%chk=000153797.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000153797

0 1
 S    1.383300       1.932700     -0.2782000    
 O   -4.700700     -0.3049000      0.8882000    
 O   -4.162700      -1.579400     -0.8163000    
 N   -1.045000       1.576500      0.7735000    
 N  -0.4548000      0.1781000      -1.098200    
 N   -3.882300     -0.6709000      6.6999998E-03
 N    2.000700     -0.4584000      0.7395000    
 N    3.681300      0.6140000     -0.6143000    
 C   -2.615400     -4.5200001E-02 -6.1200000E-02
 C  -0.2114000       1.143400     -0.1914000    
 C   -2.243600      0.9580000      0.8101000    
 C   -1.671400     -0.3975000      -1.004100    
 C    2.476300      0.5424000     -2.2100000E-02
 C    4.114700      -1.544300      0.3591000    
 C    2.851000      -1.491900      0.9104000    
 C    4.479900     -0.4525000     -0.4018000    
 H   -2.900300       1.321500       1.594500    
 H   -1.847500      -1.172700      -1.743500    
 H    4.776000      -2.386500      0.5128000    
 H    2.475400      -2.304300       1.523500    
 H    5.454400     -0.4036000     -0.8758000    


%chk=000153797-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000153797

0 1
S 1.366786 1.859383 0.605676
O -5.046869 0.154347 0.124584
O -4.107791 -1.677455 -0.878199
N -1.299454 1.830522 0.747121
N -0.297139 -0.131149 -0.323832
N -4.031141 -0.527981 -0.291365
N 2.296521 -0.687250 1.079260
N 3.520337 0.658747 -0.541647
C -2.693921 0.043698 -0.083846
C -0.237743 1.075662 0.317367
C -2.533653 1.307851 0.535328
C -1.537023 -0.650252 -0.512788
C 2.509802 0.428296 0.334705
C 4.266661 -1.597281 -0.018521
C 3.179310 -1.709718 0.879653
C 4.408816 -0.370786 -0.704054
H -3.399793 1.890915 0.860552
H -1.616965 -1.617258 -1.017460
H 4.971189 -2.419452 -0.166911
H 3.006552 -2.617888 1.466432
H 5.233419 -0.188452 -1.400655


