%chk=000017514.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017514

0 1
 O   -2.582000      -1.988200      3.1000001E-03
 O   -1.605200       2.491100      3.5999999E-03
 N    1.842300     -0.5955000     -9.1000004E-03
 N  -0.3909000      -1.271700     -2.3000001E-03
 N   -2.117700      0.2717000      3.1999999E-03
 N   0.1390000       1.014600     -3.1000001E-03
 C    2.901200      0.3665000     -1.2000000E-02
 C   0.5222000     -0.2308000     -4.8000002E-03
 C    4.259900     -0.3126000      1.8400000E-02
 C   -1.762500      -1.071100      1.5000000E-03
 C   -1.206300       1.325900      1.4000000E-03
 H    2.837500      0.9931000     -0.9090000    
 H    2.816000       1.023900      0.8610000    
 H    2.085100      -1.581900     -1.2800000E-02
 H  -4.2800002E-02  -2.225600     -3.8000001E-03
 H    4.369100     -0.9311000      0.9157000    
 H    4.393500     -0.9615000     -0.8537000    
 H    5.060500      0.4334000      1.6600000E-02
 H   -3.107300      0.5010000      6.3000000E-03


%chk=000017514-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000017514

0 1
O -2.657309 -2.015564 0.002451
O -1.603164 2.548898 0.003547
N 1.844936 -0.631881 -0.007170
N -0.417407 -1.326719 -0.002215
N -2.117272 0.277153 0.002284
N 0.184252 1.012749 -0.003165
C 2.921559 0.385088 -0.010535
C 0.523437 -0.275778 -0.004275
C 4.297833 -0.297185 0.017850
C -1.812634 -1.084293 0.000817
C -1.171541 1.370640 0.001242
H 2.808173 1.021930 -0.906997
H 2.784230 1.049324 0.861914
H 2.113254 -1.616373 -0.012588
H -0.148688 -2.313166 -0.002355
H 4.428916 -0.909692 0.929230
H 4.451466 -0.940513 -0.868657
H 5.091477 0.469356 0.014147
H -3.109919 0.527225 0.004675


