%chk=000010618.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000010618

0 1
 O   0.8448000      -2.078000      5.8300000E-02
 N   0.6219000       1.381000      0.1129000    
 N  -1.7300000E-02  0.1338000      0.1774000    
 N    3.392800     -0.8669000     -0.4009000    
 C    1.965900       1.141600     -0.1635000    
 C    2.256600     -0.1674000     -0.1988000    
 C   0.9573000     -0.8623000      5.6100000E-02
 C   -1.418500     -3.2900002E-02  4.4100001E-02
 C   0.2249000       2.416300       1.062200    
 C    2.931300       2.265700     -0.3379000    
 C   -2.018600      -1.249400      0.3834000    
 C   -2.210900       1.018500     -0.4266000    
 C    3.641100      -2.181500      0.1536000    
 C   -3.397700      -1.413000      0.2531000    
 C   -3.590100      0.8551000     -0.5567000    
 C   -4.183500     -0.3607000     -0.2169000    
 H   0.4446000       3.407100      0.6506000    
 H   0.7784000       2.303700       2.001900    
 H  -0.8376000       2.395700       1.315700    
 H    3.926500       1.914300     -0.6270000    
 H    3.037700       2.833300      0.5919000    
 H    2.582600       2.946400      -1.121500    
 H    4.211300     -0.3260000     -0.6625000    
 H   -1.447200      -2.082200      0.7800000    
 H   -1.784700       1.967700     -0.7385000    
 H    4.715200      -2.390800      0.1196000    
 H    3.141100      -2.957000     -0.4342000    
 H    3.325500      -2.245600       1.200200    
 H   -3.861100      -2.357400      0.5235000    
 H   -4.201300       1.671200     -0.9307000    
 H   -5.257200     -0.4881000     -0.3188000    


%chk=000010618-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000010618

0 1
O 0.698508 -2.156016 0.016029
N 0.585024 1.416763 0.067146
N -0.017604 0.120042 0.217418
N 3.447668 -0.834814 -0.419714
C 1.990060 1.169557 -0.072302
C 2.240956 -0.196133 -0.129038
C 0.959886 -0.911330 0.049248
C -1.427734 -0.030139 0.057983
C 0.160402 2.396806 1.105783
C 2.945182 2.321639 -0.189690
C -2.070384 -1.176249 0.594784
C -2.183528 0.949909 -0.638141
C 3.756914 -2.213074 -0.005026
C -3.463599 -1.327553 0.434358
C -3.578915 0.791228 -0.774150
C -4.227761 -0.345756 -0.239304
H 0.586365 3.379538 0.847588
H 0.497636 2.099599 2.119938
H -0.936922 2.482486 1.100513
H 3.977877 1.956019 -0.322903
H 2.948109 2.966526 0.710560
H 2.706900 2.963838 -1.059013
H 4.247047 -0.224441 -0.591754
H -1.475515 -1.937098 1.103956
H -1.668754 1.802178 -1.093058
H 4.504575 -2.645805 -0.693440
H 2.837676 -2.816185 -0.057850
H 4.154391 -2.273651 1.032095
H -3.954173 -2.217498 0.844029
H -4.156164 1.550469 -1.313899
H -5.310322 -0.468656 -0.352147


