%chk=000100320.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100320

0 1
 S    1.171800      -1.285300      -1.181700    
 O   -2.431400      -3.060100      0.5400000    
 O  -0.3788000      -3.159600     -0.2443000    
 O   -3.878200       2.915400      4.3499999E-02
 O   -4.813500       1.050000      0.7388000    
 O    5.224100       1.498000     -0.7467000    
 N   -1.415000      -2.519800      4.7300000E-02
 N    3.314300      0.1927000     -0.8459000    
 N   -3.844800       1.678900      0.2498000    
 N    2.174900     -0.4608000       1.126200    
 C  -0.3458000     -0.4429000     -0.7392000    
 C   -1.438600      -1.116200     -0.1930000    
 C   -2.664800      0.9627000     -8.3800003E-02
 C   -2.598100     -0.4134000      0.1347000    
 C  -0.4127000      0.9332000     -0.9577000    
 C   -1.572100       1.636000     -0.6300000    
 C    2.306600     -0.4508000     -0.1616000    
 C    4.303200      0.9054000     -0.1953000    
 C    4.163900      0.9017000       1.280200    
 C    3.135000      0.2347000       1.818900    
 H   -3.454200     -0.9310000      0.5610000    
 H   0.4224000       1.481200      -1.387500    
 H   -1.588300       2.707000     -0.8153000    
 H    3.330900      0.1425000      -1.859900    
 H    4.890900       1.433400       1.880600    
 H    3.019300      0.2228000       2.898000    


%chk=000100320-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000100320

0 1
S 1.124506 -1.418323 -0.089009
O -2.789188 -3.011264 -1.450878
O -0.612839 -3.245935 -0.811995
O -4.288735 2.725942 0.583341
O -5.321774 0.879440 -0.277959
O 5.965795 -0.318592 -0.706691
N -1.703233 -2.554725 -0.934052
N 3.657507 -0.566098 -0.359719
N -4.279093 1.516991 0.132223
N 2.344252 0.979484 0.881207
C -0.476224 -0.518636 -0.009196
C -1.681775 -1.161561 -0.435159
C -2.971754 0.814974 0.082902
C -2.925512 -0.499308 -0.399597
C -0.573673 0.809466 0.483473
C -1.807041 1.477482 0.528638
C 2.461943 -0.139542 0.185027
C 4.912232 0.144244 -0.195902
C 4.747072 1.376312 0.572954
C 3.504637 1.743655 1.054436
H -3.827493 -1.013066 -0.742540
H 0.337729 1.300301 0.840681
H -1.881569 2.498980 0.910642
H 3.705281 -1.422091 -0.927697
H 5.635297 1.988927 0.740715
H 3.364651 2.668641 1.621254


