%chk=000017080.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017080

0 1
 S   -1.853300     -0.7803000     -0.9886000    
 O  -0.5008000      -1.004000       1.263800    
 C    2.053100     -0.2763000      0.2695000    
 C    3.316800      0.1885000     -0.4609000    
 C   0.8157000     -0.2459000     -0.6290000    
 C   -3.179400     -0.4147000      0.1815000    
 C    4.542100      0.1148000      0.4508000    
 C   -3.007100      0.9670000      0.8295000    
 C  -0.4479000     -0.6952000      7.9899997E-02
 C   -4.516200     -0.5077000     -0.5506000    
 C    5.807500      0.5319000     -0.2817000    
 C   -3.030500       2.122100     -0.1643000    
 H    2.200800      -1.295800      0.6476000    
 H    1.883200      0.3601000       1.147100    
 H    3.180000       1.217400     -0.8148000    
 H    3.478400     -0.4396000      -1.345400    
 H   -3.168100      -1.175800      0.9701000    
 H   0.6577000      0.7757000     -0.9948000    
 H   0.9841000     -0.9014000      -1.491700    
 H    4.397500      0.7647000       1.321600    
 H    4.666800     -0.9077000      0.8260000    
 H   -3.820600       1.120200       1.550500    
 H   -2.083700       1.019200       1.416200    
 H   -5.341100     -0.2351000      0.1172000    
 H   -4.703500      -1.534700     -0.8863000    
 H   -4.570300      0.1405000      -1.431700    
 H    5.728700       1.561400     -0.6452000    
 H    5.998400     -0.1218000      -1.138700    
 H    6.670400      0.4734000      0.3890000    
 H   -3.979900       2.182700     -0.7033000    
 H   -2.912200       3.067200      0.3775000    
 H   -2.215600       2.067600     -0.8911000    


%chk=000017080-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000017080

0 1
S -1.638429 0.080002 -0.942592
O -0.400304 0.392465 1.490435
C 2.258021 -0.137971 0.226957
C 3.624019 0.208921 -0.404349
C 1.089921 0.621688 -0.450322
C -3.083277 -0.107349 0.311785
C 4.798095 -0.553900 0.251544
C -3.644297 1.275818 0.712072
C -0.242930 0.384045 0.247651
C -4.114957 -1.076071 -0.289602
C 6.165503 -0.204506 -0.374377
C -4.335030 2.064199 -0.420350
H 2.078671 -1.228875 0.150252
H 2.265061 0.106692 1.305737
H 3.804627 1.301018 -0.317465
H 3.603213 -0.018456 -1.490790
H -2.590284 -0.555380 1.194108
H 1.292780 1.712140 -0.401971
H 1.010647 0.356583 -1.520709
H 4.816931 -0.327829 1.337013
H 4.617434 -1.644664 0.164485
H -4.368467 1.106117 1.536964
H -2.820500 1.875078 1.142576
H -4.958478 -1.198406 0.416682
H -3.670391 -2.069708 -0.471347
H -4.526051 -0.704600 -1.244608
H 6.384087 0.875364 -0.272962
H 6.182555 -0.449860 -1.453175
H 6.986946 -0.762194 0.111691
H -5.228521 1.537818 -0.802109
H -4.662335 3.054841 -0.056065
H -3.643261 2.225381 -1.267459


