%chk=000017242.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017242

0 1
 S   -3.411300      0.2415000      0.4836000    
 S   0.4951000      0.2801000      -1.516900    
 S    3.971400     -0.2501000      -1.622400    
 P    2.351600     -5.4499999E-02 -0.5327000    
 O    2.505000       1.113300      0.6017000    
 O    2.134600      -1.322600      0.4766000    
 O   -3.466800      -1.199100      0.8836000    
 C   -2.141700      0.3855000     -0.8157000    
 C  -0.7599000      0.1617000     -0.2262000    
 C   -4.812000      0.5634000     -0.6133000    
 C   -6.127800      0.5273000      0.1365000    
 C    2.720300       2.461400      0.2182000    
 C    1.946000      -2.628600     -4.3000001E-02
 C    2.823600       3.317400       1.462400    
 C    1.771800      -3.596700       1.107700    
 H   -2.367700     -0.3561000      -1.589700    
 H   -2.223900       1.388700      -1.247900    
 H  -0.6917000     -0.8267000      0.2398000    
 H  -0.5411000      0.9062000      0.5467000    
 H   -4.674000       1.550200      -1.066000    
 H   -4.815400     -0.1869000      -1.410200    
 H   -6.300000     -0.4544000      0.5903000    
 H   -6.148700       1.274700      0.9367000    
 H   -6.958700      0.7359000     -0.5446000    
 H    3.645600       2.541000     -0.3589000    
 H    1.887000       2.803200     -0.4024000    
 H    1.059500      -2.645200     -0.6835000    
 H    2.815400      -2.921400     -0.6380000    
 H    2.989300       4.366600       1.202500    
 H    1.908600       3.241400       2.059200    
 H    3.647400       2.976100       2.098000    
 H    1.624000      -4.616500      0.7417000    
 H    2.649300      -3.579600       1.762400    
 H   0.9107000      -3.313300       1.721900    


%chk=000017242-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000017242

0 1
S -3.261314 0.355350 0.802821
S 0.405064 1.391870 -1.709419
S 3.587546 -0.346293 -2.210697
P 2.197868 0.234867 -0.800375
O 2.707747 1.227437 0.526759
O 1.442844 -0.934738 0.223770
O -2.588006 -1.138938 1.177309
C -2.167805 0.926792 -0.723239
C -0.780331 1.289504 -0.211352
C -4.846295 -0.111142 -0.258172
C -5.629243 -1.172026 0.512218
C 3.623353 2.364799 0.218309
C 0.963320 -2.216285 -0.391109
C 3.956712 3.004663 1.562448
C 0.190171 -2.939524 0.706734
H -2.149404 0.034229 -1.370494
H -2.703105 1.762971 -1.204128
H -0.385065 0.494271 0.446426
H -0.751368 2.258798 0.308252
H -5.388877 0.837348 -0.409418
H -4.452275 -0.491419 -1.215656
H -4.954524 -2.001815 0.791661
H -6.082647 -0.766100 1.433613
H -6.439219 -1.578721 -0.120450
H 4.524447 1.972250 -0.290051
H 3.105018 3.072927 -0.457749
H 0.317674 -1.981669 -1.260797
H 1.848698 -2.780742 -0.737896
H 4.638829 3.861091 1.407659
H 3.043032 3.369757 2.061036
H 4.451567 2.277106 2.227183
H -0.147395 -3.922092 0.325560
H 0.836006 -3.111812 1.584549
H -0.697520 -2.358816 1.012798


