%chk=000079749.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079749

0 1
 S  -0.1683000      0.1796000      -1.569300    
 O  -0.9801000      -3.580100      0.2278000    
 N   -2.169200      -1.637400      0.1979000    
 C   -2.421000     -0.2535000      6.4099997E-02
 C   -1.595100      0.6566000     -0.6119000    
 C   0.7274000     -0.5817000     -0.3161000    
 C    2.065700     -2.8800000E-02 -6.7599997E-02
 C   0.3038000      -1.640600      0.3825000    
 C   -3.632800      0.2025000      0.6118000    
 C   -1.966900       2.011300     -0.6712000    
 C  -0.9909000      -2.346200      0.2077000    
 C    3.164200     -0.5027000     -0.7879000    
 C    2.243600      0.9726000      0.8892000    
 C   -3.989300       1.549200      0.5504000    
 C   -3.150000       2.456500     -8.2800001E-02
 C    4.434900      2.2399999E-02 -0.5525000    
 C    3.514200       1.497800       1.124500    
 C    4.609800       1.022700      0.4037000    
 H   -2.995500      -2.202200      0.3832000    
 H   0.9624000      -2.106800       1.113500    
 H   -4.304800     -0.4892000       1.116600    
 H   -1.347800       2.736300      -1.196500    
 H    3.046000      -1.282800      -1.536400    
 H    1.400100       1.354200       1.459800    
 H   -4.920600       1.886100      0.9954000    
 H   -3.423900       3.505800     -0.1386000    
 H    5.288000     -0.3476000      -1.113500    
 H    3.650600       2.276700       1.869000    
 H    5.599200       1.431600      0.5870000    


%chk=000079749-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000079749

0 1
S -0.209001 0.793633 -1.372566
O -0.955514 -3.498579 -0.252278
N -2.166734 -1.548391 -0.419802
C -2.563806 -0.217661 -0.104330
C -1.774683 0.919842 -0.408803
C 0.796970 -0.336490 -0.309452
C 2.203756 0.085961 -0.081507
C 0.291312 -1.515129 0.170452
C -3.836480 -0.024073 0.499193
C -2.234869 2.215140 -0.083461
C -0.960524 -2.227031 -0.180959
C 3.230334 -0.894735 0.053387
C 2.562577 1.459695 0.009676
C -4.308227 1.271116 0.791912
C -3.503818 2.398848 0.509003
C 4.563930 -0.510660 0.299177
C 3.898038 1.840674 0.256734
C 4.904480 0.858710 0.405907
H -2.929390 -2.207221 -0.614749
H 0.939199 -2.130710 0.806639
H -4.446520 -0.901121 0.746199
H -1.602274 3.077610 -0.317431
H 2.985366 -1.955110 -0.070361
H 1.784424 2.221429 -0.103239
H -5.294120 1.397369 1.251668
H -3.857526 3.407818 0.743152
H 5.340705 -1.277642 0.391545
H 4.153515 2.903264 0.332893
H 5.942581 1.155745 0.591201


