%chk=000176545.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176545

0 1
 S    5.006000     -0.3799000      4.1299999E-02
 O   -1.723200     -0.7439000      -1.199200    
 O    5.272100      -1.277600      -1.073800    
 O    5.784600      0.8420000      0.1880000    
 N   -4.196900      9.3099996E-02 -0.3195000    
 N  -0.7490000       1.052300     -4.3000001E-02
 N    5.099000      -1.267600       1.498200    
 C   -6.381500     -0.4305000      0.3155000    
 C   -5.426700      -1.449400      0.9302000    
 C   -5.498500      0.7296000     -0.1199000    
 C   -4.045100     -0.8231000      0.8104000    
 C   -3.112200       1.059900     -0.4005000    
 C   -1.797400      0.3281000     -0.6071000    
 C   0.6242000      0.7105000     -2.3200000E-02
 C    3.311800      4.1900001E-02  1.6400000E-02
 C    1.525700       1.564200      0.5906000    
 C    1.037400     -0.4702000     -0.6175000    
 C    2.879000       1.227400      0.6106000    
 C    2.390800     -0.8069000     -0.5975000    
 H   -5.872800       1.200100      -1.034600    
 H   -5.464400       1.486700      0.6741000    
 H   -3.802900     -0.2878000       1.737900    
 H   -3.288400      -1.596700      0.6491000    
 H   -6.893300     -0.8750000     -0.5463000    
 H   -7.145400     -0.1078000       1.030000    
 H   -5.680800      -1.664700       1.973000    
 H   -5.478600      -2.390400      0.3699000    
 H   -3.253000       1.718400      -1.265800    
 H   -3.071200       1.686100      0.4994000    
 H  -0.9742000       1.936400      0.4078000    
 H    1.199000       2.489100       1.057500    
 H   0.3880000      -1.179000      -1.109300    
 H    3.577800       1.900000       1.100100    
 H    2.705800      -1.738300      -1.060000    
 H    5.238900      -2.283000       1.429700    
 H    5.587400     -0.8333000       2.290900    


%chk=000176545-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000176545

0 1
S 5.260235 -0.313205 -0.120055
O -1.730668 -1.012169 -0.682988
O 5.491425 -1.494535 -1.218171
O 6.046481 1.113648 -0.159518
N -4.308755 0.104684 -0.118931
N -0.684460 0.919907 0.146532
N 5.637120 -1.007852 1.548459
C -6.672976 -0.250462 0.050392
C -5.896945 -1.470891 0.653509
C -5.593120 0.847899 -0.163386
C -4.471109 -0.936401 0.926056
C -3.124025 0.942256 -0.037327
C -1.805177 0.159757 -0.229305
C 0.688611 0.578945 0.061331
C 3.421878 0.038376 -0.038430
C 1.630054 1.545377 0.519138
C 1.143886 -0.663533 -0.463924
C 3.009336 1.279163 0.474358
C 2.526682 -0.932098 -0.513381
H -5.700181 1.378946 -1.126940
H -5.657028 1.610280 0.656433
H -4.405912 -0.498537 1.956935
H -3.691284 -1.707631 0.822344
H -7.146245 -0.529240 -0.905839
H -7.469413 0.108457 0.725236
H -6.368807 -1.860644 1.572046
H -5.849828 -2.292341 -0.080616
H -3.176152 1.703684 -0.842871
H -3.053691 1.514546 0.933337
H -0.885693 1.843319 0.541058
H 1.280984 2.508845 0.910511
H 0.416090 -1.392895 -0.821891
H 3.746159 2.017411 0.804967
H 2.900772 -1.870200 -0.935806
H 5.802456 -2.023744 1.449565
H 6.461301 -0.498422 1.910573


