%chk=000132419.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000132419

0 1
 S  -0.6344000       2.259700       2.059700    
 O    1.421500       3.097900      7.9599999E-02
 O   -4.787400      0.5887000      -1.091500    
 O   -5.295200      0.7904000       1.102700    
 O   -2.057000      -3.076500      7.8500003E-02
 N    2.107500      0.9421000     -0.5206000    
 N   -2.709300     -0.9800000     -0.6971000    
 C    2.217400       1.138700      -1.974100    
 C   -2.335400      0.1859000       1.439100    
 C   -3.339900     -0.5081000      0.5089000    
 C   -1.819500       1.521000      0.8971000    
 C    1.464300       1.886900      0.3109000    
 C    2.674400     -0.2535000      7.5499997E-02
 C    3.018900       2.397500      -2.279000    
 C   0.8349000       1.196500      -2.611900    
 C   0.8299000       1.319400       1.572200    
 C    3.673000     -0.1440000       1.043300    
 C    2.220300      -1.512300     -0.3187000    
 C   -4.554100      0.3636000      0.2240000    
 C    4.217700      -1.293000       1.616800    
 C    2.765100      -2.661300      0.2549000    
 C   -2.119000      -2.230000     -0.8093000    
 C    3.763700      -2.551500       1.222600    
 C   -1.557500      -2.478000      -2.183600    
 H    2.760600      0.2851000      -2.398400    
 H   -1.504200     -0.5033000       1.629400    
 H   -2.826400      0.3622000       2.405800    
 H   -3.730200      -1.394200       1.026400    
 H   -1.359000       1.408300     -8.9199997E-02
 H   -2.646600       2.229900      0.7902000    
 H    2.470700       3.317900      -2.059400    
 H    3.957100       2.416100      -1.713600    
 H    3.272600       2.430400      -3.344700    
 H   0.2613000       2.063900      -2.267700    
 H   0.2532000      0.3028000      -2.368200    
 H   0.9150000       1.261000      -3.702200    
 H    1.563300       1.407900       2.380100    
 H   0.5679000      0.2658000       1.467600    
 H   -2.685000     -0.3535000      -1.496800    
 H    4.040900      0.8301000       1.355200    
 H    1.440300      -1.613500      -1.067200    
 H    4.996200      -1.207700       2.369200    
 H    2.410400      -3.641200     -5.0999999E-02
 H    4.187700      -3.446100       1.669200    
 H  -0.6642000      -1.868400      -2.332100    
 H   -1.290500      -3.533500      -2.286700    
 H   -2.300100      -2.228500      -2.946900    
 H   -5.590900       1.133300      -1.233400    


%chk=000132419-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000132419

0 1
S -0.794824 2.409367 1.952461
O 0.435862 2.341745 -0.894709
O -5.414610 0.214535 -0.214801
O -5.224847 -0.380847 2.023853
O -1.098115 -1.913555 -0.856986
N 2.117979 0.765174 -0.528409
N -3.087891 -0.718327 -0.927142
C 2.652035 0.867131 -1.937267
C -2.258864 0.029926 1.365300
C -3.309737 -0.774172 0.525788
C -2.124175 1.503466 0.954635
C 1.056375 1.565017 -0.105007
C 2.678623 -0.292387 0.297273
C 3.161353 2.291270 -2.252748
C 1.621400 0.361960 -2.972421
C 0.738475 1.477611 1.403661
C 3.927360 -0.100474 0.936575
C 1.998782 -1.531882 0.412784
C -4.720302 -0.321110 0.886144
C 4.497557 -1.146003 1.697585
C 2.573864 -2.569849 1.181051
C -1.999204 -1.313407 -1.529714
C 3.820760 -2.381834 1.823053
C -1.944861 -1.199652 -3.048668
H 3.518561 0.179092 -1.949151
H -1.299666 -0.496714 1.229078
H -2.544890 -0.049350 2.429639
H -3.217498 -1.828074 0.858146
H -1.861035 1.626313 -0.107720
H -3.043535 2.078677 1.165140
H 2.331126 3.014720 -2.231673
H 3.927396 2.607566 -1.521751
H 3.618686 2.304656 -3.259231
H 0.749864 1.036979 -2.994286
H 1.285988 -0.660071 -2.719541
H 2.082090 0.340394 -3.977369
H 1.561538 1.947732 1.972518
H 0.677820 0.432173 1.742932
H -3.794889 -0.237868 -1.487525
H 4.440525 0.862823 0.836984
H 1.035906 -1.678555 -0.092848
H 5.462722 -0.995022 2.193844
H 2.047454 -3.526481 1.271258
H 4.262049 -3.191402 2.414976
H -1.094937 -0.557052 -3.335265
H -1.762386 -2.199746 -3.476498
H -2.866732 -0.783140 -3.489056
H -6.319151 0.513545 0.070706


