%chk=000137068.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000137068

0 1
 S    3.566700     -0.2663000       1.179700    
 N    1.758900      7.7000000E-02 -0.8955000    
 C  -0.4546000     -0.6847000     -0.2382000    
 C   -1.751500     -0.3931000      0.1846000    
 C   0.4528000      0.3492000     -0.4691000    
 C   -2.141000      0.9325000      0.3766000    
 C  -3.7400000E-02  -2.106900     -0.4433000    
 C   -2.741800      -1.481600      0.4404000    
 C   6.3400000E-02   1.674700     -0.2769000    
 C   -1.233500       1.966300      0.1459000    
 C    2.517800     -6.7199998E-02 -4.1999999E-03
 H   -3.147800       1.177400      0.7045000    
 H   0.7944000      -2.204300      -1.148400    
 H   0.2648000      -2.550700      0.5108000    
 H  -0.8443000      -2.708800     -0.8737000    
 H   -3.044200      -1.953800     -0.4999000    
 H   -2.328000      -2.238300       1.115200    
 H   -3.648800      -1.096200      0.9196000    
 H   0.7603000       2.489700     -0.4559000    
 H   -1.536800       2.998500      0.2946000    


%chk=000137068-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000137068

0 1
S 4.572615 -0.375308 -0.505855
N 1.794852 0.134860 -0.217673
C -0.492056 -0.694397 -0.004471
C -1.875139 -0.383274 0.157483
C 0.441194 0.387212 -0.065707
C -2.289498 0.968033 0.250203
C -0.035753 -2.136204 -0.104228
C -2.902572 -1.498656 0.228096
C 0.014021 1.741074 0.027050
C -1.353332 2.024947 0.184443
C 2.975137 -0.081596 -0.338810
H -3.354906 1.191942 0.375607
H 1.049357 -2.218255 -0.268579
H -0.279927 -2.697482 0.818356
H -0.546081 -2.658537 -0.935521
H -2.935473 -2.081559 -0.712798
H -2.670447 -2.216933 1.037073
H -3.913187 -1.096954 0.410542
H 0.759787 2.539873 -0.025197
H -1.689191 3.064614 0.256785


