%chk=000015438.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000015438

0 1
 S   -2.809600     -0.6903000     -7.8800000E-02
 O   -2.776400      -1.503300       1.117600    
 O   -4.055600     -0.1874000     -0.6156000    
 O    1.769000     -0.2202000      0.5846000    
 O    2.989500      0.7703000      -1.099500    
 N   0.6988000      0.4351000     -3.8800001E-02
 N    3.982700     -0.5786000      0.5027000    
 C   -1.739400      0.7122000      0.1961000    
 C   -2.293400       1.551400       1.348200    
 C   -1.670000       1.548300      -1.082400    
 C  -0.3852000      0.1662000      0.6122000    
 C   -1.971600      -1.574000      -1.368200    
 C    2.919200      6.0800001E-02 -0.1005000    
 C    5.342000     -0.4905000      2.2399999E-02
 H   -3.296000       1.931500       1.122400    
 H   -1.645500       2.411100       1.555000    
 H   -2.362700      0.9710000       2.275600    
 H   -1.076900       2.456200     -0.9171000    
 H   -2.662400       1.868600      -1.417700    
 H   -1.193000       1.017200      -1.911500    
 H  -0.3577000     -0.4712000       1.515800    
 H   -2.530100      -2.497400      -1.543800    
 H   -1.969900     -0.9881000      -2.287000    
 H  -0.9590000      -1.829700      -1.055900    
 H    3.799200      -1.147000       1.323900    
 H    5.656500      -1.487700     -0.2948000    
 H    5.975100     -0.1577000      0.8486000    
 H    5.425400      0.2075000     -0.8138000    


%chk=000015438-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000015438

0 1
S -2.405442 -0.773696 -0.368855
O -2.345433 -1.851668 0.862661
O -3.834679 -0.442635 -1.104239
O 1.871016 0.321434 0.855376
O 2.302418 -1.019082 -1.065974
N 0.657144 0.770458 0.137377
N 3.998922 -0.369851 0.438587
C -1.714273 1.097886 0.418802
C -2.764660 1.350999 1.497411
C -1.772971 2.034269 -0.783220
C -0.375349 0.726342 0.950701
C -1.168702 -1.332132 -1.727971
C 2.721628 -0.415530 -0.054517
C 5.091201 -1.148147 -0.156460
H -3.769045 1.428906 1.045337
H -2.544052 2.303258 2.016761
H -2.781641 0.537532 2.244516
H -1.642069 3.076945 -0.435791
H -2.761287 1.958579 -1.271312
H -0.975523 1.824564 -1.514384
H -0.298834 0.344691 1.979527
H -1.442972 -2.380338 -1.914256
H -1.366568 -0.690485 -2.596832
H -0.141375 -1.225446 -1.348986
H 4.169926 0.216112 1.256526
H 5.511422 -1.867101 0.570089
H 5.898911 -0.485573 -0.516480
H 4.685290 -1.705991 -1.014695


