%chk=000069809.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000069809

0 1
 S  -0.1207000      -1.412900     -0.1118000    
 O  -0.5746000      -1.762100      -1.445200    
 O   0.2270000      -2.457700      0.8336000    
 N    1.217500     -0.3475000     -0.2417000    
 N   -1.299200     -0.3885000      0.6024000    
 C    2.037200     -0.1047000      0.9652000    
 C   -1.539800      0.9331000     -8.6000003E-03
 C    3.138400      0.9067000      0.6655000    
 C   -2.969500       1.390800      0.2597000    
 C    4.098800      0.4247000     -0.4244000    
 C   -4.012200      0.4399000     -0.3327000    
 C    5.222200       1.423300     -0.6558000    
 C   -5.425200      0.9550000     -0.1062000    
 H    2.475000      -1.047300       1.309200    
 H    1.396400      0.2954000       1.758100    
 H   -1.373400      0.8896000      -1.090300    
 H  -0.8374000       1.655200      0.4206000    
 H    2.689200       1.859200      0.3574000    
 H    3.698500       1.100400       1.588200    
 H   -3.130400       1.475500       1.341800    
 H   -3.103800       2.393300     -0.1641000    
 H    1.102400      0.4622000     -0.8646000    
 H   -1.286400     -0.3507000       1.630600    
 H    3.563700      0.2733000      -1.368600    
 H    4.531100     -0.5410000     -0.1375000    
 H   -3.923800     -0.5547000      0.1186000    
 H   -3.840600      0.3248000      -1.409200    
 H    4.825500       2.392900     -0.9735000    
 H    5.808100       1.573400      0.2566000    
 H    5.897500       1.060000      -1.436700    
 H   -5.640100       1.053400      0.9627000    
 H   -5.566700       1.933000     -0.5771000    
 H   -6.154700      0.2622000     -0.5372000    


%chk=000069809-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000069809

0 1
S 0.000085 -0.598789 -0.660246
O -0.483355 -0.489069 -2.198556
O 0.430105 -1.956004 0.103595
N 1.491258 0.469516 -0.603566
N -1.411038 0.013428 0.323363
C 2.120722 0.687219 0.717568
C -2.048796 1.283816 -0.079560
C 3.595134 1.114951 0.521837
C -3.518560 1.302852 0.405853
C 4.477419 0.015392 -0.108010
C -4.404459 0.235039 -0.271389
C 5.932829 0.481268 -0.323358
C -5.846702 0.232392 0.277732
H 2.088425 -0.279022 1.254720
H 1.583968 1.446817 1.329073
H -2.027516 1.319202 -1.185012
H -1.509394 2.175685 0.309933
H 3.637099 2.032589 -0.101307
H 3.996465 1.395568 1.517440
H -3.547057 1.169455 1.507449
H -3.925100 2.315214 0.203712
H 1.325097 1.302703 -1.190723
H -1.228948 -0.143795 1.326009
H 4.029530 -0.298871 -1.068496
H 4.463874 -0.877901 0.548321
H -3.939628 -0.757943 -0.130087
H -4.420355 0.418555 -1.364459
H 5.976728 1.350527 -1.006944
H 6.405699 0.780671 0.631560
H 6.547529 -0.323798 -0.765147
H -5.859545 0.012840 1.362416
H -6.337853 1.212977 0.127819
H -6.463661 -0.533283 -0.226539


