%chk=000015403.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000015403

0 1
 S    2.662300       1.388000      7.3600002E-02
 S    1.597800      -1.353300     -6.2899999E-02
 O  -0.8344000     -0.2575000     -1.4000000E-02
 O   -2.416900       1.415100      6.3100003E-02
 N   6.0699999E-02  0.8197000      4.0700000E-02
 N   -3.005800     -0.8242000     -4.6000000E-02
 C    3.859100      8.5699998E-02 -0.3378000    
 C    3.370600      -1.201900      0.2990000    
 C    1.260600      0.3543000      1.9900000E-02
 C   -2.113700      0.2271000      7.4999998E-03
 C   -4.440200     -0.6530000     -4.3099999E-02
 H    4.852100      0.3575000      3.2000002E-02
 H    3.918600     -1.1300000E-02  -1.427600    
 H    3.910000      -2.067600     -9.6299998E-02
 H    3.511500      -1.182600       1.385500    
 H   -2.634700      -1.767900     -9.6199997E-02
 H   -4.852900      -1.247000      0.7759000    
 H   -4.829800      -1.027400     -0.9929000    
 H   -4.716800      0.3963000      8.2999997E-02


%chk=000015403-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000015403

0 1
S 2.734524 1.410475 0.270871
S 1.685658 -1.500208 -0.037013
O -0.904770 -0.239647 0.042031
O -2.573897 1.487349 -0.066452
N 0.103359 0.835995 0.086036
N -3.086475 -0.812314 -0.009241
C 3.949910 0.095676 -0.348153
C 3.542249 -1.244327 0.267709
C 1.293307 0.292998 0.097533
C -2.257506 0.286395 -0.016583
C -4.544192 -0.677546 -0.074305
H 4.949597 0.413707 -0.008659
H 3.909915 0.072864 -1.448257
H 4.058158 -2.088623 -0.218540
H 3.717026 -1.264889 1.354657
H -2.653864 -1.734616 0.045547
H -5.027091 -1.113935 0.819436
H -4.952893 -1.165945 -0.978208
H -4.784916 0.396591 -0.115010


