186000    
 H    5.966800      0.4616000       1.494500    


%chk=000121524-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121524

0 1
O 0.716270 0.515977 -0.258882
O 1.473241 -1.070741 -1.801686
N -2.398987 -3.050084 0.642541
C -1.568705 1.538921 -0.532616
C -2.085642 1.500866 0.968926
C -2.642767 0.033320 0.829902
C -1.375583 -0.758217 0.365387
C -0.707887 0.239647 -0.639137
C -2.879422 1.166881 -1.317588
C -3.622050 0.157109 -0.372395
C -0.882146 2.811310 -1.033139
C -0.982743 1.673649 2.045545
C -3.175578 2.555562 1.284703
C -1.603531 -2.158889 -0.236817
C 1.712369 -0.200694 -0.925044
C -1.717949 -3.379249 1.910724
C -2.841259 -4.266910 -0.069308
C 3.079412 0.192447 -0.466770
C 4.192861 -0.461948 -1.054963
C 3.286856 1.187629 0.523878
C 5.502405 -0.123898 -0.656878
C 4.599134 1.522769 0.919288
C 5.708143 0.869115 0.330917
H -3.103144 -0.392063 1.736332
H -0.695419 -0.856318 1.231155
H -0.681526 -0.153959 -1.671986
H -2.644614 0.733627 -2.307902
H -3.479121 2.076546 -1.500869
H -4.600888 0.549591 -0.046010
H -3.816051 -0.819101 -0.845572
H -0.599890 2.718218 -2.099180
H -1.558293 3.681936 -0.944046
H 0.039721 3.026488 -0.465205
H -0.089994 1.056444 1.867107
H -0.649546 2.728461 2.082599
H -1.389186 1.422434 3.044324
H -2.749391 3.575826 1.242412
H -4.037545 2.524989 0.598924
H -3.560754 2.403380 2.310951
H -0.604855 -2.601283 -0.488244
H -2.149041 -2.069434 -1.195611
H -2.370425 -4.031415 2.518688
H -0.741433 -3.907796 1.760978
H -1.523989 -2.462741 2.494204
H -3.502077 -4.862388 0.586369
H -3.416654 -3.983331 -0.968938
H -1.995459 -4.925028 -0.395637
H 4.007006 -1.225663 -1.817445
H 2.421919 1.686219 0.970145
H 6.360252 -0.630000 -1.112638
H 4.759117 2.291402 1.683277
H 6.726138 1.131985 0.640028


