%chk=000132484.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000132484

0 1
 S   -4.672300     -0.6079000      0.2256000    
 O    1.315200       2.259100     -0.6055000    
 O   -4.701800      -2.042600      0.4731000    
 O   -5.345500      0.2988000       1.144900    
 N    4.998900     -0.4413000      0.1191000    
 N   -5.244900     -0.3096000      -1.356400    
 C    2.130100      0.1049000     -2.5400000E-02
 C    2.991900      0.5809000       1.142800    
 C    2.987200     -8.5000001E-02  -1.275400    
 C    4.201200     -0.3330000       1.348500    
 C    4.196100     -0.9776000     -0.9886000    
 C    1.045300       1.103000     -0.2882000    
 C    6.178700      -1.275600      0.3467000    
 C  -0.3772000      0.6774000     -0.1605000    
 C  -0.7016000     -0.6342000     -0.4268000    
 C   -1.315600       1.611400      0.2191000    
 C   -3.005700     -0.1091000      7.5599998E-02
 C   -2.033000      -1.032600     -0.3073000    
 C   -2.647000       1.212900      0.3388000    
 H    1.726000     -0.8665000      0.2730000    
 H    3.342200       1.607400      0.9700000    
 H    2.393900      0.6113000       2.062200    
 H    2.385500     -0.5294000      -2.077700    
 H    3.336700      0.8851000      -1.653800    
 H    4.815000      9.0000004E-02   2.153100    
 H    3.862700      -1.322400       1.683800    
 H    3.856100      -1.998100     -0.7675000    
 H    4.806100      -1.028300      -1.898800    
 H    6.804100     -0.8498000       1.139100    
 H    6.800400      -1.317000     -0.5546000    
 H    5.913000      -2.300500      0.6299000    
 H   1.7000001E-02  -1.369900     -0.7705000    
 H   -1.049100       2.642500      0.4302000    
 H   -2.292900      -2.063200     -0.5327000    
 H   -3.388800       1.950000      0.6331000    
 H   -5.453200      -1.122300      -1.949200    
 H   -5.891000      0.4780000      -1.488900    


%chk=000132484-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000132484

0 1
S -4.795703 -0.540890 -0.323267
O 1.276270 2.455705 0.784907
O -4.926904 -2.100909 0.125672
O -5.747385 0.648383 0.251572
N 4.939571 -0.579820 -0.204741
N -4.958157 -0.521113 -2.155489
C 2.213815 0.213519 0.593476
C 3.472488 0.754568 1.308525
C 2.581885 -0.148937 -0.881963
C 4.630656 -0.255874 1.207754
C 3.763357 -1.138728 -0.905036
C 1.061759 1.220597 0.609241
C 6.131235 -1.439306 -0.336982
C -0.354722 0.740441 0.370558
C -0.691573 -0.632872 0.229248
C -1.381873 1.721093 0.305306
C -3.001933 -0.018380 -0.056158
C -2.029437 -1.026679 0.013316
C -2.723396 1.350466 0.091036
H 1.891483 -0.721131 1.099413
H 3.768858 1.711002 0.844541
H 3.248583 0.961195 2.371964
H 1.717882 -0.588743 -1.414666
H 2.875984 0.775534 -1.412854
H 5.538495 0.172036 1.672239
H 4.368729 -1.183602 1.787131
H 3.435878 -2.112389 -0.445754
H 4.047300 -1.350915 -1.953068
H 7.000003 -0.944940 0.133112
H 6.363638 -1.593677 -1.406016
H 6.007888 -2.445953 0.139130
H 0.080515 -1.405171 0.293820
H -1.098202 2.770808 0.431021
H -2.315230 -2.079560 -0.073851
H -3.530212 2.089475 0.062687
H -5.236291 -1.468402 -2.461439
H -5.641554 0.209968 -2.413585


