%chk=000127427.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127427

0 1
 S    1.721900     -0.2398000     -0.1068000    
 S  -3.3000000E-02   2.612800     -2.3499999E-02
 O    2.118600      -1.509500     -0.7018000    
 O    2.217300       1.007900     -0.6742000    
 N  -0.5521000      -1.416400     -4.6999998E-02
 N    2.103100     -0.2712000       1.559100    
 C  -1.8600000E-02 -0.1743000     -5.1500000E-02
 C  -0.7667000      0.9915000     -1.4700000E-02
 C   -2.151500      0.8749000      2.9300001E-02
 C   -2.737700     -0.3860000      3.5200000E-02
 C   -1.901400      -1.490100     -3.8999999E-03
 H   -2.791700       1.753100      5.9300002E-02
 H   -3.815000     -0.5012000      6.9100000E-02
 H   -2.308700      -2.495700     -1.1000000E-03
 H    2.465100      -1.150100       1.948600    
 H    2.529400      0.5703000       1.966200    
 H   0.9522000       2.345900      0.8463000    


%chk=000127427-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127427

0 1
S 1.821313 -0.061549 0.050470
S -0.287069 2.808123 -0.199600
O 2.425878 -1.087222 -1.043155
O 2.338383 1.524973 0.041461
N -0.588616 -1.319650 0.166619
N 2.179875 -0.573048 1.753545
C -0.132918 -0.080047 0.051376
C -0.888194 1.114683 -0.060274
C -2.301006 0.876206 -0.063747
C -2.819993 -0.426151 0.051833
C -1.932761 -1.525537 0.172711
H -2.970725 1.737203 -0.156016
H -3.901007 -0.593139 0.048542
H -2.280322 -2.556891 0.271493
H 2.193870 -1.600794 1.833463
H 3.038532 -0.098570 2.074194
H 1.135961 2.383510 -0.104315


