%chk=000077812.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077812

0 1
 S   -3.701900     -0.6892000     -0.6389000    
 O    4.154800      0.9426000     -0.1719000    
 O   -1.288900      -2.269700     -0.1091000    
 C   0.2760000     -0.5319000     -7.4199997E-02
 C   -1.082900      -1.048900     -4.0500000E-02
 C   0.5290000      0.7301000     -0.6116000    
 C    1.326400      -1.298300      0.4309000    
 C   -2.276200     -0.1575000      7.5300001E-02
 C    2.883000      0.4594000     -0.1390000    
 C    1.832400       1.225700     -0.6441000    
 C    2.629900     -0.8027000      0.3985000    
 C   -2.329600       1.027100      0.6920000    
 C   -3.643100       1.568700      0.5852000    
 C   -4.490100      0.7375000     -0.1143000    
 C    5.181100      0.1071000      0.3614000    
 H  -0.2557000       1.340000      -1.049500    
 H    1.147500      -2.282000      0.8576000    
 H    2.025000       2.205900      -1.071900    
 H    3.398100      -1.449600      0.8083000    
 H   -1.519900       1.514600       1.219000    
 H   -3.952400       2.517500       1.004200    
 H   -5.534400      0.8994000     -0.3412000    
 H    5.279000     -0.8233000     -0.2083000    
 H    5.036300     -7.4800000E-02   1.431700    
 H    6.126900      0.6483000      0.2542000    


%chk=000077812-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000077812

0 1
S -3.918221 -0.836823 -0.445677
O 4.230890 0.954174 -0.105807
O -1.308968 -2.340773 -0.177024
C 0.257713 -0.511003 -0.074844
C -1.127714 -1.079152 -0.093121
C 0.585703 0.784493 -0.568160
C 1.307386 -1.341805 0.397034
C -2.291275 -0.172990 0.008855
C 2.947523 0.402851 -0.068756
C 1.914850 1.236410 -0.571439
C 2.642165 -0.897102 0.415559
C -2.411906 1.128201 0.505631
C -3.759377 1.624594 0.517877
C -4.680661 0.703638 0.032366
C 5.345489 0.131667 0.379770
H -0.194468 1.421889 -0.995779
H 1.051366 -2.347972 0.745012
H 2.182958 2.220934 -0.965997
H 3.425824 -1.557227 0.798419
H -1.560252 1.694335 0.888300
H -4.036633 2.618643 0.876315
H -5.758145 0.817533 -0.077888
H 5.450018 -0.793439 -0.218285
H 5.217099 -0.124778 1.448615
H 6.238936 0.759702 0.252826


