%chk=000099368.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099368

0 1
 S  -1.6000000E-03  -1.837700      0.3712000    
 O    1.209300     -0.7785000      0.2718000    
 O   -1.216400     -0.7821000      0.2710000    
 O  -3.0000001E-04  -2.652000     -0.8898000    
 C    3.524400     -0.2804000      5.1500000E-02
 C   -3.530900     -0.2762000      5.0400000E-02
 C    2.499400      -1.360900      0.1321000    
 C   -2.503500      -1.366800      0.1312000    
 C    3.883800      0.2490000      -1.188000    
 C   -4.121700      0.2007000       1.215400    
 C    4.123200      0.2013000       1.215700    
 C   -3.882500      0.2482000      -1.188500    
 C    4.842300       1.259600      -1.263400    
 C   -5.076500       1.214700       1.140400    
 C    5.081600       1.212100       1.140200    
 C   -4.837400       1.262400      -1.263200    
 C    5.441000       1.741100     -9.9500000E-02
 C   -5.434300       1.745600     -9.8700002E-02
 H    2.546000      -1.980400     -0.7733000    
 H    2.711800      -2.016300      0.9872000    
 H   -2.718600      -2.020600      0.9869000    
 H   -2.552000      -1.984500     -0.7753000    
 H    3.422900     -0.1160000      -2.102000    
 H   -3.848800     -0.2040000       2.186100    
 H    3.850100     -0.2011000       2.187600    
 H   -3.422200     -0.1190000      -2.101600    
 H    5.121900       1.672100      -2.228500    
 H   -5.540900       1.591500       2.047000    
 H    5.547500       1.587600       2.046500    
 H   -5.115600       1.676400      -2.227900    
 H    6.187000       2.528300     -0.1582000    
 H   -6.177500       2.535400     -0.1570000    


%chk=000099368-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000099368

0 1
S -0.261561 -2.351893 1.749359
O 1.618217 -2.456323 1.835826
O -0.619207 -0.534169 1.693119
O -0.629246 -2.920765 0.274258
C 2.609021 -1.162541 -0.064930
C -2.061374 0.755950 0.204017
C 2.291841 -2.527741 0.518896
C -0.718159 0.075168 0.325111
C 2.474474 -0.934356 -1.456665
C -3.214717 0.005538 -0.142772
C 3.063903 -0.108909 0.768264
C -2.188639 2.146225 0.447572
C 2.800505 0.324363 -2.013117
C -4.473827 0.635364 -0.242657
C 3.383664 1.150499 0.215117
C -3.448151 2.779419 0.345770
C 3.256652 1.370102 -1.177995
C -4.593208 2.024792 0.001372
H 1.684560 -3.132300 -0.185613
H 3.211526 -3.094297 0.762232
H -0.604524 -0.727474 -0.430628
H 0.128531 0.778878 0.246975
H 2.108496 -1.739362 -2.106019
H -3.118597 -1.070829 -0.331593
H 3.146394 -0.280042 1.847034
H -1.301129 2.730396 0.719658
H 2.692723 0.489353 -3.091006
H -5.359251 0.048908 -0.512448
H 3.732408 1.959273 0.867202
H -3.536773 3.855093 0.534606
H 3.507506 2.346898 -1.606650
H -5.570559 2.514284 -0.076994


