%chk=000005226.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005226

0 1
 S   -2.942900      0.2545000     -0.1110000    
 O   -3.076300       1.561800     -0.7386000    
 O   -3.679600     -0.8825000     -0.6449000    
 N    3.446900       1.197800      0.3549000    
 N   -3.296200      0.4037000       1.554000    
 C    1.470700     -0.8243000      1.5500000E-02
 C    1.079300      0.5257000     -2.9800000E-02
 C    2.931700      -1.187800      9.1899998E-02
 C    2.115100       1.621300     -9.3199998E-02
 C    3.847200     -3.4499999E-02 -0.3229000    
 C  -0.2835000      0.8480000     -7.9000004E-02
 C   -1.247700     -0.1595000     -5.5700000E-02
 C   0.4947000      -1.828400      4.8500001E-02
 C  -0.8592000      -1.495800      1.0300000E-02
 H    3.156100      -1.481200       1.125300    
 H    3.135000      -2.050900     -0.5532000    
 H    2.172300       1.991700      -1.124300    
 H    1.798700       2.455400      0.5435000    
 H    4.880000     -0.2807000     -5.2700002E-02
 H    3.826200      0.1064000      -1.411100    
 H    4.118300       1.936000      0.1457000    
 H  -0.5771000       1.893700     -0.1289000    
 H   0.7852000      -2.874300      0.1056000    
 H   -1.594000      -2.295500      3.9799999E-02
 H   -3.469300       1.347200       1.922000    
 H   -3.879800     -0.3239000       1.984700    


%chk=000005226-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000005226

0 1
S -2.994983 0.267426 -0.073569
O -3.117012 1.768598 -0.701786
O -3.808670 -1.019617 -0.658294
N 3.510559 1.180177 0.276902
N -3.478091 0.414904 1.695171
C 1.539072 -0.832969 0.050698
C 1.139760 0.532251 -0.012314
C 3.015430 -1.207830 0.087261
C 2.167870 1.656931 -0.091519
C 3.907691 -0.057466 -0.422184
C -0.237541 0.857155 -0.044032
C -1.174567 -0.182074 -0.007141
C 0.547989 -1.849017 0.071878
C -0.827151 -1.541207 0.046047
H 3.301860 -1.432932 1.133054
H 3.189399 -2.125365 -0.507221
H 2.120360 2.079937 -1.129495
H 1.874443 2.471540 0.597198
H 4.967221 -0.271582 -0.196267
H 3.808629 0.022343 -1.534093
H 4.220462 1.919589 0.252748
H -0.574352 1.897692 -0.120114
H 0.861558 -2.899212 0.103066
H -1.597801 -2.317933 0.037135
H -3.801148 1.383753 1.857551
H -4.209183 -0.291192 1.885719


