%chk=000076985.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076985

0 1
 S    3.066500     -0.5347000     -0.4547000    
 O   -3.668900     -0.4103000      0.3063000    
 C    1.318500     -0.2319000     -0.2841000    
 C   -1.417700      0.2421000     -1.6899999E-02
 C   0.8260000       1.071000     -0.3572000    
 C   0.4429000      -1.297800     -7.7399999E-02
 C  -0.5421000       1.308100     -0.2235000    
 C  -0.9252000      -1.060900      5.6200001E-02
 C   -2.844000      0.4891000      0.1225000    
 C    3.744100      0.4253000      0.9287000    
 H    1.488500       1.916500     -0.5248000    
 H   0.8085000      -2.320000     -1.7300000E-02
 H  -0.9110000       2.328800     -0.2842000    
 H   -1.588800      -1.906600      0.2167000    
 H   -3.173300       1.540000      5.6100000E-02
 H    3.281100      0.1155000       1.869600    
 H    3.578400       1.494800      0.7762000    
 H    4.820800      0.2475000      0.9939000    


%chk=000076985-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000076985

0 1
S 3.017845 -0.942451 0.317518
O -3.848820 -0.298089 -0.337061
C 1.275167 -0.420358 0.190131
C -1.486698 0.197402 -0.031772
C 0.839987 0.924819 0.297159
C 0.322812 -1.458220 -0.029576
C -0.532315 1.224359 0.186061
C -1.040587 -1.150882 -0.138564
C -2.921846 0.537041 -0.144172
C 3.919587 0.681202 0.587235
H 1.554809 1.735614 0.465528
H 0.661228 -2.497065 -0.113144
H -0.868463 2.265993 0.269251
H -1.785639 -1.936114 -0.307038
H -3.151708 1.629382 -0.043103
H 3.590923 1.158877 1.523116
H 3.774459 1.354007 -0.272070
H 4.983558 0.410984 0.666601


