%chk=000081843.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081843

0 1
 S    2.359000       1.611700       1.271600    
 O   -2.640400      0.9916000      0.2358000    
 C   0.8285000       2.121400      0.5140000    
 C   -1.499000       1.759800      7.7699997E-02
 C  -0.3209000       1.347500      0.6737000    
 C   0.7802000       3.294700     -0.2387000    
 C   -1.566900       2.919900     -0.6723000    
 C    2.615900      1.9300001E-02  0.5026000    
 C   -2.522800     -0.3554000      8.2000002E-02
 C  -0.4176000       3.694000     -0.8318000    
 C    2.739400     -7.0299998E-02 -0.8816000    
 C    2.692200      -1.126400       1.290800    
 C   -1.798200     -0.8747000     -0.9909000    
 C   -3.128400      -1.217000      0.9967000    
 C    2.940500      -1.313400      -1.481500    
 C    2.893500      -2.369500      0.6910000    
 C   -1.679100      -2.255500      -1.148800    
 C   -3.009100      -2.597800      0.8389000    
 C    3.017600      -2.463000     -0.6953000    
 C   -2.284400      -3.117000     -0.2339000    
 H  -0.2887000      0.4501000       1.286500    
 H    1.665800       3.910600     -0.3749000    
 H   -2.498500       3.231600      -1.135000    
 H  -0.4553000       4.607400      -1.418200    
 H    2.688700      0.8126000      -1.513800    
 H    2.596600      -1.072500       2.372300    
 H   -1.334600     -0.2285000      -1.731500    
 H   -3.694000     -0.8183000       1.834500    
 H    3.037900      -1.386300      -2.560700    
 H    2.952700      -3.264800       1.303000    
 H   -1.118100      -2.660000      -1.986200    
 H   -3.480400      -3.268500       1.551300    
 H    3.173800      -3.431000      -1.162400    
 H   -2.192100      -4.192000     -0.3573000    


%chk=000081843-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000081843

0 1
S 2.497856 1.671797 1.236421
O -2.626610 0.966637 -0.021662
C 0.890769 2.175829 0.481153
C -1.442594 1.739314 -0.047719
C -0.216256 1.297328 0.497806
C 0.775181 3.486269 -0.036213
C -1.584156 3.049340 -0.562853
C 2.801798 0.033290 0.438153
C -2.601519 -0.452618 -0.050902
C -0.473936 3.917775 -0.543836
C 2.553681 -0.182699 -0.938425
C 3.367379 -0.992274 1.231902
C -1.657358 -1.196336 -0.796841
C -3.656576 -1.093056 0.635473
C 2.862081 -1.435124 -1.515113
C 3.690159 -2.236588 0.641972
C -1.774087 -2.603861 -0.836284
C -3.763162 -2.499560 0.581096
C 3.435086 -2.464253 -0.729885
C -2.821430 -3.261697 -0.150269
H -0.124067 0.299300 0.935002
H 1.645042 4.149771 -0.050077
H -2.553896 3.360803 -0.961322
H -0.574104 4.932979 -0.942280
H 2.131392 0.620481 -1.551608
H 3.544381 -0.822754 2.299354
H -0.852130 -0.693092 -1.340766
H -4.372940 -0.483031 1.193788
H 2.670425 -1.599233 -2.581691
H 4.129711 -3.027735 1.259487
H -1.042473 -3.183736 -1.409737
H -4.580456 -2.998899 1.112953
H 3.680704 -3.431067 -1.182652
H -2.904093 -4.353001 -0.186826


