%chk=000035064.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035064

0 1
 S  -0.1566000      -3.022400     -0.9879000    
 N    2.596200      0.9662000      0.2912000    
 N   -2.043100       1.535400     -9.8499998E-02
 N   0.2799000       1.281900      0.1034000    
 N   -1.110100     -0.5770000     -0.5049000    
 N    1.263300     -0.8684000     -0.3054000    
 N   -1.860700      -3.755300       1.180100    
 C    1.340300      0.4436000      2.1000000E-02
 C  -0.9022000      0.7067000     -0.1702000    
 C    3.813000      0.1945000      0.2428000    
 C   -3.364600       1.059700     -0.3638000    
 C   1.7600000E-02  -1.304500     -0.5526000    
 C    4.962500       1.083100      0.5945000    
 C   -4.326800       2.192300     -0.2030000    
 C    5.995700       1.325400     -0.2203000    
 C   -5.336600       2.195600      0.6746000    
 C   -1.167700      -3.456700      0.2989000    
 H    3.770400     -0.6270000      0.9673000    
 H    3.945200     -0.2419000     -0.7542000    
 H   -3.438500      0.6844000      -1.391200    
 H   -3.618000      0.2347000      0.3129000    
 H    2.631000       1.951100      0.5309000    
 H   -1.877300       2.502400      0.1578000    
 H    4.960900       1.542800       1.580000    
 H   -4.203600       3.054500     -0.8541000    
 H    6.805000       1.973800      9.7099997E-02
 H    6.053300      0.8866000      -1.210200    
 H   -6.007100       3.045800      0.7368000    
 H   -5.511900       1.359100       1.342000    


%chk=000035064-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000035064

0 1
S 0.046425 -3.119024 -0.399782
N 2.628911 1.217826 -0.308544
N -1.960608 1.511837 0.529062
N 0.338739 1.406536 0.113960
N -1.032648 -0.615338 0.090978
N 1.352858 -0.773307 -0.325525
N -2.804821 -3.697193 0.027626
C 1.415122 0.605380 -0.170373
C -0.862118 0.755783 0.238889
C 3.897696 0.524299 -0.599544
C -3.331027 0.985817 0.690260
C 0.107951 -1.266502 -0.179628
C 4.926675 0.761092 0.489431
C -4.292227 1.630315 -0.289701
C 6.155553 1.292133 0.273910
C -5.414394 2.299715 0.072387
C -1.652614 -3.416138 -0.139423
H 3.651495 -0.548903 -0.682668
H 4.294902 0.860529 -1.576856
H -3.269484 -0.104192 0.524038
H -3.676673 1.153596 1.728511
H 2.633556 2.229994 -0.166119
H -1.800005 2.518216 0.609606
H 4.622152 0.461777 1.502749
H -4.035030 1.514592 -1.352480
H 6.875300 1.424333 1.088881
H 6.481367 1.599895 -0.728093
H -6.093729 2.727282 -0.672868
H -5.693824 2.426048 1.126316


