%chk=000079600.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079600

0 1
 O  -0.1948000      7.3700003E-02  4.4999998E-03
 O   -1.306700       2.083400      0.1589000    
 N    1.175100       2.081300       2.319800    
 N    1.136800       2.373900      -2.045700    
 C    1.063200      0.7562000      3.9099999E-02
 C    2.205900     -0.2585000     -4.0100001E-02
 C    3.501100      0.2020000      1.9700000E-02
 C    1.894600      -1.592700     -0.1677000    
 C   -2.529100      4.0500000E-02  2.8899999E-02
 C   -1.320800      0.8483000      7.1599998E-02
 C    4.542800     -0.7228000     -5.2200001E-02
 C    2.936400      -2.517500     -0.2396000    
 C    4.260500      -2.082500     -0.1818000    
 C   -3.697700      0.5625000     -0.5257000    
 C   -2.519600      -1.256700      0.5421000    
 C    1.128000       1.499000       1.316700    
 C    1.107100       1.663300      -1.128400    
 C   -4.856900     -0.2124000     -0.5668000    
 C   -3.678700      -2.031500      0.5006000    
 C   -4.847300      -1.509300     -5.3800002E-02
 H    3.738000       1.257000      0.1185000    
 H   0.8793000      -1.970200     -0.2184000    
 H    5.573800     -0.3842000     -7.7999998E-03
 H    2.717200      -3.576500     -0.3411000    
 H    5.071600      -2.802600     -0.2380000    
 H   -3.721600       1.570000     -0.9327000    
 H   -1.628000      -1.685700      0.9917000    
 H   -5.766700      0.1938000     -0.9990000    
 H   -3.672600      -3.040500      0.9027000    
 H   -5.749900      -2.112500     -8.5400000E-02


%chk=000079600-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000079600

0 1
O -0.149742 0.103733 -0.168560
O -1.370364 2.036252 -0.674974
N 1.423359 2.931058 1.166898
N 1.122795 1.638299 -3.046283
C 1.128306 0.848592 -0.488212
C 2.242792 -0.185695 -0.255509
C 2.859058 -0.295186 1.013894
C 2.598409 -1.077494 -1.296098
C -2.547853 0.005933 0.020730
C -1.367002 0.840802 -0.311587
C 3.830183 -1.294350 1.239058
C 3.568874 -2.075199 -1.065159
C 4.186801 -2.186348 0.201923
C -3.828954 0.612969 -0.072772
C -2.428309 -1.352217 0.418770
C 1.262974 2.021735 0.414505
C 1.096721 1.311320 -1.901146
C -4.983125 -0.135487 0.230527
C -3.588534 -2.094667 0.720211
C -4.864796 -1.489583 0.627141
H 2.591031 0.396345 1.819804
H 2.127886 -0.992087 -2.281544
H 4.309010 -1.372535 2.220607
H 3.844819 -2.760180 -1.873528
H 4.944204 -2.957888 0.377651
H -3.895420 1.661164 -0.382323
H -1.437451 -1.809382 0.487613
H -5.970918 0.331399 0.158852
H -3.500339 -3.142020 1.027390
H -5.763416 -2.070482 0.862722


