%chk=000099529.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099529

0 1
 S   -2.548900      -2.752700      0.3386000    
 O    1.606300     -0.1763000     -0.9962000    
 O    3.834800       1.592900      0.1332000    
 O    2.299800      -2.864100     -0.6112000    
 O   -1.135900       2.840300     -0.3702000    
 O   -4.365800     -0.3746000      0.2181000    
 N  -0.4388000      0.6198000     -0.1845000    
 N   -2.731700       1.219500     -7.4299999E-02
 C    3.044600      0.5697000      0.7347000    
 C   0.9580000      0.9118000     -0.3224000    
 C    1.656400       1.097000       1.015000    
 C    2.792900     -0.5475000     -0.2684000    
 C    2.532900      -1.893200      0.3961000    
 C  -0.8251000     -0.7041000     -1.2500000E-02
 C   -1.406700       1.646900     -0.2213000    
 C   -2.094400      -1.101100      0.1263000    
 C   -3.178400     -8.4299996E-02  9.8800004E-02
 H    3.570200      0.2324000       1.632900    
 H    1.091100       1.805200     -0.9441000    
 H    1.181800      0.4900000       1.795500    
 H    1.631000       2.142000       1.339800    
 H    3.601800     -0.6386000      -1.001800    
 H    1.681200      -1.877500       1.079700    
 H    3.415500      -2.203900      0.9655000    
 H    3.923300       2.311400      0.7826000    
 H  -4.7800001E-02  -1.451100     -9.9999997E-05
 H   -3.444500       1.943600     -9.8200001E-02
 H    2.153100      -3.713700     -0.1615000    
 H   -3.877600      -2.589900      0.4218000    


%chk=000099529-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099529

0 1
S -2.610947 -2.972333 -0.406010
O 1.742091 -0.099923 -1.115522
O 4.115726 1.427334 -0.044445
O 1.844634 -2.794749 -0.290836
O -0.981184 2.712291 0.348757
O -4.320118 -0.575337 0.502517
N -0.417254 0.505682 -0.225908
N -2.627099 1.034478 0.401065
C 3.114806 0.649683 0.694691
C 0.996599 0.976539 -0.497520
C 1.747659 1.372098 0.806280
C 2.796536 -0.578057 -0.179542
C 2.330124 -1.782832 0.652818
C -0.795229 -0.825037 -0.421923
C -1.319406 1.503608 0.183185
C -2.083823 -1.247542 -0.181596
C -3.105639 -0.290375 0.260227
H 3.506366 0.364965 1.693817
H 0.918878 1.811372 -1.212345
H 1.190503 1.014776 1.690011
H 1.843538 2.465608 0.892693
H 3.649653 -0.856965 -0.817054
H 1.526754 -1.488537 1.363139
H 3.198501 -2.157419 1.235520
H 4.232511 2.310196 0.388935
H 0.001308 -1.486490 -0.779973
H -3.307848 1.741338 0.697339
H 1.607996 -3.623058 0.196937
H -3.916537 -2.661415 -0.023356


