%chk=000099544.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099544

0 1
 S    1.768800      8.2199998E-02 -0.8358000    
 O    2.501800      0.2226000      0.6241000    
 O    2.107300      -1.215600      -1.400400    
 O    2.036300       1.307900      -1.575700    
 O   -4.695300       1.024200      0.4355000    
 O   -4.608600      -1.162800      0.6032000    
 N   -4.056800     -5.5300001E-02  0.3942000    
 C    3.918200      0.2842000      0.6922000    
 C   6.0699999E-02  4.1600000E-02 -0.4752000    
 C    4.344300      0.4120000       2.146800    
 C    4.505600     -0.9563000      3.6400001E-02
 C  -0.6693000       1.229100     -0.4229000    
 C  -0.5736000      -1.177900     -0.2391000    
 C   -2.667900     -2.2700001E-02  0.1017000    
 C   -2.033700       1.196900     -0.1344000    
 C   -1.937900      -1.210200      4.9300000E-02
 H    4.258200       1.178000      0.1559000    
 H    5.431600      0.4908000       2.240100    
 H    3.889300       1.299000       2.600600    
 H    4.002500     -0.4500000       2.730400    
 H    5.565600      -1.061900      0.2936000    
 H    4.467900     -0.8935000      -1.055100    
 H    3.987800      -1.868000      0.3527000    
 H  -0.1947000       2.190800     -0.5961000    
 H  -2.4000000E-02  -2.114600     -0.2662000    
 H   -2.570100       2.141800     -0.1003000    
 H   -2.398500      -2.178200      0.2295000    


%chk=000099544-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000099544

0 1
S 1.780775 -0.148661 -1.118601
O 2.479948 -0.214327 0.603805
O 2.034201 -1.541920 -1.904432
O 2.208498 1.267654 -1.785186
O -4.599997 1.256496 0.798598
O -4.723298 -1.019698 0.700457
N -4.085321 0.094234 0.583997
C 3.919148 0.215724 0.689908
C -0.020491 -0.075431 -0.578697
C 4.104255 0.495954 2.188736
C 4.849196 -0.873968 0.139336
C -0.583477 1.189744 -0.344636
C -0.718736 -1.287622 -0.457945
C -2.652447 0.034290 0.173952
C -1.938670 1.245467 0.039453
C -2.073592 -1.229821 -0.070982
H 4.023345 1.153983 0.108121
H 5.138067 0.843013 2.369969
H 3.404186 1.274304 2.535179
H 3.934760 -0.421425 2.778492
H 5.902864 -0.555290 0.241460
H 4.653535 -1.071957 -0.929034
H 4.710656 -1.817235 0.695915
H 0.012811 2.097545 -0.477081
H -0.223650 -2.238877 -0.675008
H -2.442914 2.194738 0.235873
H -2.678151 -2.132816 0.043349


