%chk=000039382.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039382

0 1
 S   3.8999999E-03   1.669700      0.1912000    
 N   0.1725000     -0.8875000     -0.1005000    
 N    5.076700      -1.312500     -0.1555000    
 C    1.471200     -0.4027000     -4.7400001E-02
 C    1.583100      0.9821000      0.1104000    
 C  -0.6738000      0.1092000      1.4600000E-02
 C   -2.111400     -2.3399999E-02  1.0000000E-03
 C    2.651700      -1.171900     -0.1368000    
 C    2.830800       1.622100      0.1814000    
 C    3.897400     -0.5413000     -6.6799998E-02
 C    3.983400      0.8376000      9.0200000E-02
 C   -2.700500      -1.256700      0.2771000    
 C   -2.909200       1.082600     -0.2896000    
 C   -4.089400      -1.384200      0.2626000    
 C   -4.298100      0.9551000     -0.3040000    
 C   -4.888200     -0.2783000     -2.7899999E-02
 H    2.582200      -2.249700     -0.2593000    
 H    2.905500       2.698200      0.3040000    
 H    4.954000       1.326000      0.1445000    
 H   -2.099100      -2.132300      0.5092000    
 H   -2.514500       2.062600     -0.5396000    
 H   -4.549200      -2.344400      0.4780000    
 H   -4.921000       1.814200     -0.5362000    
 H   -5.969700     -0.3778000     -4.0600002E-02
 H    5.017800      -2.315500     -0.2711000    
 H    5.980800     -0.8621000     -0.1070000    


%chk=000039382-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000039382

0 1
S 0.058837 1.916601 -0.076049
N 0.182902 -0.778778 0.010312
N 5.081615 -1.406191 0.040411
C 1.513255 -0.327937 -0.001291
C 1.670522 1.097523 -0.046797
C -0.699073 0.205094 -0.023420
C -2.157422 0.036108 -0.021205
C 2.644340 -1.172427 0.028170
C 2.954806 1.673301 -0.062984
C 3.941566 -0.598806 0.012189
C 4.080070 0.827190 -0.033653
C -2.698336 -1.281174 0.023135
C -3.045633 1.145216 -0.061682
C -4.092902 -1.477125 0.026817
C -4.441069 0.943519 -0.057696
C -4.971537 -0.367315 -0.013426
H 2.498302 -2.256724 0.062672
H 3.090959 2.758461 -0.097669
H 5.084149 1.267751 -0.046100
H -2.004745 -2.126942 0.053957
H -2.646855 2.166070 -0.096463
H -4.497889 -2.494580 0.061171
H -5.114746 1.806776 -0.089094
H -6.056155 -0.522074 -0.010421
H 5.001538 -2.417745 0.071697
H 6.010400 -0.996690 0.029319


