%chk=000137832.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000137832

0 1
 S    3.783200      0.9993000       1.115100    
 O   -2.430600       1.287500     -0.1034000    
 N    2.143600      5.2900001E-02 -0.9129000    
 C   -1.444700      0.3492000     -8.6000003E-02
 C  -0.1574000      0.6819000     -0.5079000    
 C   0.8531000     -0.2796000     -0.4885000    
 C   -1.721400     -0.9449000      0.3552000    
 C   0.5762000      -1.573600     -4.7200002E-02
 C  -0.7109000      -1.906300      0.3747000    
 C   -3.723100      0.8796000      0.3428000    
 C    2.832000      0.4540000     -4.2100001E-02
 H   5.2200001E-02   1.691700     -0.8530000    
 H   -2.698000      -1.271000      0.6965000    
 H    1.355000      -2.331800     -2.9999999E-02
 H  -0.9255000      -2.914300      0.7176000    
 H   -3.710200      0.5854000       1.397900    
 H   -4.143200      9.9299997E-02 -0.3007000    
 H   -4.382500       1.749900      0.2618000    


%chk=000137832-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000137832

0 1
S 4.838269 1.069680 -0.360888
O -2.509193 1.302430 0.027828
N 2.149988 0.199941 -0.105373
C -1.549377 0.284984 0.096157
C -0.210463 0.722770 -0.033145
C 0.840546 -0.223921 0.020419
C -1.845241 -1.089833 0.279708
C 0.559610 -1.608939 0.204629
C -0.779729 -2.019204 0.331095
C -3.917916 0.919484 0.157022
C 3.292892 0.570081 -0.212729
H -0.003047 1.786731 -0.173346
H -2.875408 -1.441625 0.380824
H 1.382045 -2.328211 0.245400
H -1.003534 -3.081838 0.472920
H -4.119452 0.454840 1.141447
H -4.223506 0.230208 -0.653569
H -4.478684 1.861622 0.071503


