%chk=000083333.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083333

0 1
 S   -3.193800      -2.048300      0.8201000    
 N   0.6189000       1.399700      0.1414000    
 C  -0.7548000       1.104100      4.5499999E-02
 C    1.777000      0.6008000      4.1299999E-02
 C   -1.228900     -0.1521000      0.4273000    
 C   -1.645300       2.067400     -0.4316000    
 C   -2.589500     -0.4442000      0.3321000    
 C    2.926500      0.9477000      0.7511000    
 C    1.772700     -0.5363000     -0.7664000    
 C   -3.005900       1.775200     -0.5268000    
 C   -3.478000      0.5195000     -0.1449000    
 C    4.071700      0.1574000      0.6533000    
 C    2.918000      -1.326700     -0.8642000    
 C    4.067500     -0.9798000     -0.1544000    
 C   -2.255900      -3.084500     -0.3238000    
 H   0.8147000       2.381500      0.3159000    
 H  -0.5448000     -0.8949000      0.8306000    
 H   -1.289800       3.049400     -0.7334000    
 H    2.941900       1.830800       1.384700    
 H   0.8991000     -0.8189000      -1.347300    
 H   -3.697600       2.525500     -0.8986000    
 H   -4.541700      0.3102000     -0.2265000    
 H    4.966800      0.4274000       1.206000    
 H    2.916300      -2.209400      -1.496800    
 H    4.959500      -1.594500     -0.2315000    
 H   -1.187400      -3.057300     -9.4700001E-02
 H   -2.414200      -2.761100      -1.356500    
 H   -2.597900      -4.118900     -0.2307000    


%chk=000083333-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000083333

0 1
S -3.463121 -2.088429 -0.199011
N 0.580170 1.388231 0.225348
C -0.787337 1.116011 -0.013114
C 1.705967 0.551068 0.046869
C -1.311172 -0.207328 -0.001336
C -1.670483 2.213325 -0.208464
C -2.691059 -0.422308 -0.201916
C 2.892266 0.850172 0.776911
C 1.725196 -0.534831 -0.874382
C -3.048965 1.981283 -0.394082
C -3.572667 0.671469 -0.404566
C 4.060544 0.083601 0.594184
C 2.897589 -1.302394 -1.038111
C 4.072288 -1.006455 -0.307896
C -2.004953 -3.221362 0.127455
H 0.781683 2.323966 0.581346
H -0.638796 -1.041802 0.208214
H -1.274314 3.235686 -0.226759
H 2.888931 1.681123 1.493816
H 0.844974 -0.747902 -1.487495
H -3.724002 2.830907 -0.545375
H -4.642857 0.501445 -0.561088
H 4.961840 0.332961 1.165663
H 2.895941 -2.129203 -1.757895
H 4.978022 -1.606338 -0.443592
H -1.553267 -3.006115 1.108485
H -1.253974 -3.137329 -0.673928
H -2.423344 -4.239752 0.131919


