%chk=000084396.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084396

0 1
 S   -2.193600      -1.744000      0.2882000    
 O    2.405700      0.6926000      0.4953000    
 N   -3.085100      0.6012000     -0.3093000    
 N   -4.719400      -1.101200     -0.2177000    
 C    1.057800      0.6989000      0.2921000    
 C    3.101700     -0.5121000      0.1833000    
 C   -1.049200     -0.4570000      0.2051000    
 C    4.523900     -0.1655000     -0.2294000    
 C   -1.715300      0.7261000     -0.1287000    
 C   0.3380000     -0.4917000      0.4197000    
 C   0.4173000       1.887900     -3.9000001E-02
 C  -0.9641000       1.915200     -0.2513000    
 C    5.324300      -1.403400     -0.5923000    
 C   -3.442000     -0.6470000     -0.1160000    
 H    2.630400      -1.045500     -0.6527000    
 H    3.113700      -1.158100       1.068800    
 H    4.502500      0.5258000      -1.080600    
 H    5.021700      0.3748000      0.5847000    
 H   0.8042000      -1.429200      0.7047000    
 H   0.9884000       2.807800     -0.1357000    
 H   -1.454300       2.849600     -0.5097000    
 H    4.866800      -1.934900      -1.432900    
 H    6.342800      -1.125300     -0.8809000    
 H    5.388000      -2.092000      0.2563000    
 H   -4.954300      -2.075700     -6.0400002E-02
 H   -5.488700     -0.4838000     -0.4554000    


%chk=000084396-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000084396

0 1
S -2.277546 -1.903735 0.030455
O 2.418339 0.726668 -0.164741
N -3.221904 0.643110 -0.009005
N -4.944059 -1.017067 0.079401
C 1.016191 0.639194 -0.124116
C 3.188077 -0.528426 -0.155895
C -1.106389 -0.510752 -0.037042
C 4.671008 -0.152218 -0.207528
C -1.814968 0.732829 -0.049134
C 0.298411 -0.583605 -0.073453
C 0.333480 1.886427 -0.136579
C -1.069992 1.935949 -0.099311
C 5.574664 -1.405037 -0.200910
C -3.633059 -0.605136 0.033651
H 2.906423 -1.146357 -1.035370
H 2.958267 -1.102269 0.767413
H 4.855190 0.448974 -1.117177
H 4.905295 0.494429 0.658378
H 0.812013 -1.547748 -0.062604
H 0.931103 2.801709 -0.175763
H -1.601856 2.891545 -0.108681
H 5.368933 -2.054707 -1.072380
H 6.640396 -1.118757 -0.240092
H 5.421734 -2.007060 0.714486
H -5.197458 -1.999315 0.111494
H -5.671091 -0.305144 0.080701


