%chk=000159173.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000159173

1 1
 S   -1.542900      -2.331400      0.3912000    
 N   0.2978000     -0.8322000     -0.4180000    
 C    1.590300     -0.3926000     -0.8877000    
 C    2.528400      1.0000000E-03  0.2514000    
 C  -0.7716000      1.2600000E-02 -0.2237000    
 C    3.897800      0.4663000     -0.2450000    
 C   -1.904300     -0.6500000      0.2326000    
 C   6.4199999E-02  -2.096700     -0.1425000    
 C  -0.7860000       1.397600     -0.4419000    
 C    4.801700      0.8643000      0.9114000    
 C   -3.095600      4.3000001E-02  0.4890000    
 C   -1.972200       2.092900     -0.1874000    
 C   -3.107700       1.425300      0.2706000    
 H    2.047300      -1.207000      -1.466500    
 H    1.474900      0.4321000      -1.599600    
 H    2.654500     -0.8528000      0.9287000    
 H    2.064200      0.7985000      0.8443000    
 H    4.376500     -0.3352000     -0.8192000    
 H    3.776900       1.322100     -0.9191000    
 H   0.7957000      -2.887500     -0.2389000    
 H   8.3099999E-02   1.945800     -0.7900000    
 H    4.966600      2.0300001E-02   1.588900    
 H    4.364100       1.686600       1.486500    
 H    5.775400       1.193200      0.5353000    
 H   -3.983400     -0.4692000      0.8456000    
 H   -2.008200       3.167400     -0.3469000    
 H   -4.018500       1.987000      0.4622000    


%chk=000159173-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000159173

1 1
S -1.687924 -2.454062 0.298336
N 0.286733 -0.924094 -0.496130
C 1.661217 -0.497772 -0.925574
C 2.513432 0.024908 0.252405
C -0.765348 0.000965 -0.241397
C 3.912666 0.473734 -0.236653
C -1.948710 -0.653013 0.204517
C -0.040634 -2.205386 -0.263139
C -0.732364 1.405820 -0.400604
C 4.788532 0.990830 0.924157
C -3.121662 0.062281 0.506605
C -1.904323 2.123307 -0.100650
C -3.082890 1.463785 0.347824
H 2.145236 -1.370391 -1.397090
H 1.535707 0.273840 -1.705471
H 2.623373 -0.773788 1.011515
H 2.006191 0.874542 0.748352
H 4.422551 -0.374780 -0.734910
H 3.802989 1.269642 -1.000529
H 0.652021 -3.032328 -0.408383
H 0.166863 1.924201 -0.744026
H 4.951603 0.206680 1.685809
H 4.322622 1.859301 1.424806
H 5.778563 1.309002 0.554914
H -4.030903 -0.439257 0.848693
H -1.909421 3.211142 -0.214821
H -3.977120 2.052292 0.572745


