%chk=000158269.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000158269

0 1
 S   -2.415200      9.3300000E-02  0.1308000    
 O   -2.185000       1.706600      6.0500000E-02
 O   -3.280100     -0.1801000       1.263700    
 O   -2.794700     -0.3507000      -1.197900    
 N  -0.8576000     -0.5403000      0.4565000    
 C    1.919300      0.8823000      0.2765000    
 C   9.3999997E-02 -0.6385000     -0.6815000    
 C   0.8671000      0.6744000     -0.8249000    
 C    2.846700     -0.3338000      0.3854000    
 C    1.016300      -1.842400     -0.4873000    
 C    2.061700      -1.623600      0.6048000    
 C    2.727600       2.152700      1.3400000E-02
 H    1.403500       1.012700       1.236500    
 H  -0.4659000     -0.8190000      -1.605300    
 H   0.1861000       1.531400     -0.8513000    
 H    1.377200      0.6623000      -1.798000    
 H    3.549900     -0.1942000       1.215300    
 H    3.448600     -0.4283000     -0.5275000    
 H    1.538500      -2.042500      -1.432000    
 H   0.4298000      -2.739300     -0.2544000    
 H    2.752800      -2.474100      0.6241000    
 H    1.573200      -1.592900       1.586200    
 H    3.455400       2.322100      0.8139000    
 H    3.274300       2.088900     -0.9335000    
 H    2.070700       3.027700     -3.2800000E-02
 H  -0.4345000     -0.3098000       1.364000    
 H   -1.786200       2.110700      0.8666000    


%chk=000158269-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000158269

0 1
S -2.385083 0.116424 0.266810
O -1.836263 1.912317 0.458956
O -3.304287 -0.232640 1.541211
O -2.908452 -0.103785 -1.238758
N -0.817196 -0.690720 0.432620
C 1.938681 0.873371 0.251246
C 0.124126 -0.692484 -0.726291
C 0.919414 0.630483 -0.890887
C 2.885135 -0.346295 0.399498
C 1.078963 -1.901282 -0.526318
C 2.104572 -1.666192 0.607900
C 2.725517 2.180505 0.015912
H 1.375280 0.990512 1.204509
H -0.503414 -0.868516 -1.618982
H 0.214863 1.479783 -0.960846
H 1.467237 0.574769 -1.854266
H 3.585693 -0.179097 1.240893
H 3.503629 -0.428773 -0.519458
H 1.622894 -2.045548 -1.481337
H 0.482508 -2.812106 -0.341014
H 2.803940 -2.522373 0.650621
H 1.589876 -1.644883 1.591490
H 3.436655 2.373855 0.840534
H 3.306985 2.123543 -0.924749
H 2.044930 3.048464 -0.058698
H -0.424034 -0.490073 1.364074
H -2.658671 2.476342 0.547130


