%chk=000068194.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068194

0 1
 S  -7.5800002E-02  -2.154300      0.3550000    
 S    2.341100      0.3942000      -2.029800    
 O  -0.7829000      -3.328000     -0.1435000    
 O   0.4517000      -2.176700       1.713900    
 N    1.193400      -1.785100     -0.7500000    
 N    2.069300      8.2000002E-02  0.5218000    
 N   -3.708400       2.520500     -0.1984000    
 C   -1.142400     -0.7816000      0.1921000    
 C   -2.168500     -0.8035000     -0.7526000    
 C  -0.9684000      0.3370000       1.006900    
 C    1.830700     -0.5002000     -0.6442000    
 C   -2.846600       1.411800     -6.7500003E-02
 C   -3.020600      0.2932000     -0.8824000    
 C   -1.820600       1.433700      0.8772000    
 C    2.687500       1.299300      0.3135000    
 C    2.917000       1.641100      -1.002800    
 C    3.043300       2.116600       1.490700    
 H    1.115900      -2.157200      -1.704400    
 H   -2.318100      -1.660600      -1.403000    
 H  -0.1935000      0.3724000       1.766500    
 H   -3.815500      0.2648000      -1.623300    
 H   -1.677600       2.297600       1.521300    
 H    3.380100       2.532600      -1.401600    
 H    3.604600       3.012700       1.207400    
 H    2.138300       2.434700       2.018000    
 H    3.659800       1.536900       2.184900    
 H   -4.451900       2.505600     -0.8837000    
 H   -3.582100       3.332100      0.3915000    


%chk=000068194-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000068194

0 1
S -0.117231 -1.761343 -0.055557
S 3.991847 -0.856649 -1.210931
O -0.640865 -3.109504 -0.814243
O 0.666673 -1.813456 1.370552
N 1.129052 -0.891225 -1.458924
N 2.173606 0.839660 -0.166320
N -4.712264 2.139566 0.321839
C -1.518920 -0.556354 0.056124
C -2.685645 -0.821941 -0.684502
C -1.369327 0.583938 0.868792
C 2.221807 -0.247545 -0.935750
C -3.652667 1.246969 0.230399
C -3.757364 0.080212 -0.588697
C -2.443735 1.482959 0.956837
C 3.430281 1.288693 0.236118
C 4.511868 0.551617 -0.245745
C 3.529690 2.511301 1.109980
H 1.335890 -1.695918 -2.077238
H -2.752249 -1.723953 -1.301006
H -0.436147 0.759789 1.412045
H -4.680673 -0.112549 -1.146769
H -2.352018 2.376567 1.584546
H 5.570890 0.766750 -0.117093
H 4.580797 2.782330 1.301314
H 3.022678 3.370510 0.635974
H 3.034754 2.328654 2.081028
H -5.574520 1.981996 -0.192200
H -4.646406 2.970528 0.902929


