%chk=000176937.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176937

0 1
 S   -3.558200     -7.9599999E-02  0.4645000    
 O   0.2944000      0.3834000      5.3500000E-02
 O    1.186100      -1.711900      0.3182000    
 N    2.575800      0.1033000     -0.1011000    
 N  -0.9086000     -0.2996000      0.2718000    
 C    3.823600     -0.6544000     -8.8299997E-02
 C    2.699100       1.533400     -0.3450000    
 C    1.334800     -0.5086000      0.1089000    
 C   -1.916800      0.5131000      0.2268000    
 C   -1.812400       1.995500     -2.9200001E-02
 C   -3.717900      -1.274500     -0.8801000    
 H    3.638300      -1.714700      0.1007000    
 H    4.469500     -0.2567000      0.6996000    
 H    4.313600     -0.5431000      -1.059600    
 H    3.334200       1.965100      0.4345000    
 H    1.742600       2.059000     -0.3440000    
 H    3.175600       1.679500      -1.319100    
 H   -1.184200       2.453300      0.7410000    
 H   -2.787300       2.490000     -1.7700000E-02
 H   -1.352100       2.162300      -1.007900    
 H   -4.727900      -1.692600     -0.8780000    
 H   -3.001100      -2.089900     -0.7529000    
 H   -3.541300     -0.7866000      -1.842400    


%chk=000176937-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000176937

0 1
S -3.746892 0.263601 -0.331376
O 0.248660 0.475904 -0.206067
O 1.086876 -1.751612 -0.403213
N 2.518315 0.097015 -0.179103
N -1.096986 -0.153245 -0.307132
C 3.726788 -0.740087 -0.225857
C 2.720500 1.546055 -0.031809
C 1.285801 -0.525021 -0.276082
C -2.006387 0.792715 -0.228926
C -1.794018 2.277899 -0.064188
C -3.552707 -1.599533 -0.530205
H 3.426184 -1.792322 -0.337402
H 4.313996 -0.626494 0.706040
H 4.366345 -0.452083 -1.082758
H 3.271577 1.764007 0.904194
H 1.752395 2.062014 -0.002749
H 3.312165 1.940504 -0.881433
H -1.225015 2.477424 0.861625
H -2.752110 2.820266 -0.021104
H -1.197068 2.669293 -0.907708
H -4.576926 -1.997747 -0.592956
H -3.017626 -2.008405 0.338091
H -2.984067 -1.814450 -1.445682


