%chk=000093708.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093708

0 1
 S   -2.237900      -1.682200      -1.029000    
 S    1.107200      -1.343100     -0.9208000    
 N   -1.643800       1.214900      -1.956300    
 N    1.949500       1.538700      -1.689700    
 C   -1.179400      -2.483400      0.2320000    
 C   6.4300001E-02  -1.641400      0.5427000    
 C  -0.7733000      -3.862100     -0.2869000    
 C   -2.661400     -0.1585000     -0.1982000    
 C    2.425300     -0.3617000     -0.2154000    
 C   -2.332600       1.091500     -0.7279000    
 C    2.701500      0.9333000     -0.6571000    
 C   -3.342300     -0.2381000       1.018500    
 C    3.190300     -0.9257000      0.8068000    
 C   -2.683300       2.255600     -4.4100001E-02
 C   -3.693100      0.9261000       1.702200    
 C    3.740100       1.662300     -7.7699997E-02
 C   -3.363500       2.172800       1.171000    
 C    4.228700     -0.1965000       1.386000    
 C    4.503700       1.097300      0.9438000    
 H   -1.756500      -2.623100       1.152300    
 H  -0.2104000     -0.6780000      0.9850000    
 H   0.6586000      -2.169600       1.296500    
 H  -8.9199997E-02  -4.352000      0.4153000    
 H   -1.652400      -4.511400     -0.3779000    
 H  -0.2854000      -3.837100      -1.266900    
 H   -3.623600      -1.195100       1.450800    
 H    3.007800      -1.936500       1.162700    
 H   -2.432800       3.234300     -0.4457000    
 H   -4.225100      0.8621000       2.646800    
 H    3.966100       2.671800     -0.4120000    
 H   -3.637100       3.079300       1.703100    
 H    4.825400     -0.6372000       2.179400    
 H    5.312800       1.664700       1.394500    
 H   -1.406000       2.129100      -2.317100    
 H   -1.368500      0.3831000      -2.461600    
 H    2.163500       2.480100      -1.990700    
 H    1.184600       1.032000      -2.115500    


%chk=000093708-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000093708

0 1
S -2.286258 -1.779741 -0.914418
S 1.195237 -1.389485 -0.999132
N -1.278995 1.041233 -1.753706
N 1.435516 1.647085 -0.283553
C -1.070041 -2.356480 0.472951
C 0.147850 -1.438932 0.606871
C -0.733546 -3.828999 0.184591
C -2.848296 -0.146408 -0.261765
C 2.666498 -0.489641 -0.340253
C -2.319039 1.064769 -0.811485
C 2.599374 0.917715 -0.075375
C -3.865954 -0.094187 0.717131
C 3.867873 -1.201811 -0.132737
C -2.853954 2.306203 -0.356910
C -4.375168 1.141296 1.174886
C 3.776798 1.557516 0.423502
C -3.865012 2.340921 0.622206
C 5.027518 -0.552545 0.347733
C 4.965518 0.833679 0.629861
H -1.661262 -2.272604 1.404229
H -0.150392 -0.405684 0.850128
H 0.819446 -1.816122 1.398782
H -0.070933 -4.221062 0.978659
H -1.648177 -4.445996 0.157411
H -0.203719 -3.937384 -0.777492
H -4.272260 -1.036167 1.101919
H 3.883009 -2.275356 -0.349820
H -2.461879 3.241670 -0.775162
H -5.164132 1.166819 1.932982
H 3.745199 2.633445 0.637352
H -4.258648 3.308422 0.954352
H 5.952978 -1.115795 0.502744
H 5.851842 1.355717 1.009198
H -1.162765 1.839828 -2.376443
H -0.981233 0.123629 -2.102294
H 1.422553 2.639241 -0.061925
H 0.606253 1.241510 -0.736116


