%chk=000086446.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086446

0 1
 S  -0.3528000       1.995100     -0.3354000    
 O   -1.041800      -1.280600     -5.6899998E-02
 O  -0.2801000       3.084800      0.6227000    
 O  -0.6124000       2.245300      -1.743500    
 O   -2.731000     -0.4788000      -1.413500    
 C   -1.729400      0.8867000      0.2234000    
 C   -1.906300      0.9942000       1.693300    
 C   -2.850000       1.697800      0.7625000    
 C   -1.911900     -0.3365000     -0.5158000    
 C    1.091400       1.027300     -0.1742000    
 C    1.528800      0.2435000      -1.241800    
 C    1.808000       1.038300       1.022400    
 C   -1.493000      -2.634800     -0.1607000    
 C    2.682900     -0.5295000      -1.112800    
 C    2.962200      0.2656000       1.151400    
 C    3.399500     -0.5183000      8.3700001E-02
 C  -0.4069000      -3.565300      0.3575000    
 C   -2.791400      -2.791200      0.6161000    
 C    4.634000      -1.343500      0.2214000    
 H   -1.247200       1.595600       2.305100    
 H   -2.293200      0.1335000       2.229500    
 H   -3.856700       1.300900      0.6855000    
 H   -2.820700       2.779100      0.7228000    
 H   0.9831000      0.2155000      -2.180800    
 H    1.483300       1.636500       1.869000    
 H   -1.662500      -2.869200      -1.219000    
 H    3.013500      -1.136100      -1.951700    
 H    3.512200      0.2830000       2.088600    
 H  -0.7061000      -4.614500      0.2752000    
 H   0.5202000      -3.419600     -0.2074000    
 H  -0.1729000      -3.346400       1.405200    
 H   -3.105900      -3.839800      0.6407000    
 H   -3.613700      -2.216800      0.1797000    
 H   -2.673400      -2.443000       1.648300    
 H    4.782200      -1.663400       1.258400    
 H    4.571800      -2.251700     -0.3878000    
 H    5.508600     -0.7671000     -9.6100003E-02


%chk=000086446-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000086446

0 1
S -0.369360 1.556746 -0.657556
O -1.543780 -1.194749 -0.302179
O -0.134954 3.135430 -0.260144
O -0.666878 1.127687 -2.201613
O -3.450753 -0.707971 0.956277
C -1.874147 1.051317 0.463545
C -1.976890 1.834782 1.785487
C -2.890500 2.194050 0.622637
C -2.378747 -0.353237 0.404189
C 1.166057 0.631399 -0.055551
C 1.533633 -0.550280 -0.715672
C 1.934127 1.219709 0.961320
C -1.995381 -2.635050 -0.462580
C 2.724623 -1.188621 -0.307004
C 3.117835 0.557727 1.357644
C 3.528723 -0.649915 0.733482
C -1.353841 -3.117524 -1.764219
C -1.573692 -3.419755 0.785983
C 4.824622 -1.327776 1.140129
H -1.166887 2.539656 1.995951
H -2.381245 1.276104 2.633781
H -3.937709 1.883530 0.647926
H -2.655543 3.121537 0.091594
H 0.912014 -0.937535 -1.527695
H 1.633094 2.175797 1.401307
H -3.097832 -2.608719 -0.543741
H 3.039266 -2.112044 -0.807196
H 3.735411 0.991584 2.152563
H -1.717432 -4.133420 -2.002131
H -1.612196 -2.445782 -2.599886
H -0.254014 -3.158697 -1.671467
H -1.857115 -4.482128 0.671860
H -2.074723 -3.025389 1.685735
H -0.479841 -3.364862 0.928123
H 5.074197 -1.126881 2.196399
H 4.772944 -2.421632 1.000847
H 5.669312 -0.958487 0.526853


