%chk=000043098.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043098

0 1
 O  -0.3282000      -1.066300       1.213700    
 N   -2.519100     -9.6000005E-03  0.2672000    
 N    1.042500      0.4488000      9.0700001E-02
 C   -3.793700      0.7304000      0.1198000    
 C   -4.977500     -0.2542000      3.3799998E-02
 C   -2.315500     -0.9469000     -0.8515000    
 C   -4.795000      -1.266700      -1.089200    
 C   -3.450200      -1.963500     -0.9536000    
 C    1.290800       1.721300     -0.6505000    
 C   -1.359800      0.8823000      0.3639000    
 C    2.641700       1.535000      -1.373000    
 C  -0.1637000     -6.8000001E-03  0.6060000    
 C    2.276500     -0.2398000      0.1830000    
 C   -4.057200       1.693700       1.286000    
 C    3.235500      0.3911000     -0.6141000    
 C    1.361800       2.914900      0.3091000    
 C    2.600900      -1.378300      0.9058000    
 C    4.531800     -9.1499999E-02 -0.7052000    
 C    3.909500      -1.866600      0.8280000    
 C    4.868700      -1.227300      3.0099999E-02
 H   -3.769800       1.321500     -0.8064000    
 H   -5.912000      0.2959000     -0.1316000    
 H   -5.089100     -0.7887000      0.9868000    
 H   -1.398000      -1.538000     -0.7816000    
 H   -2.247700     -0.3924000      -1.798200    
 H   -4.850600     -0.7556000      -2.058100    
 H   -5.605100      -2.004000      -1.066600    
 H   -3.453300      -2.604700     -6.3000001E-02
 H   -3.286600      -2.617000      -1.818200    
 H   0.5054000       1.895000      -1.391800    
 H   -1.279800       1.492200     -0.5362000    
 H   -1.425000       1.538500       1.237000    
 H    3.271600       2.429000      -1.347300    
 H    2.481200       1.230900      -2.413500    
 H   -3.360400       2.537600       1.281300    
 H   -5.065000       2.118500       1.217300    
 H   -3.975700       1.183000       2.252000    
 H   0.4148000       3.055500      0.8381000    
 H    2.141300       2.776800       1.066600    
 H    1.578100       3.837900     -0.2390000    
 H    1.888900      -1.893700       1.538300    
 H    5.267100      0.3925000      -1.339100    
 H    4.186800      -2.753200       1.392200    
 H    5.878300      -1.625500     -2.1400001E-02


%chk=000043098-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000043098

0 1
O -0.148761 -1.446100 0.552883
N -2.588037 -0.126393 -0.114328
N 1.153193 0.373218 -0.086266
C -3.789801 0.764345 -0.131961
C -5.046269 -0.064415 0.248461
C -2.743414 -1.284568 -1.034896
C -5.243056 -1.296705 -0.658615
C -3.959002 -2.149620 -0.661448
C 1.353188 1.826818 -0.446241
C -1.315266 0.561935 -0.334825
C 2.790288 1.847559 -1.051380
C -0.078424 -0.265277 0.100471
C 2.438107 -0.238744 0.088992
C -3.660358 1.959169 0.838120
C 3.441994 0.617618 -0.436179
C 1.254902 2.725068 0.808381
C 2.764632 -1.489416 0.658742
C 4.793666 0.241371 -0.389876
C 4.132268 -1.857976 0.697628
C 5.141467 -1.008187 0.185763
H -3.953596 1.165537 -1.170615
H -5.932110 0.598573 0.197164
H -4.932720 -0.392484 1.300844
H -1.828833 -1.893508 -0.974311
H -2.858094 -0.926607 -2.094464
H -5.467065 -0.962650 -1.693551
H -6.112234 -1.890174 -0.316225
H -3.787458 -2.580572 0.342850
H -4.044774 -2.988552 -1.378842
H 0.593240 2.130340 -1.186531
H -1.165989 0.850088 -1.414070
H -1.304781 1.505192 0.237744
H 3.314293 2.788515 -0.810008
H 2.758248 1.754080 -2.154698
H -2.949510 2.733389 0.495782
H -4.643232 2.453552 0.943510
H -3.346924 1.603620 1.837067
H 0.274213 2.640926 1.308151
H 2.034102 2.446163 1.540528
H 1.404839 3.783815 0.527878
H 1.981918 -2.138449 1.052477
H 5.569221 0.899302 -0.798667
H 4.409215 -2.822209 1.138456
H 6.191915 -1.315585 0.233705


