%chk=000074368.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000074368

0 1
 S    1.911500     -0.4424000      0.3038000    
 O    2.368000      0.2082000       1.525300    
 O    2.212600      -1.851900      9.1300003E-02
 N    2.488500      0.4469000      -1.037000    
 N   -3.978000      0.2419000     -0.1443000    
 C   0.1821000     -0.2414000      0.1726000    
 C  -0.4456000      0.8313000      0.8057000    
 C  -0.5718000      -1.153700     -0.5655000    
 C   -2.581100      7.9499997E-02 -3.7599999E-02
 C   -1.827300      0.9918000      0.7007000    
 C   -1.953400     -0.9933000     -0.6708000    
 C    2.194500       1.883100      -1.144200    
 H   0.1219000       1.556000       1.382600    
 H  -0.1035000      -1.992300      -1.073000    
 H    2.635100     -4.8300002E-02  -1.925200    
 H   -2.304700       1.832400       1.197800    
 H   -2.529800      -1.709800      -1.250300    
 H    2.188800       2.365800     -0.1640000    
 H    1.233200       2.033200      -1.641800    
 H    2.973200       2.357100      -1.748500    
 H   -4.433600       1.019900      0.3138000    
 H   -4.525000     -0.4188000     -0.6801000    


%chk=000074368-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000074368

0 1
S 1.930605 -0.399726 0.283819
O 2.396945 0.443220 1.593407
O 2.287630 -1.963920 0.020135
N 2.718072 0.482566 -1.138881
N -4.105641 0.167417 -0.125762
C 0.064158 -0.216641 0.152250
C -0.561581 0.859992 0.808530
C -0.658099 -1.182178 -0.574899
C -2.725229 0.039375 -0.031475
C -1.958231 0.988791 0.712095
C -2.054273 -1.051781 -0.666797
C 2.490894 1.940601 -1.173551
H 0.033112 1.560058 1.404696
H -0.136991 -2.032399 -1.027926
H 2.483332 -0.043908 -1.996302
H -2.464326 1.817278 1.220986
H -2.635088 -1.798630 -1.220383
H 2.755685 2.352022 -0.185054
H 1.455968 2.251098 -1.435623
H 3.191560 2.368676 -1.912364
H -4.592785 0.927822 0.339947
H -4.660116 -0.514534 -0.635548


