%chk=000075815.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075815

0 1
 S    5.727500     -0.2426000     -0.3627000    
 N    2.992900     -0.4019000      3.1599998E-02
 C   0.1269000      0.2397000     -0.4988000    
 C   0.8772000      0.5476000      0.8083000    
 C   -1.337700      6.2899999E-02 -0.2793000    
 C    2.366400      0.7949000      0.5951000    
 C   -1.852700      -1.201900      4.9000001E-03
 C   -2.192600       1.162500     -0.3577000    
 C   -3.222400      -1.367300      0.2104000    
 C   -3.562200      0.9969000     -0.1521000    
 C   -4.077100     -0.2680000      0.1319000    
 C    4.153700     -0.3228000     -0.1315000    
 H   0.2965000       1.048800      -1.221200    
 H   0.5357000     -0.6637000     -0.9689000    
 H   0.7433000     -0.2857000       1.510200    
 H   0.4390000       1.433300       1.285500    
 H    2.500400       1.654900     -7.4699998E-02
 H    2.820600       1.049400       1.562200    
 H   -1.197000      -2.066100      7.0699997E-02
 H   -1.803700       2.153500     -0.5763000    
 H   -3.623300      -2.352100      0.4322000    
 H   -4.227900       1.853000     -0.2125000    
 H   -5.143500     -0.3967000      0.2923000    


%chk=000075815-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000075815

0 1
S 4.771032 -2.002525 -0.813704
N 3.181486 0.108282 0.231731
C 0.212746 0.491559 -0.475227
C 0.889652 0.809840 0.883431
C -1.260658 0.144499 -0.309153
C 2.389213 1.179186 0.751066
C -1.664957 -1.192045 -0.057184
C -2.256546 1.153472 -0.362816
C -3.027480 -1.512963 0.137767
C -3.620682 0.837804 -0.169135
C -4.010822 -0.497873 0.083007
C 3.855473 -0.787464 -0.208807
H 0.325255 1.367171 -1.144981
H 0.749473 -0.349803 -0.953417
H 0.784647 -0.053788 1.566482
H 0.378952 1.666375 1.364851
H 2.496482 2.059648 0.084446
H 2.785756 1.470480 1.744348
H -0.908648 -1.986488 -0.021897
H -1.962670 2.191315 -0.565857
H -3.322212 -2.551640 0.325798
H -4.377318 1.629094 -0.220235
H -5.068174 -0.745536 0.229087


