%chk=000083700.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083700

0 1
 S  -0.2583000      -1.824100      -1.160100    
 S    1.752500      -2.897200      0.8193000    
 O    2.135300       2.332700     -1.6000001E-02
 O   -3.376900      0.8104000      0.7555000    
 N    1.702700     -0.4289000     -0.1619000    
 N   -1.244000     -0.6680000     -0.4650000    
 C    2.377100      0.1421000      0.9957000    
 C    1.750500      0.3665000      -1.381000    
 C   -1.605800     -0.8329000      0.9540000    
 C   -2.421800     -0.2119000      -1.224700    
 C    1.942500       1.588100       1.192000    
 C    1.341100       1.802100      -1.082900    
 C   -2.227300      0.4423000       1.514400    
 C   -3.021800       1.046100     -0.6050000    
 C    1.154100      -1.667300     -0.1343000    
 H    3.453200      9.7999997E-02  0.7896000    
 H    2.174800     -0.4118000       1.916300    
 H    1.190000     -3.3599999E-02  -2.227100    
 H    2.804400      0.3584000      -1.689400    
 H  -0.7388000      -1.067300       1.578900    
 H   -2.317400      -1.663200       1.054100    
 H   -3.176000      -1.009500      -1.246700    
 H   -2.145000      1.4200000E-02  -2.261800    
 H   0.8905000       1.653900       1.490500    
 H    2.543000       2.058900       1.976500    
 H    1.505900       2.429700      -1.964200    
 H   0.2818000       1.875400     -0.8135000    
 H   -2.550200      0.2761000       2.547100    
 H   -1.512100       1.273000       1.521400    
 H   -2.329200       1.894600     -0.6625000    
 H   -3.932900       1.327300      -1.143000    


%chk=000083700-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000083700

0 1
S -0.360394 -2.045610 0.150108
S 2.376868 -2.892218 0.588696
O 2.780660 2.436939 0.510880
O -4.129124 0.667771 -0.386749
N 1.881581 -0.259561 -0.050248
N -1.550001 -0.600562 -0.113496
C 3.335941 0.058355 0.023270
C 1.065922 0.912353 -0.469340
C -2.436441 -0.419222 1.077103
C -2.364610 -0.798135 -1.352267
C 3.554148 1.265336 0.955062
C 1.347900 2.101449 0.468908
C -3.320162 0.821518 0.831181
C -3.251605 0.449972 -1.545732
C 1.426142 -1.516678 0.200853
H 3.688082 0.299038 -0.998573
H 3.874057 -0.832263 0.388277
H -0.007432 0.639578 -0.439958
H 1.361764 1.180369 -1.503352
H -1.808740 -0.266952 1.972628
H -3.086024 -1.305933 1.250066
H -3.009217 -1.702604 -1.286287
H -1.683889 -0.916650 -2.213865
H 3.269008 0.993938 1.994131
H 4.609757 1.581233 0.935318
H 0.843214 3.009737 0.100814
H 0.985166 1.866512 1.493501
H -4.041260 0.957044 1.653948
H -2.677614 1.725387 0.746052
H -2.607930 1.342878 -1.704840
H -3.923868 0.321083 -2.409889


