%chk=000129235.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129235

0 1
 S    3.400500       1.934400     -0.1197000    
 O   0.5292000      -1.090300       1.066100    
 O    1.267800      -3.955400      0.3287000    
 O  -0.9829000      -3.504600      -1.126000    
 O    2.705800      0.5744000      0.4710000    
 O    4.683400       1.581500     -0.6997000    
 O    2.403100       2.616600     -0.9242000    
 O   -2.100300       3.174100     -0.4838000    
 N   -1.727800     -0.8084000      0.3902000    
 N   -1.491700      0.4780000      9.2000000E-02
 N   -3.729600      6.4700000E-02  0.3231000    
 N    3.689600       2.892700       1.272400    
 N   -4.328200       2.763000     -0.2323000    
 C    1.250500      -2.767000     -0.4622000    
 C  -0.1837000      -2.392000     -0.7795000    
 C    1.709700      -1.595500      0.4002000    
 C  -0.6283000      -1.760300      0.5309000    
 C    2.323200     -0.4644000     -0.4132000    
 C   -3.059900      -1.046100      0.5261000    
 C   -2.734800      0.9632000      6.3199997E-02
 C   -2.996000       2.341400     -0.2233000    
 H    1.859400      -2.948200      -1.352400    
 H  -0.2162000      -1.667200      -1.601200    
 H    2.404900      -1.906100       1.188400    
 H  -0.9573000      -2.508300       1.263000    
 H    1.598800     -5.8699999E-02  -1.127700    
 H    3.203500     -0.8198000     -0.9591000    
 H    2.195800      -4.140700      0.5530000    
 H  -0.9045000      -4.164100     -0.4158000    
 H   -3.474900      -2.015100      0.7645000    
 H    2.861500       3.260600       1.758000    
 H    4.407500       2.552100       1.924700    
 H   -5.095700       2.127900     -3.7300002E-02
 H   -4.568400       3.727200     -0.4372000    


%chk=000129235-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000129235

0 1
S 3.972800 1.253653 0.459758
O 0.492104 -1.303268 1.256859
O 1.698283 -3.677902 -0.255230
O -0.786444 -3.855192 -0.904918
O 2.092941 1.208596 0.401020
O 4.516300 0.048303 1.385231
O 4.505190 1.460335 -1.046521
O -2.546559 2.546396 -1.802996
N -1.790551 -0.911493 0.580973
N -1.725109 0.108148 -0.367926
N -3.619580 0.317747 0.950495
N 4.159067 2.746277 1.348867
N -4.436840 2.583306 -0.416957
C 1.229434 -2.380053 -0.761719
C -0.324552 -2.498774 -0.724407
C 1.548866 -1.221773 0.206117
C -0.706270 -1.906116 0.677973
C 1.564932 0.154692 -0.489641
C -2.922962 -0.763705 1.357645
C -2.850751 0.825851 -0.104002
C -3.241155 2.058012 -0.865684
H 1.610763 -2.202073 -1.785155
H -0.780215 -1.886284 -1.518603
H 2.502924 -1.379453 0.740658
H -1.060903 -2.699701 1.357254
H 0.541027 0.500846 -0.726815
H 2.163037 0.124853 -1.424340
H 2.683900 -3.733037 -0.270520
H -0.046843 -4.448019 -0.589159
H -3.192494 -1.434459 2.168739
H 3.855825 3.584034 0.842970
H 3.945478 2.670588 2.348014
H -4.931529 2.126194 0.351505
H -4.806114 3.423074 -0.858589


