%chk=000123372.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000123372

0 1
 S   -5.230900       1.132300     -4.8000002E-03
 O    2.444400      0.5487000     -0.1442000    
 O    1.947400      -1.632100      0.4211000    
 N   -2.654000      0.2084000      0.4011000    
 C  -0.7866000      -1.264800     -0.1685000    
 C   0.2020000     -0.1071000     -0.3173000    
 C   -2.216600     -0.8569000     -0.5025000    
 C    1.612900     -0.5203000      3.5599999E-02
 C    3.824300      0.3134000      0.1541000    
 C    4.606400       1.585600     -9.4200000E-02
 C   -3.749300      0.5927000      0.2196000    
 H  -0.4866000      -2.092800     -0.8224000    
 H  -0.7480000      -1.646600      0.8598000    
 H  -7.5400002E-02  0.7192000      0.3463000    
 H   0.1972000      0.2490000      -1.353500    
 H   -2.865200      -1.737300     -0.4017000    
 H   -2.264000     -0.5241000      -1.548300    
 H    3.925400      1.5600000E-02   1.203700    
 H    4.205600     -0.4871000     -0.4896000    
 H    5.668000       1.441100      0.1244000    
 H    4.500200       1.906100      -1.135900    
 H    4.224600       2.400600      0.5295000    


%chk=000123372-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000123372

0 1
S -4.193920 2.124600 1.124086
O 2.368610 0.565761 -0.175537
O 1.919048 -1.593779 0.580154
N -2.894805 -0.058425 -0.148249
C -0.823337 -1.425738 -0.245415
C 0.126576 -0.233018 -0.455992
C -2.246941 -1.160730 -0.791692
C 1.532767 -0.528877 0.043188
C 3.789889 0.411514 0.280621
C 4.502516 1.715387 -0.059713
C -3.446997 0.867150 0.390315
H -0.425542 -2.320094 -0.759453
H -0.877483 -1.678470 0.828137
H -0.245075 0.668078 0.067868
H 0.190872 0.046436 -1.525846
H -2.866763 -2.068690 -0.654501
H -2.200800 -0.958682 -1.881419
H 3.781118 0.199310 1.364822
H 4.224397 -0.462042 -0.238005
H 5.559667 1.657203 0.257739
H 4.476449 1.907911 -1.145747
H 4.031556 2.568797 0.456941


