%chk=000124861.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124861

0 1
 S   -4.871800      -2.546000       1.703900    
 O   0.9773000      -2.294500     -0.8831000    
 O    3.002300       1.814600      6.5000001E-03
 O    4.628200      -2.527900      0.3796000    
 O    3.623000     -0.9418000       1.659700    
 N    2.044200     -0.2529000     -0.5093000    
 N   -3.971800      -1.383200     -0.6487000    
 C  -0.4787000      0.9228000     -0.1838000    
 C  -0.4001000     -0.4435000     -0.4870000    
 C   0.6666000       1.715000     -2.1199999E-02
 C   -1.755000       1.521100     -3.4499999E-02
 C   0.9213000      -1.089200     -0.6479000    
 C    2.009700       1.112200     -0.1723000    
 C   -1.561700      -1.210700     -0.6411000    
 C   0.5566000       3.077500      0.2841000    
 C   -2.909400      0.7394000     -0.1929000    
 C    3.355300     -0.8523000     -0.7342000    
 C   -1.848300       2.887400      0.2704000    
 C   -2.812000     -0.6173000     -0.4940000    
 C  -0.6995000       3.659200      0.4286000    
 C    3.869400      -1.417400      0.5589000    
 C   -4.345600      -1.872600      0.3582000    
 H   -1.500800      -2.270200     -0.8792000    
 H    1.436500       3.702200      0.4122000    
 H   -3.893000       1.193700     -8.2199998E-02
 H    4.070700     -0.1090000      -1.099200    
 H    3.267900      -1.654200      -1.474800    
 H   -2.819300       3.364000      0.3886000    
 H  -0.7845000       4.715900      0.6650000    
 H    4.951700      -2.891600       1.231300    


%chk=000124861-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000124861

0 1
S -6.227152 -3.068632 0.150005
O 1.092724 -2.335096 -0.707446
O 3.133647 1.848366 -0.415128
O 5.039466 -2.259081 0.284021
O 3.393716 -1.389766 1.683251
N 2.084935 -0.233181 -0.560789
N -3.915812 -1.432297 0.049243
C -0.446804 0.975970 -0.095311
C -0.364867 -0.441632 -0.281796
C 0.725839 1.792291 -0.139462
C -1.735212 1.583966 0.140810
C 0.951507 -1.092827 -0.526405
C 2.061338 1.180423 -0.372565
C -1.513100 -1.236166 -0.232748
C 0.627159 3.180282 0.045076
C -2.897689 0.757623 0.185695
C 3.393191 -0.875721 -0.748375
C -1.802716 3.005095 0.323596
C -2.792582 -0.635760 0.003107
C -0.641632 3.785423 0.275351
C 3.890320 -1.510609 0.548312
C -4.900214 -2.130405 0.089750
H -1.423170 -2.317731 -0.374635
H 1.542925 3.779011 0.009582
H -3.880567 1.205991 0.365543
H 4.114861 -0.102747 -1.062584
H 3.327108 -1.656742 -1.522281
H -2.776757 3.474058 0.503386
H -0.704411 4.868887 0.417025
H 5.373152 -2.668292 1.127371


