%chk=000146944.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146944

0 1
 S   -1.267200      0.2893000     -0.8568000    
 O    1.278100      -2.171700      3.1800002E-02
 O    5.138600      0.3191000     -0.4008000    
 N    3.214800     -0.9378000     -0.1893000    
 N    3.169200       1.375300      0.1464000    
 N   -3.938700      0.2492000      -1.170100    
 N   -3.298700     -4.6999998E-02  0.9357000    
 C    1.131800      0.1738000      0.3900000    
 C  -0.3328000      9.0800002E-02  0.6755000    
 C    1.857600      -1.089200      6.5200001E-02
 C    1.828400       1.316900      0.4098000    
 C    3.931300      0.2606000     -0.1653000    
 C   -2.955600      0.1459000     -0.2755000    
 C   -5.088600      0.1034000     -0.4465000    
 C   -4.668000     -7.8599997E-02  0.8500000    
 H  -0.6253000      0.8848000       1.372700    
 H  -0.5880000     -0.8597000       1.156000    
 H    1.366300       2.270500      0.6377000    
 H    3.737300      -1.779900     -0.4137000    
 H    3.620100       2.284600      0.1835000    
 H   -3.864100      0.4019000      -2.167700    
 H   -6.066100      0.1411000     -0.9054000    
 H   -5.281900     -0.2302000       1.726000    


%chk=000146944-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000146944

0 1
S -1.520750 -1.514738 -1.032734
O 2.312188 -2.386858 -0.693171
O 4.135000 1.880781 -0.023302
N 3.183777 -0.248070 -0.345789
N 1.916187 1.471448 0.622981
N -3.772269 0.144233 -1.017281
N -2.321604 0.643524 0.640131
C 0.882750 -0.692616 0.318871
C -0.282676 -1.622423 0.441546
C 2.128680 -1.207598 -0.272985
C 0.827200 0.619659 0.739943
C 3.160048 1.090392 0.073712
C -2.558653 -0.168675 -0.412625
C -4.341035 1.215949 -0.306701
C -3.435679 1.504701 0.710533
H -0.892922 -1.429862 1.335465
H 0.050221 -2.670991 0.403777
H -0.108741 1.028584 1.138354
H 4.067214 -0.572836 -0.751721
H 1.858333 2.443252 0.932786
H -4.186082 -0.336441 -1.815066
H -5.296029 1.654832 -0.579780
H -3.506658 2.266854 1.482253


