%chk=000128486.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128486

0 1
 S   0.7598000     -0.8844000     -9.3199998E-02
 N    3.831400      0.7968000      0.2144000    
 N   -2.341300     -0.4286000      0.3394000    
 N    4.206600      -1.163700     -0.7591000    
 N   -3.999600       1.185900     -0.3263000    
 N   -4.453500      -1.167500     -0.3750000    
 N   -2.340700       2.991800      0.1742000    
 C    3.463000     -0.4991000      7.5599998E-02
 C    2.298800      -1.066000      0.8358000    
 C  -0.3639000      -1.657800       1.110500    
 C   -1.795300      -1.742100      0.5954000    
 C    4.909500      0.9856000     -0.6038000    
 C    3.225400       1.803700       1.053300    
 C    5.122400     -0.2383000      -1.193400    
 C   -3.626100     -0.1984000     -0.1276000    
 C   -5.790100     -0.8688000     -0.8639000    
 C   -3.106300       2.150900     -5.6400001E-02
 H    2.481700      -2.133200       1.004000    
 H    2.199000     -0.5943000       1.818200    
 H  -0.3340000      -1.073800       2.036800    
 H  -2.3000001E-03  -2.667800       1.329800    
 H   -2.410200      -2.248300       1.348700    
 H   -1.832700      -2.348200     -0.3177000    
 H    5.416100       1.936300     -0.6950000    
 H   -1.717300      0.3530000      0.5135000    
 H    3.336100       1.499900       2.097100    
 H    3.731300       2.759800      0.8950000    
 H    2.171400       1.901200      0.7836000    
 H    5.888400     -0.4999000      -1.908800    
 H   -4.930000       1.400800     -0.6672000    
 H   -6.360500     -0.2760000     -0.1413000    
 H   -6.331800      -1.808600      -1.011200    
 H   -5.760400     -0.3569000      -1.831200    


%chk=000128486-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128486

0 1
S 1.035680 -1.730574 -0.416540
N 3.303764 0.965618 0.027146
N -1.953859 -0.765393 -0.150096
N 4.563998 -0.840736 0.588199
N -3.188092 1.260345 -0.188475
N -4.305168 -0.892170 0.032785
N -1.027824 2.605987 -0.115621
C 3.307075 -0.327779 0.563594
C 2.096667 -1.041832 1.046801
C -0.383052 -2.512985 0.596992
C -1.750939 -2.212715 -0.037365
C 4.627816 1.279808 -0.291889
C 2.136444 1.847915 -0.129039
C 5.387503 0.158515 0.059796
C -3.209037 -0.196260 -0.101799
C -5.608818 -0.227483 0.187905
C -2.068106 2.006071 -0.148894
H 2.421101 -1.905854 1.643854
H 1.421759 -0.396610 1.634071
H -0.327858 -2.084061 1.612500
H -0.207548 -3.599667 0.644785
H -2.564297 -2.622307 0.587815
H -1.833724 -2.703228 -1.029445
H 4.903452 2.237729 -0.725296
H -1.138828 -0.229468 -0.468131
H 1.888427 2.367149 0.812870
H 2.339559 2.604063 -0.903159
H 1.260098 1.263368 -0.447135
H 6.460786 0.013021 -0.036052
H -4.093733 1.721460 -0.287746
H -5.613163 0.600739 0.934480
H -6.342692 -0.974302 0.532750
H -5.992494 0.175637 -0.775459


