%chk=000153701.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000153701

0 1
 S    7.000000      -1.078200     -0.8048000    
 O   -2.236500     -0.5789000       2.099700    
 O   -5.655900      -1.350900      -1.125400    
 O   -2.134000       1.697500      -2.124300    
 O  -0.9831000       2.343000      0.9499000    
 C   -2.175500      0.5648000     -9.4999997E-03
 C   -2.768800     -0.3205000      0.8717000    
 C   -2.717800      0.8252000      -1.254600    
 C   -3.945300     -0.9680000      0.4945000    
 C   -4.508000     -0.7188000     -0.7572000    
 C  -0.9249000       1.252600      0.3923000    
 C   -3.894300      0.1778000      -1.631900    
 C    2.857900      0.6348000      9.3999997E-02
 C   0.3665000      0.5864000      6.4800002E-02
 C    1.539900       1.180000      0.3788000    
 C    3.009400     -0.7291000     -0.1561000    
 C    3.970200       1.475900      7.0000000E-02
 C    5.385600     -0.4105000     -0.4545000    
 C    4.273200      -1.251700     -0.4305000    
 C    5.234200      0.9534000     -0.2044000    
 C   -2.665600      0.2488000       3.178600    
 C   -6.230400      -2.254900     -0.1828000    
 C    7.203500      -2.278600      0.5415000    
 H   -4.375000      -1.654900       1.216300    
 H   -4.333500      0.3713000      -2.607400    
 H   0.3025000     -0.3661000     -0.4485000    
 H    1.533300       2.150000      0.8712000    
 H    2.175500      -1.424600     -0.1301000    
 H    3.871600       2.541900      0.2611000    
 H    4.367200      -2.317100     -0.6254000    
 H    6.089400       1.624400     -0.2189000    
 H   -1.348200       2.104100      -1.725300    
 H   -3.725200      7.4100003E-02   3.390200    
 H   -2.499900       1.307300       2.957900    
 H   -2.084700     -1.7600000E-02   4.065800    
 H   -5.564500      -3.100100      2.1800000E-02
 H   -7.136400      -2.665800     -0.6402000    
 H   -6.540700      -1.739000      0.7323000    
 H    6.482100      -3.094200      0.4459000    
 H    7.073400      -1.789000       1.510500    
 H    8.211100      -2.700200      0.4954000    


%chk=000153701-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000153701

0 1
S 7.178947 -0.728559 0.667499
O -1.553007 -1.201176 1.017814
O -6.158626 -1.066160 -0.580591
O -3.323466 2.608303 -1.598218
O -0.938694 2.615504 -0.986498
C -2.300361 0.738797 -0.370361
C -2.559354 -0.513429 0.281603
C -3.445989 1.377378 -1.011494
C -3.811489 -1.141798 0.237155
C -4.882282 -0.514154 -0.462941
C -0.985988 1.395854 -0.504795
C -4.705539 0.744687 -1.064608
C 2.804674 0.797529 -0.041820
C 0.272335 0.702755 -0.190827
C 1.476506 1.359748 -0.281399
C 3.031885 -0.571250 0.288696
C 3.946550 1.648482 -0.145119
C 5.451070 -0.202174 0.403531
C 4.329186 -1.065764 0.508120
C 5.246536 1.164597 0.072901
C -1.333887 -0.665800 2.379775
C -6.397704 -2.386207 0.014283
C 7.004901 -2.560029 1.036808
H -3.923996 -2.097546 0.753894
H -5.534805 1.239270 -1.574020
H 0.197126 -0.351093 0.088368
H 1.432781 2.421249 -0.566014
H 2.184320 -1.260746 0.368691
H 3.802857 2.704838 -0.401921
H 4.459009 -2.123384 0.756842
H 6.103917 1.841081 -0.014385
H -2.322454 2.908964 -1.441203
H -2.274921 -0.701052 2.960763
H -0.954985 0.373219 2.345360
H -0.581401 -1.324284 2.840068
H -5.727591 -3.149767 -0.423986
H -7.443095 -2.622653 -0.230843
H -6.268948 -2.360292 1.113244
H 6.553926 -3.088259 0.182570
H 6.417583 -2.719829 1.954241
H 8.032772 -2.922251 1.191216


