%chk=000036141.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036141

1 1
 S   0.2132000      -1.322400     -2.0600000E-02
 N   -3.626500      0.2321000     -2.0400001E-02
 N    2.756000     -0.6815000      0.1022000    
 N    3.702900      0.2762000      0.1945000    
 C   -2.513200     -0.8052000     -5.0400000E-02
 C   -3.428700       1.221800      -1.159500    
 C   -4.971200     -0.4626000     -0.1795000    
 C   -3.592900      0.9742000       1.307900    
 C   -1.155500     -0.1262000      2.4800001E-02
 C    1.556300     -0.2045000      0.1007000    
 C    5.016500     -8.8000000E-02 -0.3086000    
 C    6.043100      0.9861000      8.8000000E-03
 H   -2.674800      -1.485600      0.7946000    
 H   -2.622200      -1.371800     -0.9834000    
 H   -3.268800      0.6646000      -2.087200    
 H   -4.337700       1.826900      -1.241500    
 H   -2.589400       1.886500     -0.9402000    
 H   -5.090900      -1.175100      0.6421000    
 H   -5.761800      0.2929000     -0.1467000    
 H   -4.980600     -0.9816000      -1.142500    
 H   -3.587300      0.2414000       2.120100    
 H   -2.715800       1.623700       1.354700    
 H   -4.493100       1.594200       1.371000    
 H  -0.9871000      0.5450000     -0.8205000    
 H   -1.036100      0.4415000      0.9505000    
 H    1.328700      0.8745000      0.1747000    
 H    5.342400      -1.030300      0.1472000    
 H    4.972500     -0.2429000      -1.392700    
 H    3.400200       1.164200     -0.2051000    
 H    5.774400       1.940400     -0.4565000    
 H    6.129300       1.143600       1.089200    
 H    7.027400      0.6919000     -0.3692000    


%chk=000036141-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000036141

1 1
S -0.178264 1.548621 -3.070829
N -2.507364 -0.017734 0.103230
N 1.445296 0.779098 -0.972604
N 2.647578 0.555115 -0.347820
C -1.698986 0.152628 -1.221449
C -3.840703 0.718546 0.023447
C -2.769254 -1.511348 0.294701
C -1.696351 0.501517 1.290576
C -1.308583 1.595167 -1.562521
C 1.394983 1.096169 -2.240782
C 2.631008 -0.082367 0.976946
C 4.038060 -0.054251 1.596850
H -0.783479 -0.447683 -1.090293
H -2.320544 -0.288369 -2.019670
H -4.416170 0.330292 -0.830839
H -4.399124 0.550723 0.957470
H -3.657775 1.794672 -0.106451
H -1.805696 -2.034271 0.391250
H -3.369712 -1.660818 1.205344
H -3.314903 -1.897033 -0.579948
H -0.677966 0.088909 1.232269
H -1.648228 1.598726 1.250576
H -2.191436 0.186295 2.222088
H -2.159288 2.227901 -1.859521
H -0.723491 2.072918 -0.761277
H 2.250991 1.172518 -2.927954
H 1.925530 0.481015 1.617657
H 2.268979 -1.133142 0.914082
H 3.507071 0.478197 -0.908653
H 4.764138 -0.615525 0.979592
H 4.401089 0.981859 1.708288
H 4.021896 -0.524346 2.594747


