%chk=000117677.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117677

0 1
 S  -2.3399999E-02   2.294800      0.6684000    
 O   1.5200000E-02  -2.169100      0.3287000    
 N   -1.196700     -0.1463000      0.2465000    
 N    1.193300     -0.1258000      0.2508000    
 C   -1.142500      -1.537600     -0.1850000    
 C    1.164800      -1.518300     -0.1793000    
 C  -8.5000005E-03  0.6237000      0.3746000    
 C   -2.550100      0.4146000      0.3083000    
 C    2.536600      0.4583000      0.3169000    
 C   -3.023600      0.8588000      -1.065200    
 C    3.034900      0.8469000      -1.064700    
 H   -2.008800      -2.080600      0.2048000    
 H   -1.161200      -1.581000      -1.280200    
 H    1.189100      -1.563000      -1.274400    
 H    2.038700      -2.045500      0.2153000    
 H   -3.230700     -0.3384000      0.7218000    
 H   -2.579100       1.262500      0.9983000    
 H    2.544200       1.335200      0.9697000    
 H    3.216100     -0.2689000      0.7760000    
 H   -2.356700       1.608300      -1.501700    
 H   -3.071200      1.3500000E-02  -1.759400    
 H   -4.025500       1.294000     -0.9965000    
 H    3.114700     -2.7300000E-02  -1.718900    
 H    2.363100       1.563200      -1.548000    
 H    4.026600       1.304500     -0.9935000    


%chk=000117677-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000117677

0 1
S -0.013049 2.248175 0.641971
O 0.011933 -2.277391 0.360701
N -1.182094 -0.187025 0.176581
N 1.183620 -0.174550 0.180117
C -1.170659 -1.620091 -0.178278
C 1.187322 -1.606658 -0.177896
C -0.003266 0.543390 0.308810
C -2.511380 0.456947 0.288193
C 2.506262 0.481292 0.299439
C -3.074831 0.918464 -1.072952
C 3.081601 0.931028 -1.060661
H -2.039355 -2.117088 0.281900
H -1.201071 -1.757607 -1.283602
H 1.218108 -1.741747 -1.283488
H 2.061723 -2.095189 0.280511
H -3.194361 -0.269611 0.770302
H -2.397231 1.326827 0.956195
H 2.376907 1.357992 0.955575
H 3.189718 -0.233488 0.798366
H -2.396469 1.662868 -1.523849
H -3.199647 0.075189 -1.776997
H -4.062618 1.393858 -0.931823
H 3.221678 0.080508 -1.753055
H 2.402666 1.664212 -1.528811
H 4.063793 1.416194 -0.913949


