%chk=000005842.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005842

0 1
 O  -0.9875000       1.646700      -1.649100    
 O   8.7899998E-02  -1.190100       1.935200    
 O    3.191000       1.737600      0.2451000    
 N    1.129300       1.620600     -0.7654000    
 N    1.666800      0.2032000       1.024600    
 C  -0.3878000     -0.2354000     -0.2426000    
 C   -1.879500     -0.3755000      9.4099998E-02
 C   1.5000000E-02  -1.339000      -1.237100    
 C  -0.1452000       1.101300     -0.9364000    
 C   0.4419000     -0.4473000       1.019800    
 C   -2.340500      0.7639000      0.9407000    
 C  -0.2578000      -2.693400     -0.6693000    
 C    2.079700       1.211800      0.1625000    
 C   -3.296000       1.623900      0.5709000    
 C   0.6826000      -3.628300     -0.4930000    
 H   -2.099600      -1.287800      0.6606000    
 H   -2.476500     -0.4311000     -0.8263000    
 H    1.074100      -1.242700      -1.511700    
 H  -0.5483000      -1.233500      -2.173700    
 H    1.365700       2.436700      -1.323000    
 H    2.299300     -2.5699999E-02   1.786400    
 H   -1.891500      0.8890000       1.922600    
 H   -1.285500      -2.975100     -0.4590000    
 H   -3.597700       2.427300       1.234000    
 H   -3.791400       1.545500     -0.3905000    
 H   0.4179000      -4.609200     -0.1134000    
 H    1.725300      -3.434800     -0.7188000    


%chk=000005842-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000005842

0 1
O -0.849797 1.384940 -2.018178
O 0.046360 -1.193890 1.972113
O 3.045416 2.005599 0.443916
N 1.083971 1.647133 -0.777646
N 1.572301 0.316754 1.114412
C -0.437877 -0.280149 -0.258208
C -1.968331 -0.319834 0.063111
C -0.042002 -1.486264 -1.227093
C -0.120933 0.984685 -1.075255
C 0.374183 -0.422230 1.036245
C -2.406653 0.771797 1.021410
C -0.168156 -2.865780 -0.622764
C 1.981222 1.363318 0.269112
C -3.153057 1.848380 0.668950
C 0.824092 -3.790198 -0.638207
H -2.190550 -1.306105 0.507828
H -2.510005 -0.230943 -0.894713
H 0.991829 -1.337363 -1.594130
H -0.716710 -1.381824 -2.100571
H 1.336105 2.443789 -1.372086
H 2.171432 0.145874 1.929020
H -2.090009 0.648879 2.067910
H -1.137289 -3.130854 -0.179383
H -3.448234 2.605641 1.404302
H -3.483990 2.002287 -0.365440
H 0.677902 -4.791580 -0.219477
H 1.810478 -3.573463 -1.067979


