%chk=000041365.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041365

0 1
 S    2.705500      0.3857000      8.4399998E-02
 N  -0.6129000       1.889100      0.1797000    
 C   0.1307000     -0.4429000      0.3583000    
 C  -0.6702000      0.6001000     -0.4488000    
 C   -1.047500      -1.412400      0.1281000    
 C   -1.942500     -0.1657000     -3.0200001E-02
 C    1.436900     -0.8539000     -0.2716000    
 H   0.2281000     -0.2172000       1.432200    
 H  -0.4913000      0.6032000      -1.530100    
 H   -1.295700      -2.068200      0.9667000    
 H  -0.9742000      -2.015600     -0.7847000    
 H   -2.722000     -0.2426000     -0.7932000    
 H   -2.403000      0.1554000      0.9127000    
 H    1.776900      -1.806900      0.1465000    
 H    1.353100     -0.9810000      -1.355800    
 H   0.2944000       2.346200      9.9699996E-02
 H   -1.295700       2.554400     -0.1809000    
 H    3.708900     -0.2353000     -0.5525000    


%chk=000041365-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000041365

0 1
S 2.736357 0.460078 0.037383
N -0.582736 1.968211 0.218899
C 0.126920 -0.507171 0.356272
C -0.667713 0.631826 -0.375225
C -1.112303 -1.452296 0.139699
C -1.985149 -0.172294 -0.108291
C 1.469917 -0.952638 -0.210237
H 0.216544 -0.239462 1.425751
H -0.420111 0.594605 -1.465126
H -1.395630 -2.105637 0.980219
H -1.007833 -2.067928 -0.772576
H -2.734537 -0.213063 -0.915527
H -2.458281 0.182889 0.823550
H 1.852515 -1.849174 0.306919
H 1.391864 -1.154255 -1.292755
H 0.356894 2.378028 0.154611
H -1.306804 2.616532 -0.110628
H 3.699588 -0.025852 -0.832438


