%chk=000129748.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129748

0 1
 S  -0.3303000       2.230700     -0.3805000    
 O    2.914900      -1.318300      0.8378000    
 O    3.083000      -1.879300      -1.428900    
 N   0.2576000     -0.1807000      0.3203000    
 C    1.454900      0.5139000      0.2273000    
 C    1.336200       1.856200     -0.1461000    
 C  -0.7393000      0.6199000      2.3700001E-02
 C   -2.131100      0.2364000      1.5400000E-02
 C    2.743000     -9.8999999E-03  0.4717000    
 C    2.457800       2.689700     -0.2829000    
 C   -2.482400      -1.109600     -7.6800004E-02
 C   -3.122300       1.213300      0.1007000    
 C   -4.819800     -0.5031000      1.3000000E-03
 C    3.864000      0.8143000      0.3372000    
 C   -3.827200      -1.479500     -8.3999999E-02
 C   -4.467200      0.8434000      9.3599997E-02
 C    3.721000       2.146200     -3.5300002E-02
 C   -6.257500     -0.8993000     -6.8000001E-03
 C    3.082400      -2.191300     -0.2454000    
 C    3.262300      -3.592900      0.2575000    
 H    2.353900       3.730600     -0.5735000    
 H   -1.727000      -1.888500     -0.1478000    
 H   -2.916700       2.274500      0.2015000    
 H    4.858000      0.4159000      0.5245000    
 H   -4.089500      -2.531600     -0.1590000    
 H   -5.232000       1.612500      0.1646000    
 H    4.602200       2.774300     -0.1356000    
 H   -6.633000     -0.9294000      -1.034400    
 H   -6.397900      -1.886100      0.4474000    
 H   -6.865600     -0.1928000      0.5686000    
 H    4.150100      -3.646500      0.8923000    
 H    3.399000      -4.268200     -0.5919000    
 H    2.372800      -3.903200      0.8111000    


%chk=000129748-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000129748

0 1
S -0.214912 2.547067 -0.177114
O 3.073427 -1.299563 0.558480
O 2.310021 -1.917751 -1.578331
N 0.422845 -0.048888 0.199149
C 1.629763 0.656089 0.156568
C 1.522951 2.073758 -0.027245
C -0.632304 0.731549 0.045963
C -2.027048 0.284323 0.033522
C 2.922568 0.088794 0.297101
C 2.655773 2.909089 -0.063617
C -2.308963 -1.109634 0.122145
C -3.113992 1.192572 -0.064309
C -4.730678 -0.664797 0.013045
C 4.061234 0.907561 0.267900
C -3.636823 -1.568583 0.111984
C -4.442110 0.721484 -0.073613
C 3.925827 2.309208 0.090076
C -6.159368 -1.175182 -0.006966
C 2.635757 -2.241254 -0.426092
C 2.664016 -3.624854 0.176099
H 2.563843 3.989709 -0.203880
H -1.468819 -1.807217 0.192512
H -2.925633 2.270968 -0.129730
H 5.046745 0.447300 0.383775
H -3.835400 -2.645244 0.178893
H -5.267677 1.438763 -0.148753
H 4.823476 2.935485 0.067875
H -6.346272 -1.801486 -0.899973
H -6.374097 -1.802662 0.878121
H -6.887109 -0.346174 -0.019814
H 3.605254 -3.788695 0.726127
H 2.545075 -4.379437 -0.614581
H 1.836929 -3.720698 0.902285


