%chk=000093998.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093998

0 1
 O   -1.599100     -0.1056000     -0.1601000    
 O  -0.6518000      -2.079800      0.4996000    
 O    7.711300       2.761800     -0.2177000    
 N   0.6392000     -0.2698000     -0.2334000    
 N    5.984000       1.270500      0.3369000    
 C   -3.973000      0.4037000     -0.2049000    
 C   -5.362500     -0.2627000     -0.1213000    
 C   -3.830400       1.678300      0.6570000    
 C   -6.509400      0.6529000     -0.5618000    
 C   -2.888200     -0.6396000      0.1093000    
 C   -7.884700     -1.2100000E-02 -0.4590000    
 C   -4.048600       1.477400       2.150300    
 C   -9.030100      0.9003000     -0.8703000    
 C  -0.5301000     -0.9362000      7.7900000E-02
 C    1.965700     -0.7486000     -0.1383000    
 C    3.032600      7.3899999E-02 -0.5002000    
 C    4.341200     -0.3997000     -0.4063000    
 C    2.207400      -2.044400      0.3177000    
 C    4.583000      -1.695500      4.9800001E-02
 C    3.516100      -2.517900      0.4118000    
 C    5.481800      0.4792000     -0.7935000    
 C    6.845900       2.013800      5.6499999E-02
 H   -3.817400      0.7243000      -1.244800    
 H   -5.547800     -0.6206000      0.8985000    
 H   -5.370100      -1.153000     -0.7636000    
 H   -2.827900       2.099400      0.5100000    
 H   -4.522900       2.448000      0.2982000    
 H   -6.338700      0.9775000      -1.595400    
 H   -6.526500       1.555500      5.8400001E-02
 H   -2.947200     -0.9638000       1.154400    
 H   -3.036100      -1.519500     -0.5291000    
 H   -7.902100     -0.9092000      -1.089100    
 H   -8.051500     -0.3445000      0.5726000    
 H   -3.921800       2.430800       2.674100    
 H   -5.058400       1.117000       2.365400    
 H   -3.328000      0.7726000       2.573900    
 H   -9.067800       1.790300     -0.2343000    
 H   -8.915900       1.225100      -1.909300    
 H   -9.986100      0.3753000     -0.7796000    
 H   0.5365000      0.6834000     -0.5731000    
 H    2.844500       1.085200     -0.8539000    
 H    1.433300      -2.737900      0.6156000    
 H    5.598000      -2.075600      0.1296000    
 H    3.705700      -3.526700      0.7674000    
 H    6.288800     -0.1421000      -1.209100    
 H    5.162200       1.139600      -1.613400    


%chk=000093998-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000093998

0 1
O -1.548382 -0.388251 -1.175801
O -0.879683 -1.862635 0.546971
O 5.878722 3.123809 -3.083622
N 0.625908 -0.426390 -0.590615
N 5.220933 1.443260 -1.449377
C -3.838088 0.332383 -0.495881
C -5.331053 -0.086869 -0.611872
C -3.416143 0.777113 0.933132
C -6.334812 1.017222 -0.209912
C -2.967680 -0.819541 -1.036827
C -7.803552 0.615596 -0.478080
C -3.640856 -0.265393 2.052714
C -8.811552 1.707469 -0.059340
C -0.612404 -0.983845 -0.310956
C 1.871818 -0.716245 0.026941
C 3.008163 -0.007390 -0.447653
C 4.278395 -0.232561 0.113063
C 2.013511 -1.661620 1.074819
C 4.424573 -1.175971 1.160830
C 3.293881 -1.877836 1.628196
C 5.515860 0.516418 -0.379078
C 5.617870 2.277693 -2.242720
H -3.682300 1.202096 -1.169960
H -5.516713 -0.990180 0.004889
H -5.535882 -0.383575 -1.662571
H -2.344286 1.056067 0.907792
H -3.962478 1.707069 1.184207
H -6.102897 1.948911 -0.767745
H -6.219494 1.259710 0.865517
H -3.000150 -1.708419 -0.381628
H -3.278764 -1.098821 -2.058777
H -7.928750 0.388781 -1.556700
H -8.028262 -0.325357 0.064854
H -3.327922 0.149716 3.028334
H -4.705583 -0.550128 2.141172
H -3.046549 -1.180065 1.879606
H -8.726752 1.932285 1.020689
H -8.629551 2.648456 -0.612278
H -9.853212 1.395206 -0.258356
H 0.620755 0.272146 -1.337284
H 2.910172 0.724866 -1.257956
H 1.139275 -2.205605 1.436832
H 5.409896 -1.360711 1.606032
H 3.405429 -2.607543 2.437708
H 5.969874 1.067161 0.470016
H 6.271816 -0.217481 -0.725927


