%chk=000061039.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000061039

0 1
 S   -4.327000     -0.5676000     -0.1615000    
 S    2.536100     -0.5869000       2.136800    
 P    2.672800     -8.2300000E-02  0.2578000    
 O    1.455300      0.7932000     -0.3584000    
 O    3.953600      0.8419000     -0.1389000    
 O    2.810900      -1.284500     -0.8298000    
 O   -5.073300      0.6447000     -0.6448000    
 C   0.1235000      0.4803000     -0.3130000    
 C   -2.583100     -0.1570000     -0.2207000    
 C  -0.2706000     -0.8534000     -0.2934000    
 C  -0.8243000       1.498200     -0.2868000    
 C   -1.627600      -1.173000     -0.2472000    
 C   -2.181300       1.178700     -0.2405000    
 C   -4.499400     -0.6137000       1.642300    
 C    4.041300       2.171700      0.3450000    
 C    3.793000      -2.290100     -0.6470000    
 H   0.4413000      -1.669800     -0.3207000    
 H  -0.5152000       2.539500     -0.3006000    
 H   -1.925500      -2.218400     -0.2339000    
 H   -2.905300       1.988600     -0.2152000    
 H   -3.880700      -1.417200       2.049000    
 H   -5.547000     -0.8086000       1.884000    
 H   -4.201900      0.3456000       2.072900    
 H    4.948400       2.629300     -5.7500001E-02
 H    4.099000       2.173900       1.436100    
 H    3.176500       2.752900      1.5500000E-02
 H    3.926200      -2.822900      -1.591800    
 H    3.459600      -2.999300      0.1145000    
 H    4.747300      -1.844700     -0.3536000    


%chk=000061039-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000061039

0 1
S -4.574900 -0.401475 -0.180753
S 2.538716 -0.209634 2.255417
P 2.681570 0.047630 0.217728
O 1.378033 0.841331 -0.623452
O 3.993910 0.981962 -0.384011
O 2.835099 -1.354126 -0.772995
O -5.215301 1.146181 -0.165653
C 0.014913 0.475841 -0.458671
C -2.689340 -0.102748 -0.265395
C -0.399799 -0.875907 -0.491399
C -0.909204 1.537143 -0.343713
C -1.778526 -1.167308 -0.392306
C -2.286444 1.242370 -0.258087
C -4.617025 -0.920872 1.679461
C 4.377141 2.222308 0.332080
C 3.893750 -2.336315 -0.429215
H 0.340121 -1.673203 -0.614398
H -0.542713 2.567644 -0.333087
H -2.118797 -2.208720 -0.428012
H -3.057406 2.021155 -0.186552
H -4.044058 -1.851338 1.810294
H -5.679906 -1.056959 1.926780
H -4.177706 -0.083187 2.239256
H 5.354836 2.494398 -0.091248
H 4.463700 2.038140 1.418693
H 3.637924 3.017065 0.133580
H 3.686199 -3.203083 -1.073264
H 3.830490 -2.623550 0.636529
H 4.887324 -1.915644 -0.659006


