%chk=000162297.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162297

0 1
 O   -2.116900      -1.539600      0.6008000    
 N   -2.687300      0.6448000      0.5954000    
 C    3.487100     -9.2900001E-02  0.2654000    
 C    2.672500       1.084600      0.8199000    
 C    2.671600      -1.223700     -0.3823000    
 C    1.693200       1.690900     -0.1912000    
 C    1.545800      -1.776100      0.5007000    
 C   0.5090000       2.365600      0.5031000    
 C   0.5204000      -2.604000     -0.2849000    
 C  -0.6385000       2.719300     -0.4524000    
 C  -0.4423000      -1.773200      -1.148800    
 C   -1.250000       1.539900      -1.225100    
 C   -1.369200     -0.9168000     -0.3626000    
 C   -1.725100      0.4216000     -0.3659000    
 C   -2.870200     -0.5402000       1.127900    
 H    4.086500     -0.5119000       1.083100    
 H    4.199700      0.2864000     -0.4775000    
 H    3.362500       1.866200       1.161300    
 H    2.141400      0.7501000       1.718500    
 H    3.356500      -2.044700     -0.6311000    
 H    2.281200     -0.8781000      -1.344300    
 H    1.315500      0.9183000     -0.8582000    
 H    2.218300       2.414400     -0.8261000    
 H    1.018600     -0.9816000       1.034600    
 H    1.998600      -2.413600       1.270500    
 H   0.8568000       3.281100      0.9968000    
 H   0.1197000       1.717100       1.297000    
 H  -5.9400000E-02  -3.203600      0.4282000    
 H    1.050500      -3.316900     -0.9287000    
 H  -0.2853000       3.463800      -1.176500    
 H   -1.427300       3.208600      0.1335000    
 H   -1.050000      -2.463800      -1.747000    
 H   0.1180000      -1.163700      -1.864400    
 H  -0.5384000       1.171700      -1.971800    
 H   -2.107600       1.914900      -1.798600    
 H   -3.544100     -0.8138000       1.925700    


%chk=000162297-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000162297

0 1
O -2.105887 -1.541072 0.682495
N -2.670141 0.673427 0.651272
C 3.516708 -0.097480 0.292242
C 2.668780 1.076606 0.857257
C 2.693413 -1.222661 -0.394545
C 1.695992 1.715939 -0.166856
C 1.564897 -1.826004 0.479669
C 0.481319 2.412804 0.489921
C 0.533084 -2.660602 -0.319187
C -0.659543 2.765536 -0.496006
C -0.457130 -1.806141 -1.168161
C -1.240867 1.544314 -1.271471
C -1.355188 -0.916458 -0.361868
C -1.706646 0.427111 -0.375486
C -2.866122 -0.492805 1.238356
H 4.108004 -0.533928 1.123360
H 4.252244 0.294353 -0.440227
H 3.350197 1.848136 1.268227
H 2.077343 0.709644 1.720479
H 3.384397 -2.033544 -0.702865
H 2.259973 -0.828936 -1.335602
H 1.313644 0.919531 -0.829715
H 2.238105 2.427530 -0.822597
H 1.023398 -1.018393 1.008377
H 2.018147 -2.458448 1.268912
H 0.808220 3.333067 1.014581
H 0.070905 1.740885 1.270844
H -0.060862 -3.282709 0.376759
H 1.061189 -3.356660 -1.001432
H -0.305629 3.507902 -1.239631
H -1.485326 3.237632 0.068785
H -1.075417 -2.494360 -1.779289
H 0.097594 -1.170584 -1.883557
H -0.497008 1.151372 -1.989055
H -2.098544 1.900523 -1.875647
H -3.521445 -0.744429 2.066660


