%chk=000103692.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000103692

0 1
 S   -3.135900      -1.907900      0.6041000    
 O  -0.3598000       2.254000      -1.441400    
 O   -1.497900       2.828000      0.4263000    
 O    2.417200     -0.3611000       1.389300    
 N   0.9413000      0.2569000     -0.2972000    
 C  -4.7499999E-02  0.8924000      0.5354000    
 C   -1.084900     -0.1229000       1.034500    
 C   -1.936500     -0.7287000     -8.3499998E-02
 C  -0.6964000       2.092000     -0.1392000    
 C    2.101500     -0.3220000      0.2031000    
 C    2.953500     -0.9172000     -0.9028000    
 C    4.243500      -1.524900     -0.3827000    
 C   -3.898300      -2.438600     -0.9462000    
 H   0.4835000       1.298100       1.406400    
 H   -1.742800      0.3782000       1.757100    
 H  -0.5667000     -0.9243000       1.577800    
 H   -2.486700      5.4000001E-02 -0.6148000    
 H   -1.301200      -1.256700     -0.8015000    
 H   0.7683000      0.2220000      -1.297900    
 H    2.365400      -1.685900      -1.416800    
 H    3.185600     -0.1274000      -1.626300    
 H    4.039100      -2.330200      0.3307000    
 H    4.829400      -1.940200      -1.208400    
 H    4.854900     -0.7728000      0.1268000    
 H   -3.153600      -2.902200      -1.598500    
 H   -4.356600      -1.587600      -1.456700    
 H   -4.677300      -3.174700     -0.7310000    
 H  -0.8183000       3.021000      -1.846000    


%chk=000103692-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000103692

0 1
S -3.235040 -1.920045 0.578173
O -0.267571 2.212976 -1.420657
O -1.315382 2.891677 0.539509
O 2.118158 -0.817176 1.422587
N 0.980483 0.172069 -0.338215
C 0.014587 0.817115 0.560343
C -1.125155 -0.143920 1.035208
C -1.992800 -0.671570 -0.117708
C -0.587374 2.073786 -0.055781
C 2.001001 -0.615222 0.173900
C 2.947969 -1.231572 -0.860634
C 4.422778 -1.138142 -0.410676
C -4.086941 -2.393498 -1.031531
H 0.558082 1.122207 1.476717
H -1.750138 0.400185 1.766671
H -0.633599 -0.980938 1.562161
H -2.563033 0.141594 -0.603171
H -1.374550 -1.187617 -0.873539
H 0.940008 0.399992 -1.333092
H 2.668049 -2.298563 -0.965713
H 2.808341 -0.763137 -1.854028
H 4.528957 -1.551659 0.606232
H 5.077637 -1.704684 -1.095955
H 4.769020 -0.089401 -0.388462
H -3.364896 -2.843086 -1.732542
H -4.566312 -1.512291 -1.487985
H -4.857469 -3.136298 -0.772394
H -0.692008 3.038515 -1.778820


