%chk=000127739.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127739

0 1
 S    1.984700       1.488700     -0.7759000    
 O    1.473100      -1.840400       1.306700    
 C    1.165700      0.3737000      0.4038000    
 C    1.463300      -1.106900      7.6399997E-02
 C   0.3175000      -1.625700     -0.8130000    
 C  -0.3296000      0.4114000      0.2631000    
 C  -0.8055000     -0.7182000     -0.4133000    
 C   -1.202400       1.394400      0.7053000    
 C   -2.156200     -0.8789000     -0.6759000    
 C   -2.566800       1.234900      0.4545000    
 C   -3.040200      0.1066000     -0.2326000    
 C    3.696400       1.160300     -0.2990000    
 H    1.449900      0.6306000       1.430400    
 H    2.435800      -1.291500     -0.3863000    
 H   7.4500002E-02  -2.673800     -0.6155000    
 H   0.5423000      -1.475500      -1.873900    
 H  -0.8399000       2.270200       1.232800    
 H   -2.524000      -1.747500      -1.211600    
 H    1.632600      -2.774300       1.087300    
 H   -3.269300       1.992400      0.7912000    
 H   -4.104900      1.5000000E-03 -0.4228000    
 H    4.031200      0.1861000     -0.6614000    
 H    3.816700       1.216100      0.7861000    
 H    4.338300       1.921600     -0.7515000    


%chk=000127739-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127739

0 1
S 2.011437 1.441904 -0.878239
O 1.523096 -1.924648 1.334169
C 1.179769 0.244710 0.364776
C 1.475321 -1.241488 0.023695
C 0.272519 -1.706868 -0.849128
C -0.325032 0.358312 0.243112
C -0.852276 -0.766697 -0.441848
C -1.171663 1.389039 0.697013
C -2.237605 -0.877295 -0.669736
C -2.564629 1.278695 0.469696
C -3.093605 0.153053 -0.208045
C 3.778585 1.346600 -0.230589
H 1.575398 0.500207 1.361966
H 2.442380 -1.372618 -0.499960
H 0.030594 -2.775674 -0.694389
H 0.514563 -1.576633 -1.922424
H -0.759762 2.261149 1.216538
H -2.653648 -1.745750 -1.193954
H 1.481618 -2.904003 1.191979
H -3.239400 2.067298 0.821103
H -4.174370 0.079049 -0.374789
H 4.171565 0.320431 -0.311798
H 3.819216 1.685939 0.816890
H 4.379128 2.021086 -0.861138


