%chk=000117412.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117412

0 1
 S  -0.6305000      -1.520900     -0.1212000    
 O   -3.816800      -1.064300       1.038200    
 N   0.1358000       1.013900      0.2761000    
 C    1.324600      0.2706000      0.1456000    
 C   0.1950000       2.444500      0.5057000    
 C  -0.9972000      0.2063000      0.1593000    
 C    1.112700      -1.109400     -7.3200002E-02
 C    2.630000      0.7486000      0.2094000    
 C   0.2395000       3.209700     -0.8061000    
 C    2.164500      -2.001800     -0.2270000    
 C   -2.286800      0.5713000      0.2320000    
 C    3.697000     -0.1433000      5.5799998E-02
 C    3.465900      -1.507700     -0.1609000    
 C   -3.365700     -0.4370000      8.2500003E-02
 C   -3.867900     -0.6806000      -1.316100    
 H  -0.6914000       2.768500       1.064900    
 H    1.039500       2.727200       1.144400    
 H    2.854000       1.798300      0.3673000    
 H    1.130700       2.954600      -1.388200    
 H  -0.6372000       2.986500      -1.423200    
 H   0.2555000       4.287500     -0.6162000    
 H    1.990100      -3.059600     -0.3950000    
 H   -2.599600       1.595100      0.3975000    
 H    4.717800      0.2267000      0.1030000    
 H    4.308000      -2.184100     -0.2784000    
 H   -3.351700     -4.2300001E-02  -2.039000    
 H   -3.696300      -1.725500      -1.587400    
 H   -4.936600     -0.4540000      -1.356700    


%chk=000117412-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000117412

0 1
S -0.616495 -1.457463 -0.665136
O -4.655736 0.951523 -0.416534
N 0.138017 0.940699 0.205846
C 1.344894 0.223234 0.056585
C 0.114872 2.337596 0.693785
C -1.039402 0.265328 -0.168170
C 1.150439 -1.109809 -0.392884
C 2.655426 0.692373 0.306467
C 0.216197 3.373570 -0.445263
C 2.223924 -1.991649 -0.584898
C -2.305727 0.820402 -0.165216
C 3.741249 -0.192472 0.114419
C 3.535324 -1.521826 -0.324135
C -3.606352 0.224243 -0.482299
C -3.727670 -1.244666 -0.890035
H -0.811593 2.483358 1.274849
H 0.951611 2.456294 1.404611
H 2.837999 1.719922 0.634018
H 1.154661 3.247855 -1.013032
H -0.627617 3.272592 -1.149127
H 0.197193 4.396620 -0.028693
H 2.056689 -3.016975 -0.928879
H -2.395823 1.878763 0.106176
H 4.758848 0.164273 0.305458
H 4.388868 -2.191357 -0.468910
H -3.171843 -1.452058 -1.824644
H -3.332263 -1.919966 -0.107716
H -4.792790 -1.471604 -1.053542


