%chk=000100517.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100517

0 1
 S  -1.0400000E-02   1.822700      1.1300000E-02
 N   -1.136400     -0.5135000     -0.6522000    
 N    1.428000     -0.1422000       1.109000    
 N    2.267700      0.8051000     -0.9416000    
 C   -1.374000      0.6737000     -5.0799999E-02
 C   -2.592300       1.032800      0.5029000    
 C    1.382700      0.7055000      6.6000000E-02
 C   -3.633700      0.1140000      0.4355000    
 C   -3.427900      -1.118200     -0.1752000    
 C   -2.172400      -1.380800     -0.6988000    
 C    3.471400     -0.9730000      0.1460000    
 C    2.491700     -0.9721000       1.117800    
 C    3.305600     -5.3900000E-02 -0.8699000    
 H   -2.749900       1.995300      0.9787000    
 H   -4.603900      0.3575000      0.8579000    
 H   -4.225200      -1.849700     -0.2391000    
 H   -1.960100      -2.327200      -1.185100    
 H    4.314100      -1.650300      0.1782000    
 H    2.536100      -1.659700       1.955600    
 H    4.024700      1.9400001E-02  -1.678800    


%chk=000100517-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000100517

0 1
S -0.040762 1.469271 -1.206032
N -1.680217 -0.742903 -1.282466
N 1.143632 -0.456312 0.382256
N 2.592272 1.030285 -0.903046
C -1.446521 0.410017 -0.612828
C -2.242782 0.877766 0.455983
C 1.374548 0.565676 -0.489244
C -3.348471 0.091261 0.853347
C -3.602792 -1.122916 0.175884
C -2.741876 -1.500043 -0.880774
C 3.562903 -0.703642 0.503753
C 2.252342 -1.087893 0.867167
C 3.679781 0.385732 -0.392253
H -1.994381 1.816233 0.958364
H -3.990931 0.418960 1.677268
H -4.446213 -1.763268 0.452634
H -2.900896 -2.431196 -1.436011
H 4.442099 -1.218381 0.898550
H 2.067865 -1.913270 1.563660
H 4.656198 0.760022 -0.718812


