%chk=000140686.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000140686

0 1
 O   -1.763800       1.044600      -1.464000    
 N    1.524300      0.6844000      1.3400000E-02
 C  -0.5557000     -0.6953000     -0.2780000    
 C   0.8509000     -0.3311000     -0.8466000    
 C   -1.442200      0.5665000     -0.1492000    
 C  -0.7010000       1.665700      0.6186000    
 C  -0.4224000      -1.490500       1.042700    
 C   0.7226000       1.935300      8.5299999E-02
 C    1.638500      -1.651400      -1.029700    
 C   0.4421000      -2.739700      0.8852000    
 C    1.800200      -2.424000      0.2744000    
 C   -2.797200      0.2883000      0.5102000    
 C    1.352300       3.005500      0.9955000    
 C    2.891100      0.9602000     -0.4487000    
 C   -3.539600     -0.8186000     -0.2091000    
 H   -1.016300      -1.358300      -1.024700    
 H   0.7201000      9.9200003E-02  -1.849900    
 H  -0.6426000       1.399300       1.682500    
 H   -1.275500       2.600200      0.5604000    
 H   -1.398900      -1.812600       1.415600    
 H   1.3500000E-02 -0.8585000       1.825500    
 H   0.6352000       2.365300     -0.9222000    
 H    2.616700      -1.478900      -1.489500    
 H    1.097700      -2.283200      -1.748000    
 H  -8.3400004E-02  -3.462300      0.2482000    
 H   0.5787000      -3.219700       1.860900    
 H    2.403500      -1.848200      0.9858000    
 H    2.340300      -3.358300      8.3700001E-02
 H   -3.420700       1.191300      0.4727000    
 H   -2.686200      3.3000000E-02   1.569800    
 H   0.6608000       3.841900       1.149600    
 H    1.602900       2.594300       1.979700    
 H    2.258900       3.432100      0.5556000    
 H    3.520000      6.6299997E-02 -0.4085000    
 H    3.406600       1.667900      0.2070000    
 H    2.905900       1.355900      -1.470100    
 H   -2.254700       1.879100      -1.373700    
 H   -3.674500     -0.6012000      -1.273400    
 H   -3.054900      -1.793500     -0.1164000    
 H   -4.540200     -0.9252000      0.2248000    


%chk=000140686-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000140686

0 1
O -1.656702 0.985958 -1.546460
N 1.515894 0.682937 0.026801
C -0.553874 -0.714343 -0.261197
C 0.833751 -0.327953 -0.857947
C -1.451810 0.541608 -0.131916
C -0.699536 1.644202 0.644183
C -0.389132 -1.493661 1.069184
C 0.710457 1.947993 0.087183
C 1.657384 -1.625035 -1.056543
C 0.477631 -2.761634 0.880159
C 1.849734 -2.412495 0.259015
C -2.843798 0.281729 0.504946
C 1.374327 3.023977 0.972689
C 2.912598 0.942200 -0.392450
C -3.678104 -0.810497 -0.195449
H -1.039339 -1.381184 -1.003388
H 0.653091 0.127725 -1.862534
H -0.600360 1.342249 1.705082
H -1.299901 2.577971 0.627649
H -1.379184 -1.782442 1.470404
H 0.098070 -0.840298 1.817497
H 0.587590 2.360623 -0.949253
H 2.628705 -1.412515 -1.538913
H 1.093829 -2.255292 -1.774987
H -0.051789 -3.473649 0.212133
H 0.613587 -3.274597 1.852183
H 2.428835 -1.797910 0.975770
H 2.431450 -3.335469 0.067971
H -3.403765 1.241820 0.481203
H -2.718933 0.035254 1.577479
H 0.656383 3.842929 1.162792
H 1.665539 2.588207 1.946696
H 2.267601 3.474949 0.507594
H 3.506169 0.016185 -0.331200
H 3.381687 1.668935 0.289133
H 2.993861 1.339424 -1.436879
H -2.181733 1.827359 -1.526449
H -3.742449 -0.611397 -1.279646
H -3.231032 -1.812214 -0.062081
H -4.703732 -0.845849 0.214943


