%chk=000006722.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006722

0 1
 S    2.313000      0.2955000     -7.7000000E-02
 O    2.435700      0.9782000       1.399200    
 O    3.373000     -0.6890000     -0.1887000    
 O    2.157900       1.350100      -1.060500    
 N   0.3769000       2.331000     -4.8700001E-02
 C  -0.4979000     -4.1999999E-03 -1.6700000E-02
 C   0.7839000     -0.5777000     -4.0199999E-02
 C   -1.633200     -0.8487000      1.1900000E-02
 C  -0.6780000       1.388500     -2.1000000E-02
 C   0.9441000      -1.963700     -3.5399999E-02
 C   -1.453400      -2.241600      1.5900001E-02
 C   -2.915100     -0.2755000      3.5200000E-02
 C  -0.1724000      -2.794100     -7.7000000E-03
 C   -1.958900       1.940800      2.7999999E-03
 C   -3.075500       1.110400      3.0900000E-02
 H    1.911800      -2.454600     -4.7499999E-02
 H   -2.311800      -2.909800      3.7700001E-02
 H   -3.802000     -0.9055000      5.7300001E-02
 H  -4.8200000E-02  -3.873300     -2.7999999E-03
 H   -2.107200       3.018200      1.1000000E-03
 H   -4.072500       1.540700      4.9600001E-02
 H    1.085200       2.243200      0.6686000    
 H   0.1366000       3.286500     -0.2895000    
 H    2.468400      0.3475000       2.156500    


%chk=000006722-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000006722

0 1
S 2.418508 0.134940 -0.240638
O 2.576063 1.093983 1.402537
O 3.580202 -0.993510 -0.210717
O 2.422796 1.220450 -1.433089
N 0.232773 2.349292 0.530545
C -0.540415 0.023201 0.076343
C 0.714716 -0.676576 0.071332
C -1.712466 -0.850752 -0.032416
C -0.768924 1.458231 0.195982
C 0.867032 -2.062279 0.106465
C -1.552463 -2.276508 0.008701
C -3.019090 -0.295063 -0.186385
C -0.301309 -2.877913 0.113335
C -2.081655 1.952197 -0.023020
C -3.185135 1.092751 -0.226688
H 1.866617 -2.507781 0.090054
H -2.455617 -2.894507 -0.050808
H -3.875756 -0.970786 -0.274963
H -0.197660 -3.966027 0.155027
H -2.242916 3.035939 0.021574
H -4.180094 1.526057 -0.374350
H 1.130043 2.064620 0.944274
H 0.032264 3.345274 0.477703
H 3.532886 1.367670 1.490201


