%chk=000071158.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071158

0 1
 S    2.570100      0.2285000      0.1841000    
 O    3.288900       1.048000      -1.029300    
 O    3.290200      -1.013200      0.3996000    
 O    2.302100       1.149500       1.273700    
 O   -3.150800     -0.2624000       1.211800    
 N   -1.939900     -0.2494000     -0.7776000    
 C   0.1802000      -1.065200      0.1758000    
 C    1.053000     -0.1264000     -0.6460000    
 C   -1.128300      -1.408600     -0.5269000    
 C   -2.887900      0.2290000      0.1173000    
 C   -3.577700       1.470100     -0.3824000    
 H   0.7235000      -1.995500      0.3801000    
 H  -3.3199999E-02 -0.6076000       1.149800    
 H    1.304800     -0.5899000      -1.605600    
 H   0.5551000      0.8300000     -0.8324000    
 H  -0.9300000      -1.884200      -1.493300    
 H   -1.697900      -2.116600      8.5000001E-02
 H   -1.797200      0.2456000      -1.653300    
 H    3.578000      0.5016000      -1.797600    
 H   -4.459200       1.674000      0.2317000    
 H   -2.890300       2.318100     -0.3197000    
 H   -3.897600       1.335900      -1.419700    


%chk=000071158-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000071158

0 1
S 2.666956 0.137982 0.101899
O 3.433734 0.783640 -1.476100
O 3.411630 -1.224350 0.556051
O 2.506425 1.350149 1.160118
O -2.865716 -0.112884 1.323224
N -2.066735 -0.262072 -0.847831
C 0.107822 -1.087156 0.153959
C 1.000378 -0.266701 -0.773351
C -1.237956 -1.438920 -0.539811
C -2.856819 0.328262 0.134790
C -3.696443 1.520165 -0.311765
H 0.613910 -2.030277 0.432940
H -0.116596 -0.534544 1.083487
H 1.334463 -0.803625 -1.675562
H 0.608254 0.732293 -1.019498
H -1.061962 -2.002425 -1.474436
H -1.807041 -2.081548 0.155116
H -2.102690 0.094329 -1.803151
H 4.345248 1.131181 -1.257440
H -4.759344 1.308314 -0.104315
H -3.418060 2.403207 0.288704
H -3.583557 1.766281 -1.381928


