%chk=000014997.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014997

0 1
 S    1.888200       1.024500     -0.1647000    
 O   -2.704400     -0.2153000      -1.419800    
 O    2.725500      -1.430200      0.3487000    
 N   -2.026300      0.4698000      0.6991000    
 C  -0.8145000       1.152900      0.3076000    
 C   0.3571000      0.1791000      0.3251000    
 C   -2.867900     -0.1569000     -0.2039000    
 C   -4.043000     -0.8113000      0.4718000    
 C    3.038100     -0.3008000     -8.5000005E-03
 C    4.447200      8.8200003E-02 -0.3553000    
 H  -0.6625000       1.969600       1.021500    
 H  -0.9576000       1.581800     -0.6908000    
 H   0.1714000     -0.6526000     -0.3636000    
 H   0.4804000     -0.2402000       1.330100    
 H   -2.252800      0.4413000       1.689100    
 H   -4.782000      -1.106000     -0.2785000    
 H   -3.704400      -1.699500       1.012000    
 H   -4.514400     -0.1159000       1.172200    
 H    4.799400      0.8759000      0.3164000    
 H    4.503700      0.4228000      -1.394800    
 H    5.100700     -0.7815000     -0.2380000    


%chk=000014997-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000014997

0 1
S 1.878301 0.374432 -1.298372
O -3.010772 0.666078 -1.081167
O 2.465226 -0.545106 1.221030
N -1.739731 0.052425 0.763060
C -0.502475 0.647263 0.233631
C 0.246707 -0.348422 -0.678235
C -2.932664 0.102752 0.053077
C -4.133945 -0.554171 0.727652
C 2.920948 0.019760 0.200362
C 4.358209 0.477296 0.042913
H 0.142417 0.941665 1.078867
H -0.776654 1.545755 -0.344774
H -0.343026 -0.584110 -1.577876
H 0.502917 -1.270171 -0.129784
H -1.704930 -0.437396 1.657873
H -4.933075 0.197474 0.847272
H -4.528962 -1.347095 0.069447
H -3.904199 -0.990211 1.715428
H 4.539152 0.970813 -0.924682
H 5.027885 -0.396815 0.137090
H 4.610569 1.173484 0.862887


