%chk=000079655.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079655

0 1
 S   -3.558600     -0.9500000      0.3550000    
 O    2.912400     -7.5199999E-02  0.1607000    
 O    1.184400      -1.889900     -0.5734000    
 O    2.288600       2.046100     -0.5254000    
 N   -1.011700      -1.333800     -0.1220000    
 N   -1.641200      0.8887000      0.3999000    
 C   0.6740000      0.3735000     -6.3500002E-02
 C   -1.927800     -0.3588000      0.2078000    
 C   0.3334000      -1.056600     -0.2808000    
 C  -0.3163000       1.221300      0.2533000    
 C   -4.453700      0.5392000     -0.1368000    
 C    2.033800      0.9027000     -0.1780000    
 C    4.294400      0.2919000      9.8399997E-02
 C   -5.950900      0.2985000     -9.7099997E-02
 C    5.139300     -0.8976000      0.5020000    
 H   -1.334400      -2.287800     -0.2521000    
 H   -4.211600       1.362300      0.5433000    
 H   -4.153600      0.8289000      -1.149100    
 H  -0.1101000       2.273700      0.4252000    
 H    4.545700      0.5951000     -0.9241000    
 H    4.481100       1.128000      0.7817000    
 H   -6.248500     -0.5000000     -0.7852000    
 H   -6.289900      3.4800000E-02  0.9106000    
 H   -6.482700       1.207700     -0.3969000    
 H    6.204100     -0.6518000      0.4649000    
 H    4.886400      -1.223300       1.516400    
 H    4.949000      -1.747900     -0.1614000    


%chk=000079655-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000079655

0 1
S -3.738836 -1.020103 -0.031240
O 3.059978 -0.146912 0.146967
O 1.143078 -2.203193 0.184586
O 2.298404 2.049989 0.019557
N -1.052098 -1.445481 0.078754
N -1.710095 0.836287 -0.050893
C 0.689040 0.235818 0.055065
C -2.014689 -0.466101 0.000558
C 0.385849 -1.202006 0.112962
C -0.367377 1.152797 -0.021724
C -4.630703 0.661855 -0.143446
C 2.062920 0.811085 0.070816
C 4.462692 0.374754 0.163338
C -6.142277 0.406984 -0.159749
C 5.373394 -0.845257 0.245904
H -1.306973 -2.440032 0.117000
H -4.301585 1.250292 0.725757
H -4.266317 1.150692 -1.059177
H -0.124622 2.219422 -0.063683
H 4.622935 0.968394 -0.755142
H 4.571722 1.050494 1.031295
H -6.447616 -0.201520 -1.028969
H -6.483654 -0.099599 0.759993
H -6.667784 1.377099 -0.225532
H 6.430678 -0.522663 0.260766
H 5.169609 -1.425155 1.161705
H 5.219927 -1.508239 -0.622066


