%chk=000127856.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127856

0 1
 O    3.348300      -1.860200      0.7248000    
 N    1.594500      -1.127900     -0.6209000    
 C    3.746200      1.4000000E-02 -0.7690000    
 C    5.120000      0.2936000     -0.1251000    
 C    3.366800       1.465200     -0.4069000    
 C    4.876000       1.785200     -0.4348000    
 C    2.893500      -1.107200     -0.1324000    
 C   0.5943000      -2.058600     -0.1715000    
 C  -0.2058000      -1.525700       1.020200    
 C  -0.9173000     -0.2401000      0.7301000    
 C   -2.224900     -0.2118000      0.2184000    
 C   -2.842000       1.036300     -3.5399999E-02
 C  -0.2281000      0.9449000      0.9887000    
 C   -2.933300      -1.394900     -4.7800001E-02
 C   -2.133300       2.219200      0.2306000    
 C  -0.8350000       2.172300      0.7393000    
 C   -4.149500       1.064600     -0.5471000    
 C   -4.231700      -1.348100     -0.5561000    
 C   -4.838600     -0.1209000     -0.8051000    
 H    3.835700     -0.1296000      -1.856500    
 H    5.980800     -0.1545000     -0.6282000    
 H    5.182500      7.6899998E-02  0.9477000    
 H    2.917800       1.587300      0.5847000    
 H    2.759100       1.997600      -1.143100    
 H    5.227200       2.492600      0.3203000    
 H    5.243200       2.098300      -1.418900    
 H    1.326200     -0.4487000      -1.327200    
 H  -6.3800000E-02  -2.260000      -1.023500    
 H    1.082000      -2.999200      0.1072000    
 H   0.4857000      -1.361800       1.859500    
 H  -0.8868000      -2.295400       1.397900    
 H   0.7778000      0.9293000       1.397800    
 H   -2.508700      -2.381300      0.1107000    
 H   -2.588100       3.189900      4.3900002E-02
 H  -0.2988000       3.094500      0.9433000    
 H   -4.643500       2.012500     -0.7498000    
 H   -4.767900      -2.270200     -0.7611000    
 H   -5.849100     -8.5199997E-02  -1.201800    


%chk=000127856-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127856

0 1
O 3.405042 -1.673728 0.638586
N 1.516244 -0.650843 -0.264750
C 3.704093 0.465994 -0.508389
C 4.989900 0.100847 -1.342313
C 4.655733 1.165471 0.534702
C 5.785793 1.194324 -0.550788
C 2.877046 -0.704577 0.005732
C 0.577341 -1.683024 0.191210
C -0.346698 -1.188664 1.346183
C -1.241406 -0.026062 0.942818
C -2.446074 -0.232485 0.165202
C -3.236771 0.917242 -0.237740
C -0.875943 1.282911 1.291698
C -2.903243 -1.537124 -0.227088
C -2.815308 2.234682 0.141298
C -1.656016 2.413826 0.895254
C -4.431202 0.716407 -1.006645
C -4.071196 -1.701970 -0.976022
C -4.843438 -0.565707 -1.373194
H 3.078697 1.207375 -1.041037
H 4.919622 0.201606 -2.437789
H 5.325847 -0.917081 -1.081488
H 4.893708 0.463631 1.352063
H 4.316230 2.126588 0.955028
H 6.804608 0.933972 -0.221524
H 5.819617 2.157282 -1.090887
H 1.138641 0.173790 -0.735230
H -0.034428 -2.026917 -0.664223
H 1.193972 -2.526976 0.546134
H 0.300617 -0.888076 2.189369
H -0.944585 -2.051683 1.695998
H 0.027548 1.440301 1.892854
H -2.334181 -2.422563 0.073975
H -3.420673 3.095471 -0.166744
H -1.338065 3.419283 1.192149
H -5.019767 1.593700 -1.301327
H -4.402375 -2.706931 -1.260177
H -5.757532 -0.707394 -1.960000


