%chk=000068449.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068449

0 1
 S    2.779900      0.6657000     -7.7399999E-02
 O   -3.384800      -1.234600      4.2100001E-02
 O    2.810000       1.366100       1.396400    
 O    3.963100     -0.1698000     -0.1820000    
 O    2.494600       1.689600      -1.065600    
 N   -3.917700       1.489800      1.7400000E-02
 C   6.1200000E-02  8.1299998E-02 -2.6799999E-02
 C   -1.010300     -0.8429000      6.9999998E-04
 C    1.381200     -0.3979000     -4.1700002E-02
 C   -2.330300     -0.3635000      1.5400000E-02
 C  -0.2188000       1.457500     -3.9000001E-02
 C  -0.7301000      -2.219000      1.2500000E-02
 C    1.641200      -1.768500     -2.9300001E-02
 C   -2.590200       1.007300      3.5000001E-03
 C   -1.536500       1.916100     -2.3900000E-02
 C   0.5875000      -2.677300     -2.3000001E-03
 H   0.5412000       2.228100     -1.0200000E-02
 H   -1.511700      -2.973300      1.6500000E-02
 H    2.650100      -2.169400     -3.7900001E-02
 H   -1.726400       2.986600     -2.3200000E-02
 H   0.7905000      -3.744500      3.8999999E-03
 H   -4.096600       2.485100      1.0900000E-02
 H   -4.689400      0.8363000      3.9799999E-02
 H   -3.142400      -2.035800      0.5326000    
 H    2.921900      0.7484000       2.156800    


%chk=000068449-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000068449

0 1
S 2.893653 0.569649 -0.049447
O -3.562856 -1.164758 0.054846
O 2.759908 1.153011 1.714753
O 4.203759 -0.368553 -0.197464
O 2.757719 1.874925 -0.999996
N -3.974283 1.475303 0.055568
C 0.044968 0.069439 -0.002484
C -1.070199 -0.877377 0.013714
C 1.347883 -0.514503 -0.016469
C -2.399635 -0.359912 0.035764
C -0.234768 1.472108 -0.001704
C -0.788750 -2.286850 0.011834
C 1.623970 -1.877048 -0.015087
C -2.662803 1.028484 0.036276
C -1.550025 1.930267 0.017343
C 0.516647 -2.777471 -0.004523
H 0.588464 2.189455 -0.029123
H -1.607170 -3.019214 0.019558
H 2.657005 -2.236767 -0.026960
H -1.749661 3.008128 0.016214
H 0.702023 -3.855677 -0.006657
H -4.191086 2.466845 0.054659
H -4.728215 0.793123 0.067287
H -3.351493 -2.128033 0.074462
H 3.512146 1.796825 1.866835


