%chk=000096876.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096876

0 1
 S    2.654000      0.2105000     -0.1224000    
 O    3.320900     -0.9261000     -0.7411000    
 O    2.834200       1.545000     -0.6754000    
 N    3.050700      0.2462000       1.538900    
 C   -3.643300      0.6537000     -0.2744000    
 C   -2.477900       1.565200      0.1391000    
 C   -3.255700     -0.7745000      0.1376000    
 C   -1.322600      0.6196000      4.2900000E-02
 C   -1.764200     -0.7087000      4.1999999E-02
 C   2.7600000E-02  0.9236000      4.9000001E-03
 C  -0.8646000      -1.760500      3.1000001E-03
 C   0.9419000     -0.1309000     -4.7100000E-02
 C   0.4990000      -1.463200     -4.8099998E-02
 H   -3.759200      0.6929000      -1.366600    
 H   -4.596100      0.9702000      0.1613000    
 H   -2.594700       1.913800       1.170300    
 H   -2.379400       2.418500     -0.5377000    
 H   -3.687500      -1.516200     -0.5401000    
 H   -3.558400     -0.9849000       1.168400    
 H   0.3505000       1.959300      2.1400001E-02
 H   -1.204300      -2.790500      1.4600000E-02
 H    1.207800      -2.286600     -7.8100003E-02
 H    3.609500     -0.5306000       1.912700    
 H    3.274900       1.157900       1.956200    


%chk=000096876-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096876

0 1
S 2.725294 0.205171 -0.070992
O 3.474873 -1.088998 -0.722605
O 2.911346 1.726784 -0.629825
N 3.229696 0.249677 1.699160
C -3.760603 0.670805 -0.315931
C -2.564452 1.577621 0.115122
C -3.342766 -0.775360 0.099742
C -1.376382 0.625953 0.062973
C -1.821483 -0.725197 0.051760
C -0.001069 0.928198 0.041121
C -0.899453 -1.791160 0.006139
C 0.885042 -0.163361 0.000871
C 0.487959 -1.509932 -0.023498
H -3.874313 0.715746 -1.414899
H -4.717422 0.984956 0.134993
H -2.705835 1.951375 1.149534
H -2.440438 2.461862 -0.534394
H -3.772569 -1.552501 -0.556718
H -3.679737 -1.000364 1.132206
H 0.378419 1.955265 0.023255
H -1.243054 -2.831050 -0.017531
H 1.237790 -2.304227 -0.094101
H 3.926137 -0.500120 1.849168
H 3.606120 1.192557 1.896850


