%chk=000013913.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013913

0 1
 O  -7.8000002E-02   1.632400      9.3999997E-02
 N    3.711300     -0.7920000      5.6899998E-02
 N    1.294100       1.807700     -3.9400000E-02
 C    3.208000      0.4157000     -0.5965000    
 C    1.736400      0.6066000     -0.3678000    
 C  -0.3909000      0.3361000     -0.1606000    
 C   0.7479000     -0.3624000     -0.4628000    
 C   -1.782100      1.6000000E-03 -6.1200000E-02
 C    3.492000     -0.7210000       1.501100    
 C    5.132200     -0.9772000     -0.2358000    
 C   -2.213300      -1.307100     -0.3040000    
 C   -2.720500      0.9820000      0.2787000    
 C   -3.566700      -1.631400     -0.2082000    
 C   -4.073700      0.6578000      0.3746000    
 C   -4.496800     -0.6489000      0.1311000    
 H    3.360900      0.3384000      -1.681000    
 H    3.761500       1.302900     -0.2588000    
 H   0.8381000      -1.409100     -0.7140000    
 H    2.431200     -0.7292000       1.769600    
 H    3.957000      0.1663000       1.947200    
 H    3.921300      -1.603200       1.991200    
 H    5.499400      -1.907600      0.2118000    
 H    5.744600     -0.1491000      0.1392000    
 H    5.294800      -1.065000      -1.315900    
 H   -1.512900      -2.094600     -0.5705000    
 H   -2.430800       2.011300      0.4757000    
 H   -3.896500      -2.648700     -0.3978000    
 H   -4.798500       1.422400      0.6388000    
 H   -5.550500     -0.9013000      0.2057000    


%chk=000013913-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000013913

0 1
O -0.132767 1.750286 0.150680
N 3.754869 -0.741894 0.146820
N 1.323066 1.921866 0.048676
C 3.259865 0.484408 -0.524217
C 1.783320 0.691694 -0.288728
C -0.448029 0.405233 -0.126195
C 0.730243 -0.277589 -0.404052
C -1.860649 0.024600 -0.066301
C 3.716172 -0.637536 1.621380
C 5.088032 -1.142067 -0.348292
C -2.253585 -1.317104 -0.329582
C -2.856655 0.987668 0.257350
C -3.612211 -1.685964 -0.269174
C -4.214161 0.612612 0.315900
C -4.598754 -0.723621 0.053843
H 3.432112 0.363182 -1.611427
H 3.804186 1.408370 -0.207483
H 0.866295 -1.327970 -0.644368
H 2.691160 -0.402220 1.955090
H 4.400074 0.152067 2.022267
H 4.007159 -1.605872 2.065320
H 5.378750 -2.100509 0.117002
H 5.890596 -0.394766 -0.123368
H 5.052972 -1.289950 -1.442561
H -1.496839 -2.068692 -0.580095
H -2.555341 2.020006 0.459976
H -3.902966 -2.722145 -0.473395
H -4.973007 1.361898 0.566017
H -5.654406 -1.012591 0.100215


