%chk=000076312.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076312

0 1
 S    2.479900     -0.4607000      0.1225000    
 O    3.408600      0.5006000      0.6996000    
 O    2.352700      -1.786400      0.7123000    
 O   -3.796600     -0.1622000     -5.0900001E-02
 O   -2.549900      -1.967400      2.7600000E-02
 N   -2.673000     -0.7192000     -7.0000002E-03
 C   0.9023000      0.2850000      6.1799999E-02
 C  -0.2448000     -0.5083000      5.1800001E-02
 C   0.7895000       1.674800      2.3300000E-02
 C   -1.504900      8.8100001E-02  3.1999999E-03
 C    2.924300     -0.6934000      -1.583800    
 C  -0.4705000       2.271300     -2.5100000E-02
 C   -1.617600       1.477900     -3.5300002E-02
 H  -0.1418000      -1.590200      7.4600004E-02
 H    1.669200       2.312200      2.3000000E-02
 H    2.952900      0.2790000      -2.079100    
 H    3.912700      -1.156700      -1.616400    
 H    2.190100      -1.348700      -2.056200    
 H  -0.5579000       3.353400     -5.6699999E-02
 H   -2.582300       1.977300     -7.4000001E-02


%chk=000076312-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000076312

0 1
S 2.567376 -0.455162 0.124654
O 3.572988 0.707941 0.684028
O 2.386974 -1.906198 0.854117
O -3.908733 -0.130629 -0.020431
O -2.606458 -2.004716 -0.046845
N -2.765139 -0.726262 -0.023046
C 0.835077 0.338871 0.023224
C -0.279678 -0.507984 0.019003
C 0.757041 1.741406 0.042488
C -1.541444 0.124271 -0.003080
C 3.049778 -0.792614 -1.698458
C -0.527229 2.335956 0.027319
C -1.684763 1.529240 -0.001643
H -0.190863 -1.598431 0.062143
H 1.673871 2.338537 0.100431
H 3.054369 0.176285 -2.216084
H 4.053265 -1.237318 -1.642267
H 2.308209 -1.494748 -2.103220
H -0.623225 3.425664 0.044876
H -2.688516 1.962293 -0.012009


