%chk=000048220.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048220

0 1
 S   0.7184000       1.323500      -1.089800    
 O  -0.1008000      -1.202900       1.527400    
 N  -0.6622000      -1.439200     -0.6956000    
 C    1.344500     -0.1333000     -0.1366000    
 C    2.173400      0.3819000       1.071900    
 C    2.269100     -0.9722000      -1.060600    
 C   0.1348000     -0.9702000      0.3416000    
 C    3.355700       1.286900      0.7310000    
 C    2.839300      -2.250400     -0.4488000    
 C  -0.2574000       2.060400      0.2348000    
 C   -1.838500      -2.242800     -0.4588000    
 C  -0.9184000       3.311800     -0.2467000    
 C   -3.020300      -1.344200     -0.3051000    
 C   -2.242800       3.501700     -0.2500000    
 C   -3.794800      -1.310900      0.7852000    
 H    2.567500     -0.4798000       1.626800    
 H    1.542500      0.8790000       1.816300    
 H    3.102500     -0.3694000      -1.440400    
 H    1.713000      -1.278600      -1.956900    
 H    4.095000      0.7841000      0.1025000    
 H    3.869600       1.568700       1.657100    
 H    3.050400       2.216700      0.2446000    
 H    3.538300      -2.032500      0.3633000    
 H    3.391400      -2.810700      -1.210900    
 H    2.049500      -2.902600     -6.5300003E-02
 H  -0.4502000      -1.171900      -1.652000    
 H   0.3803000       2.363300       1.067700    
 H   -1.006700       1.355700      0.6060000    
 H   -1.975400      -2.891100      -1.329800    
 H   -1.681500      -2.875800      0.4211000    
 H  -0.2811000       4.124500     -0.5879000    
 H   -3.267800     -0.6894000      -1.137100    
 H   -2.662200       4.438900     -0.5993000    
 H   -2.927700       2.733200      9.0899996E-02
 H   -4.644300     -0.6386000      0.8349000    
 H   -3.596700      -1.946100       1.641400    


%chk=000048220-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000048220

0 1
S 0.895669 1.388366 -1.093643
O 0.273257 -1.851158 1.255792
N -0.765585 -1.100420 -0.689658
C 1.479283 -0.182104 -0.106262
C 2.198909 0.226608 1.202633
C 2.407524 -0.920423 -1.125097
C 0.264122 -1.099994 0.229047
C 3.496337 1.036077 1.012473
C 3.037276 -2.220638 -0.575930
C -0.264994 2.210185 0.196878
C -1.973303 -1.931334 -0.519106
C -1.128971 3.232248 -0.490562
C -3.192664 -1.108954 -0.130312
C -2.483229 3.161677 -0.555877
C -3.844004 -1.226051 1.053068
H 2.398592 -0.703747 1.765354
H 1.490522 0.795904 1.834186
H 3.207314 -0.221502 -1.434838
H 1.819320 -1.152390 -2.034145
H 4.287145 0.438545 0.523674
H 3.887570 1.361281 1.993623
H 3.319883 1.935812 0.394802
H 3.706473 -2.019724 0.279457
H 3.637122 -2.707526 -1.366229
H 2.266648 -2.933827 -0.236163
H -0.719299 -0.389113 -1.431526
H 0.385916 2.675504 0.956617
H -0.871509 1.414194 0.660677
H -2.167411 -2.475378 -1.464778
H -1.741198 -2.670209 0.266514
H -0.606835 4.082901 -0.952332
H -3.548023 -0.382546 -0.878325
H -3.073228 3.939820 -1.052601
H -3.035876 2.328529 -0.103560
H -4.724165 -0.616550 1.289156
H -3.512188 -1.936363 1.819894


