%chk=000072560.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072560

0 1
 S  -0.6622000      -1.429400      7.1999997E-02
 O  -0.7298000      -2.148300       1.325600    
 O  -0.9239000      -2.042400      -1.212100    
 O   -1.005800       2.395200      0.2658000    
 O   -3.499400      0.8098000     -0.7728000    
 N   -1.495700      7.1999997E-02  0.1987000    
 C   0.8770000     -0.6176000     -1.1600000E-02
 C   0.7439000      0.7690000      5.8300000E-02
 C  -0.6517000       1.233000      0.1856000    
 C   -2.960700      8.1600003E-02  0.3161000    
 C    2.099600      -1.245100     -0.1325000    
 C    1.862700       1.582300      7.1000000E-03
 C    3.231500     -0.4304000     -0.1846000    
 C    3.114600      0.9703000     -0.1155000    
 H   -3.251600      0.5611000       1.255300    
 H   -3.365300     -0.9343000      0.2951000    
 H    2.187600      -2.323900     -0.1855000    
 H    1.784300       2.662700      5.9599999E-02
 H    4.216000     -0.8809000     -0.2796000    
 H    4.010800       1.583800     -0.1581000    
 H   -4.465700      0.8122000     -0.6651000    


%chk=000072560-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000072560

0 1
S -0.713506 -1.539892 -0.031383
O -0.986337 -2.423095 1.301080
O -1.023469 -2.204762 -1.472398
O -0.994497 2.434455 0.458721
O -3.576697 0.332854 -0.948052
N -1.549063 0.161728 0.243694
C 0.941905 -0.636469 -0.044979
C 0.754743 0.748178 0.101249
C -0.654935 1.234386 0.273025
C -2.980426 0.250014 0.388088
C 2.184815 -1.252080 -0.213294
C 1.888840 1.586209 0.086629
C 3.316441 -0.396738 -0.224422
C 3.167078 1.004621 -0.076182
H -3.184737 1.161995 0.986463
H -3.334031 -0.650124 0.933358
H 2.288185 -2.334435 -0.331868
H 1.749568 2.665925 0.201017
H 4.313987 -0.829143 -0.351512
H 4.054663 1.644952 -0.090006
H -4.546329 0.522121 -0.867429


