%chk=000064049.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064049

0 1
 O  -1.4500000E-02  -2.068700      0.1024000    
 N   0.4924000      0.2315000      6.7299999E-02
 N   -1.294100       1.799600     -3.2699998E-02
 N    2.568800     -0.1372000       1.195300    
 C   -1.809100     -0.5883000      4.5499999E-02
 C  -2.7200000E-02   1.527900      3.7500001E-02
 C   -2.211700      0.7444000     -4.1099999E-02
 C  -0.3630000     -0.8903000      9.4800003E-02
 C    1.905700     -2.6200000E-02  2.6200000E-02
 C   -2.754400      -1.620800      5.9400000E-02
 C   -3.578800       1.035800     -0.1136000    
 C   0.8980000       2.722500      0.1488000    
 C   -4.113000      -1.316900     -1.2800000E-02
 C   -4.525600      1.0500000E-02 -0.1004000    
 C    2.491100     -0.1420000      -1.221000    
 C    3.858100     -0.3905000      -1.271700    
 C    3.896000     -0.3787000       1.106400    
 C    4.581300     -0.5125000     -9.0300001E-02
 H   -2.453600      -2.662900      0.1231000    
 H   -3.915600       2.067800     -0.1774000    
 H    1.552800       2.761700     -0.7261000    
 H    1.513300       2.633100       1.048300    
 H   0.3266000       3.653700      0.2023000    
 H   -4.849400      -2.115100     -2.3000001E-03
 H   -5.583800      0.2482000     -0.1565000    
 H    1.918200     -4.4700000E-02  -2.137000    
 H    4.359100     -0.4888000      -2.230000    
 H    4.414000     -0.4651000       2.055800    
 H    5.647700     -0.7061000     -0.1059000    


%chk=000064049-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000064049

0 1
O 0.091728 -2.008196 -0.526003
N 0.469292 0.284170 -0.102300
N -1.343271 1.840020 0.221534
N 2.565323 0.357206 1.047072
C -1.827004 -0.565332 -0.156997
C -0.047381 1.587519 0.126569
C -2.254150 0.774456 0.104618
C -0.391649 -0.864060 -0.285775
C 1.901040 0.034370 -0.092775
C -2.780822 -1.609520 -0.283903
C -3.644027 1.046149 0.238161
C 0.923756 2.737707 0.225854
C -4.149665 -1.327486 -0.148219
C -4.578855 0.005245 0.114110
C 2.519194 -0.553866 -1.219993
C 3.906323 -0.805829 -1.160417
C 3.907617 0.117016 1.086102
C 4.618771 -0.463341 0.012380
H -2.416878 -2.622687 -0.483205
H -3.949417 2.077735 0.436851
H 1.630084 2.749537 -0.624388
H 1.523865 2.666115 1.148559
H 0.340072 3.668966 0.233882
H -4.888608 -2.130059 -0.242918
H -5.648181 0.219637 0.219056
H 1.925910 -0.817179 -2.098113
H 4.418485 -1.264628 -2.012112
H 4.413467 0.393351 2.017698
H 5.694280 -0.645116 0.098973


