%chk=000069228.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000069228

0 1
 S    2.732900     -0.3296000     -8.5800000E-02
 O    3.165400     -0.4916000       1.482600    
 O   -2.819300       1.658000      4.3699998E-02
 O    2.726500      -1.665500     -0.6642000    
 O    3.543100      0.7277000     -0.6704000    
 O   -2.087200      -2.354600     -1.8800000E-02
 O   -3.535700     -0.7057000      2.8600000E-02
 N   -2.356300      -1.130100      3.9999999E-04
 C    1.086700      0.2508000     -5.0200000E-02
 C   2.6799999E-02 -0.6561000     -4.0500000E-02
 C   -1.288100     -0.1915000     -9.6000005E-03
 C   0.8316000       1.622000     -2.9100001E-02
 C   -1.543100       1.179700      1.1500000E-02
 C  -0.4833000       2.086500      1.9000000E-03
 H   0.2427000      -1.721300     -4.8300002E-02
 H    1.640400       2.347100     -2.7700000E-02
 H  -0.6750000       3.155900      2.0500001E-02
 H    2.634900      -1.140300       2.002500    
 H   -3.424700      0.9940000      0.4070000    


%chk=000069228-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000069228

0 1
S 2.735640 -0.427895 -0.092704
O 2.945944 -0.527041 1.748211
O -2.872837 1.779619 0.082404
O 2.747076 -1.923037 -0.706004
O 3.714177 0.723502 -0.668396
O -2.256574 -2.387497 -0.078131
O -3.709859 -0.633499 0.006911
N -2.485580 -1.130406 -0.029071
C 0.987754 0.221179 -0.023106
C -0.056266 -0.698016 -0.040439
C -1.373772 -0.183333 -0.010340
C 0.797689 1.622626 0.027490
C -1.623156 1.233112 0.046388
C -0.509688 2.119519 0.058233
H 0.112808 -1.778458 -0.089974
H 1.661421 2.294889 0.025406
H -0.713353 3.192367 0.096007
H 3.866903 -0.873197 1.936640
H -3.550026 1.010966 0.064572


