%chk=000175146.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000175146

0 1
 S   -3.082600       2.172700     -0.1813000    
 O    5.685200      0.5598000       1.764000    
 O   -3.507600       2.203600       1.212600    
 O   -3.381800       3.306000      -1.047700    
 O    5.456400       1.766600     -0.1419000    
 O    2.970500      -3.681800      0.2228000    
 O   -4.308500      -1.858500       1.371700    
 N    2.789500       1.246800     -0.3100000    
 N   -3.663900      0.7425000     -0.9100000    
 N    3.908700      -3.659900      -1.876700    
 N   -3.888100     -0.5623000       1.099400    
 C    3.520400      0.5953000      0.7584000    
 C    3.346600     -0.9285000      0.6818000    
 C    3.795900      -1.587900     -0.6274000    
 C    1.423800       1.461900     -0.2803000    
 C   -1.358400       1.900600     -0.2196000    
 C    4.968100       1.041800      0.7155000    
 C   0.6483000       1.046500      0.8200000    
 C   0.7676000       2.103000      -1.349400    
 C  -0.7292000       1.263700      0.8501000    
 C  -0.6099000       2.320300      -1.319200    
 C    3.504300      -3.071500     -0.7005000    
 C   -3.999100     -0.4467000     -0.2195000    
 C   -4.474500      -1.606900     -0.8375000    
 C   -4.655100      -2.470400      0.2103000    
 C   -5.126700      -3.856700      0.3143000    
 H    3.166600      0.9622000       1.730700    
 H    2.297500      -1.194600      0.8553000    
 H    3.902700      -1.393000       1.507000    
 H    3.288300       1.494500      -1.157700    
 H    4.874800      -1.447500     -0.7625000    
 H    3.291500      -1.116800      -1.479100    
 H    1.080300      0.5530000       1.684900    
 H    1.335700       2.435400      -2.215700    
 H   -1.291500      0.9272000       1.716400    
 H   -1.079900       2.812100      -2.166200    
 H   -3.873300      0.7650000      -1.916300    
 H   -4.661100      -1.797700      -1.884100    
 H    6.619300      0.8580000       1.735800    
 H    3.771500      -4.651900      -2.039200    
 H    4.352900      -3.131800      -2.621000    
 H   -5.380900      -4.262500     -0.6698000    
 H   -4.353600      -4.494200      0.7541000    
 H   -6.019300      -3.913400      0.9449000    


%chk=000175146-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000175146

0 1
S -3.074133 1.927493 -0.431264
O 5.841290 0.717001 1.961895
O -3.705965 1.890384 1.064861
O -3.422881 3.118056 -1.486849
O 5.608697 1.827793 -0.065964
O 4.925399 -3.556513 0.264117
O -3.935586 -2.455474 0.753722
N 2.930514 1.331515 -0.126304
N -3.682090 0.360278 -1.427770
N 4.034966 -3.557295 -1.877425
N -3.189511 -1.333795 0.182271
C 3.685464 0.602948 0.893493
C 3.689263 -0.950755 0.706908
C 4.204420 -1.401108 -0.676534
C 1.547791 1.436927 -0.175263
C -1.237397 1.714136 -0.332317
C 5.119328 1.131156 0.853138
C 0.699218 0.812546 0.793165
C 0.948659 2.206331 -1.224590
C -0.697047 0.949416 0.715949
C -0.443768 2.343437 -1.311221
C 4.415351 -2.923141 -0.706625
C -4.077495 -0.755675 -0.681743
C -5.344728 -1.453921 -0.716087
C -5.214616 -2.503681 0.172637
C -6.111474 -3.606425 0.632868
H 3.285288 0.819200 1.904805
H 2.658114 -1.320879 0.850768
H 4.314695 -1.407398 1.494005
H 3.497541 1.854757 -0.800015
H 5.188334 -0.935579 -0.888023
H 3.514125 -1.073120 -1.474941
H 1.122525 0.218140 1.607183
H 1.588691 2.699025 -1.965739
H -1.352471 0.464967 1.445490
H -0.910839 2.939382 -2.101502
H -4.403561 0.743596 -2.060806
H -6.217391 -1.198000 -1.311660
H 6.782637 1.035146 1.901101
H 4.180524 -4.564139 -1.955227
H 3.594495 -3.057513 -2.647570
H -7.093937 -3.529505 0.140831
H -5.678347 -4.595281 0.397515
H -6.262691 -3.560435 1.726118


