%chk=000088327.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088327

0 1
 S   0.5441000       2.090400      0.3916000    
 O    4.496900     -0.1949000     -9.7800002E-02
 O    2.969500      -1.852900      0.2402000    
 N   0.9322000     -0.3357000     -0.4559000    
 C    2.243000      0.3375000     -0.4624000    
 C    2.238000       1.495500      0.5186000    
 C   6.2000002E-03  0.4937000     -9.0400003E-02
 C   -1.428000      0.1249000     -4.1900001E-02
 C    3.240200     -0.7020000     -6.8899997E-02
 C   -1.801000      -1.192400      0.2250000    
 C   -2.405400       1.095400     -0.2627000    
 C   -3.151300      -1.539300      0.2709000    
 C   -3.755700      0.7486000     -0.2166000    
 C   -4.128700     -0.5688000      5.0299998E-02
 H    2.465500      0.6617000      -1.487000    
 H    2.433900       1.173000       1.546800    
 H    2.959800       2.271500      0.2487000    
 H   -1.054800      -1.961900      0.4049000    
 H   -2.152900       2.126300     -0.4928000    
 H   -3.441900      -2.564700      0.4796000    
 H   -4.517000       1.502900     -0.3929000    
 H   -5.180000     -0.8390000      8.5400000E-02
 H    5.167600     -0.8628000      0.1598000    


%chk=000088327-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000088327

0 1
S 0.457715 2.356168 0.051620
O 3.929433 -1.437547 -0.346769
O 3.589071 -0.337259 1.670940
N 0.999988 -0.291654 -0.280336
C 2.332005 0.366480 -0.355020
C 2.268185 1.828607 0.189955
C 0.010273 0.540922 -0.114201
C -1.410331 0.138631 -0.071191
C 3.329017 -0.471083 0.457857
C -1.751343 -1.224587 -0.298340
C -2.441993 1.079136 0.188025
C -3.098598 -1.632747 -0.264412
C -3.790832 0.666033 0.218293
C -4.123530 -0.689555 -0.007109
H 2.653536 0.341503 -1.413640
H 2.560552 1.865424 1.250772
H 2.879268 2.520823 -0.406698
H -0.945488 -1.937612 -0.497585
H -2.191345 2.129673 0.375634
H -3.353381 -2.683703 -0.439277
H -4.579847 1.398343 0.420008
H -5.171163 -1.009429 0.018037
H 4.529006 -2.009566 0.205938


