%chk=000060256.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060256

0 1
 S   -4.923500      -1.121700     -0.7619000    
 O    6.139300     -0.4981000     -0.1193000    
 C   -2.362000      0.1872000     -0.5878000    
 C   -1.669100       1.022800      0.5204000    
 C  -0.1256000      0.9952000      0.5685000    
 C   0.4665000     -0.4168000      0.3489000    
 C   -3.810700      0.1172000     -2.5599999E-02
 C   -1.690800      -1.197400     -0.7399000    
 C   -2.283400      0.4907000       1.833300    
 C  -0.1693000      -1.123600     -0.8604000    
 C   -3.640400     -0.1137000       1.476000    
 C   0.5074000       1.996300     -0.4105000    
 C   -2.381500      0.9131000      -1.945700    
 C    1.982800     -0.4034000      0.2234000    
 C    2.007800       2.114100     -0.1554000    
 C    2.696400      0.7790000     -4.5899998E-02
 C    2.692700      -1.608100      0.3727000    
 C    4.096100      0.7338000     -0.1521000    
 C   -6.398000     -0.7552000      0.2152000    
 C    4.081800      -1.641300      0.2548000    
 C    4.783500     -0.4701000     -8.5000005E-03
 H   -1.993600       2.070000      0.4301000    
 H   0.1699000       1.328200       1.575600    
 H   0.2318000      -1.008100       1.245100    
 H   -4.286800       1.096800     -0.1705000    
 H   -2.084100      -1.716000      -1.623200    
 H   -1.929000      -1.837500      0.1188000    
 H   -2.392800       1.302900       2.560900    
 H   -1.657700     -0.2743000       2.305500    
 H   0.2140000      -2.148700     -0.9418000    
 H   0.1157000     -0.6278000      -1.795700    
 H   -3.638600      -1.177500       1.742700    
 H   -4.438600      0.3682000       2.051500    
 H   4.9500000E-02   2.986300     -0.3012000    
 H   0.3530000       1.687200      -1.447600    
 H   -2.765900       1.934200      -1.845700    
 H   -1.392800      0.9781000      -2.402700    
 H   -3.023300      0.3899000      -2.663100    
 H    2.175600       2.662600      0.7800000    
 H    2.456200       2.700500     -0.9665000    
 H    2.161900      -2.533500      0.5847000    
 H    4.647800       1.651700     -0.3448000    
 H   -6.267200      -1.066800       1.254200    
 H   -7.243100      -1.312600     -0.1987000    
 H   -6.638700      0.3103000      0.1725000    
 H    4.609000      -2.584100      0.3726000    
 H    6.460000      0.4018000     -0.3019000    


%chk=000060256-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000060256

0 1
S -4.880393 -1.251539 -0.735024
O 6.240483 -0.577254 -0.212167
C -2.386485 0.183450 -0.499974
C -1.654867 1.025127 0.610611
C -0.099454 1.026552 0.581373
C 0.491448 -0.397892 0.374091
C -3.811553 0.064081 0.129886
C -1.709385 -1.212080 -0.647737
C -2.230399 0.499311 1.969934
C -0.180461 -1.111926 -0.835457
C -3.598571 -0.180656 1.645122
C 0.517641 2.012753 -0.442334
C -2.471067 0.898236 -1.869953
C 2.015794 -0.377154 0.234028
C 2.033611 2.156886 -0.196562
C 2.739304 0.809509 -0.068800
C 2.740142 -1.589469 0.387960
C 4.148012 0.750428 -0.222596
C -6.569562 -0.708383 -0.103393
C 4.137310 -1.653204 0.242982
C 4.842112 -0.468607 -0.069826
H -1.989477 2.077774 0.486398
H 0.230711 1.380148 1.584395
H 0.244971 -1.008014 1.270001
H -4.343064 1.023339 -0.033219
H -2.164036 -1.748718 -1.503018
H -1.916035 -1.824233 0.252944
H -2.339689 1.331426 2.688693
H -1.538754 -0.229265 2.431975
H 0.248868 -2.126463 -0.942894
H 0.066977 -0.575777 -1.772376
H -3.562435 -1.266171 1.845613
H -4.429296 0.232726 2.244324
H 0.029697 3.002900 -0.351401
H 0.342294 1.663142 -1.476715
H -2.802004 1.947638 -1.748014
H -1.501919 0.911149 -2.397402
H -3.203539 0.383040 -2.519158
H 2.191107 2.731336 0.741112
H 2.502410 2.751098 -1.004886
H 2.191522 -2.507651 0.633538
H 4.699994 1.671371 -0.460957
H -6.640808 -0.847493 0.986735
H -7.312096 -1.348803 -0.605044
H -6.754880 0.345542 -0.368656
H 4.690233 -2.588936 0.365333
H 6.637789 0.302526 -0.428483


