%chk=000012543.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000012543

0 1
 S    1.918800      0.4409000     -0.3029000    
 O    2.374900     -0.2097000      -1.524500    
 O    2.221700       1.849900     -8.9800000E-02
 N    2.494300     -0.4495000       1.037700    
 C   0.1892000      0.2421000     -0.1723000    
 C  -0.5643000       1.154900      0.5657000    
 C  -0.4392000     -0.8296000     -0.8064000    
 C   -2.574600     -7.5700000E-02  3.5500001E-02
 C   -1.946200      0.9959000      0.6698000    
 C   -1.821100     -0.9886000     -0.7025000    
 C   -4.052200     -0.2451000      0.1454000    
 C    2.198600      -1.885400       1.144300    
 H  -9.5600002E-02   1.993100       1.073500    
 H   0.1280000      -1.554300      -1.383600    
 H   -2.522600       1.713800       1.247300    
 H   -2.299400      -1.826900      -1.202200    
 H    2.641400      4.5100000E-02   1.926100    
 H   -4.332900      -1.302900      0.1017000    
 H   -4.425100      0.1458000       1.098200    
 H   -4.552800      0.2848000     -0.6710000    
 H    2.192400      -2.367700      0.1639000    
 H    1.237000      -2.034500       1.641600    
 H    2.976600      -2.360700       1.748600    


%chk=000012543-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000012543

0 1
S 1.951153 0.393226 -0.272099
O 2.414934 -0.449992 -1.581080
O 2.301773 1.957790 -0.011699
N 2.716299 -0.485565 1.145839
C 0.064474 0.212846 -0.145471
C -0.648042 1.185677 0.575401
C -0.550073 -0.870934 -0.793553
C -2.721121 -0.041689 0.038264
C -2.050333 1.044408 0.662759
C -1.953925 -0.990905 -0.688266
C -4.232483 -0.160407 0.110211
C 2.560626 -1.950974 1.164300
H -0.124708 2.036426 1.024667
H 0.046851 -1.576655 -1.380612
H -2.631656 1.791431 1.215519
H -2.459679 -1.827173 -1.184585
H 2.494645 0.032013 2.009973
H -4.561631 -1.211808 0.044168
H -4.630097 0.266565 1.047182
H -4.708129 0.386016 -0.727116
H 2.823581 -2.336586 0.164889
H 1.547667 -2.312834 1.443848
H 3.296772 -2.355175 1.881564


