%chk=000066907.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066907

0 1
 S    1.229900      0.4866000     -0.9681000    
 O    4.287200      -1.065100      0.8753000    
 O    4.114900      0.7986000     -0.4139000    
 N   -4.487600     -0.3103000      0.6014000    
 C  -0.4731000      0.2490000     -0.5004000    
 C   -3.139300     -0.1224000      0.2317000    
 C   -1.146500       1.243100      0.2095000    
 C   -1.132900     -0.9308000     -0.8442000    
 C   -2.479600       1.057300      0.5757000    
 C   -2.466000      -1.116600     -0.4782000    
 C    2.105900     -0.2023000      0.4646000    
 C    3.587200     -8.7099999E-02  0.2466000    
 H  -0.6487000       2.169100      0.4867000    
 H  -0.6243000      -1.717000      -1.396900    
 H   -2.993400       1.839400       1.128900    
 H   -2.969200      -2.040400     -0.7521000    
 H    1.834000      -1.257300      0.5658000    
 H    1.839200      0.3369000       1.377800    
 H   -4.976200      0.4098000       1.116700    
 H   -4.966100      -1.165800      0.3528000    
 H    5.253200     -0.9744000      0.7308000    


%chk=000066907-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000066907

0 1
S 1.252379 0.591679 -1.106559
O 4.274285 -0.822419 1.247169
O 4.276994 0.382864 -0.741867
N -4.502337 -0.345769 0.662937
C -0.477366 0.290062 -0.539304
C -3.181565 -0.136764 0.267972
C -1.151297 1.253117 0.249964
C -1.166541 -0.883319 -0.930410
C -2.484966 1.047531 0.652573
C -2.500095 -1.100453 -0.533678
C 2.137294 -0.234105 0.354333
C 3.638555 -0.162633 0.179987
H -0.629446 2.171495 0.540432
H -0.656496 -1.623408 -1.556742
H -2.993886 1.805060 1.261057
H -3.020556 -2.013456 -0.847741
H 1.821078 -1.288034 0.428169
H 1.849338 0.273716 1.290394
H -4.993765 0.342662 1.225108
H -5.003883 -1.183428 0.383240
H 5.260880 -0.764099 1.123468


