%chk=000020559.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020559

0 1
 S    3.334700       1.806600      0.6668000    
 N    1.991000     -0.2312000     -0.6240000    
 C   0.9939000     -0.9487000      0.1987000    
 C  -0.3724000     -0.3583000      0.1007000    
 C    1.030400      -2.419600     -0.2355000    
 C  -0.7822000      0.2593000      -1.080900    
 C   -1.240100     -0.4233000       1.190800    
 C   -2.059700      0.8119000      -1.172500    
 C   -2.517700      0.1291000       1.099300    
 C   -2.927400      0.7467000     -8.2400002E-02
 C    2.549500      0.6275000     -6.1099999E-02
 H    1.306500     -0.9324000       1.255300    
 H   0.7450000      -2.530900      -1.288000    
 H   0.3424000      -3.025800      0.3637000    
 H    2.038400      -2.833100     -0.1203000    
 H  -0.1331000      0.3118000      -1.950600    
 H  -0.9348000     -0.9032000       2.116900    
 H   -2.380200       1.289900      -2.093600    
 H   -3.193700      7.7900000E-02   1.947800    
 H   -3.922500       1.176000     -0.1540000    


%chk=000020559-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000020559

0 1
S 4.095484 1.588566 -0.949926
N 2.009459 -0.076167 0.021350
C 0.959373 -0.925549 0.511504
C -0.432968 -0.318532 0.280138
C 1.070421 -2.335148 -0.140578
C -0.713125 0.493061 -0.844671
C -1.475810 -0.631498 1.185244
C -2.020439 0.983527 -1.061415
C -2.783702 -0.143807 0.968139
C -3.060351 0.665194 -0.158080
C 2.893486 0.631109 -0.389037
H 1.108220 -1.043170 1.604936
H 0.925801 -2.264247 -1.231991
H 0.287711 -2.993516 0.273290
H 2.059861 -2.779810 0.062963
H 0.090347 0.754512 -1.542140
H -1.266332 -1.251379 2.066627
H -2.225458 1.616256 -1.931953
H -3.581319 -0.388308 1.678176
H -4.072659 1.049106 -0.325477


