%chk=000177805.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000177805

0 1
 S    2.019400      -1.382100      0.1972000    
 N  -0.4743000     -0.3510000      0.2208000    
 N    2.870800       1.030300     -0.1737000    
 N   -2.854200     -0.1514000      0.2313000    
 N   -1.536800       1.789500     -2.3600001E-02
 N    4.555800     -0.6247000     -6.2199999E-02
 N   -2.935000      -2.591100     -0.3218000    
 C   0.8718000     -0.1228000      0.1053000    
 C   -1.570900      0.5053000      0.1537000    
 C    1.493000       1.081300     -9.3199998E-02
 C    3.258700     -0.2178000     -3.3799998E-02
 C   -2.806200       2.494700     -0.1340000    
 C   -2.891900      -1.460100     -6.6100001E-02
 H  -0.6895000      -1.323600      0.4260000    
 H    1.017000       2.047100     -0.1896000    
 H   -3.705700      0.3938000      0.2948000    
 H    4.812500      -1.599900      5.0299998E-02
 H    5.318600      3.0800000E-02 -0.1961000    
 H   -3.405200       2.139100     -0.9792000    
 H   -2.597800       3.553100     -0.3232000    
 H   -3.380800       2.450100      0.7973000    


%chk=000177805-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000177805

0 1
S 2.034225 -1.500304 0.040309
N -0.560449 -0.491951 0.126413
N 2.834198 1.068861 -0.043802
N -2.917889 -0.252439 0.079629
N -1.466672 1.695909 -0.038066
N 4.657144 -0.496434 -0.078047
N -3.235006 -2.781792 0.111966
C 0.802296 -0.140797 0.071478
C -1.619648 0.405416 0.049025
C 1.430156 1.092297 0.018135
C 3.323002 -0.153756 -0.037814
C -2.638248 2.580751 -0.149520
C -3.112266 -1.586051 0.094414
H -0.789386 -1.480216 0.253359
H 0.889880 2.035287 0.017777
H -3.729504 0.367086 0.098218
H 4.968531 -1.462101 -0.080572
H 5.339446 0.257414 -0.112226
H -3.313623 2.319248 -0.995948
H -2.282659 3.608035 -0.328075
H -3.244227 2.606138 0.783545


