%chk=000057789.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000057789

0 1
 S    4.147000     -0.6435000      2.2800000E-02
 O   -1.884000      0.3897000      5.3500000E-02
 O   -3.074900      -1.576900     -9.8099999E-02
 N  -0.7838000     -0.4750000      1.3000000E-03
 N   -4.126400      0.4844000      3.9000001E-02
 C    1.486900       2.402400     -0.4138000    
 C    2.795400       1.810700      0.1307000    
 C   0.2545000       1.745200      0.2167000    
 C    2.741300      0.3160000      6.0300000E-02
 C    1.581600     -0.4348000      3.0400001E-02
 C   0.2938000      0.2351000      6.3000001E-02
 C    1.867900      -1.831200     -3.9500002E-02
 C    3.223300      -2.083400     -4.9600001E-02
 C   -3.031100     -0.3533000     -1.1400000E-02
 C   -5.491700      1.4600000E-02 -5.2999998E-03
 H    1.468200       3.483000     -0.2324000    
 H    1.451700       2.257300      -1.501800    
 H    2.933200       2.116800       1.174700    
 H    3.639300       2.204400     -0.4471000    
 H  -0.6250000       2.188500     -0.2591000    
 H   0.2099000       1.973800       1.288100    
 H    1.123600      -2.616400     -7.7799998E-02
 H    3.714400      -3.045300     -9.4899997E-02
 H   -3.964200       1.483800      0.1156000    
 H   -5.979100      0.2957000      0.9314000    
 H   -5.537200      -1.069100     -0.1360000    
 H   -5.996100      0.5106000     -0.8380000    


%chk=000057789-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000057789

0 1
S 4.246116 -0.733616 0.100510
O -1.959758 0.368103 0.067601
O -3.198543 -1.634305 -0.408581
N -0.737885 -0.462673 -0.001467
N -4.216006 0.413394 0.150613
C 1.620361 2.465661 -0.469741
C 2.907301 1.860430 0.150051
C 0.335586 1.842407 0.128214
C 2.815291 0.358525 0.091619
C 1.626923 -0.370854 0.024778
C 0.328448 0.322028 0.037277
C 1.827630 -1.807980 -0.023606
C 3.155628 -2.172442 0.008745
C -3.153223 -0.430638 -0.094422
C -5.603615 -0.043054 0.040320
H 1.606355 3.559406 -0.307285
H 1.633413 2.293758 -1.562604
H 3.011684 2.197205 1.202887
H 3.800260 2.228905 -0.388266
H -0.562984 2.239967 -0.373806
H 0.244400 2.123670 1.198296
H 0.997401 -2.514287 -0.079175
H 3.599173 -3.165792 -0.016505
H -4.006815 1.373452 0.423995
H -6.129268 0.026676 1.010866
H -5.587816 -1.098470 -0.274797
H -6.161556 0.543627 -0.712815


