%chk=000013798.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013798

0 1
 O   6.6900000E-02  -1.657200      0.6207000    
 N    4.175800      3.9500002E-02 -3.4299999E-02
 N   -1.296900      -1.660100      0.3543000    
 C    2.750800     -0.1258000     -0.3190000    
 C    1.935500     -0.1864000      0.9743000    
 C    4.408000       1.277100      0.7095000    
 C    4.948800      3.6300000E-02  -1.275600    
 C   0.4665000     -0.3800000      0.6898000    
 C    5.876000       1.435100       1.067500    
 C    4.719500      -1.243200      -2.061900    
 C  -0.5403000      0.4839000      0.4868000    
 C   -1.637100     -0.3702000      0.2787000    
 C   -2.996300      1.6899999E-02  1.0800000E-02
 C   -3.259500       1.207400     -0.6641000    
 C   -4.046200     -0.7996000      0.4270000    
 C   -4.577500       1.582900     -0.9237000    
 C   -5.364200     -0.4240000      0.1674000    
 C   -5.629900      0.7673000     -0.5080000    
 H    2.377600      0.6814000     -0.9642000    
 H    2.557400      -1.069300     -0.8411000    
 H    1.998200      0.7406000       1.552900    
 H    2.292000      -1.000200       1.618000    
 H    4.060700       2.160800      0.1596000    
 H    3.894400       1.263000       1.674100    
 H    4.715600      0.9029000      -1.907200    
 H    6.022100      6.2799998E-02  -1.060900    
 H    6.287900      0.5207000       1.508100    
 H    6.488000       1.722800      0.2070000    
 H    5.989200       2.233700       1.809700    
 H    4.797600      -2.132700      -1.427100    
 H    3.753500      -1.252700      -2.576200    
 H    5.484400      -1.334000      -2.841900    
 H  -0.4991000       1.563300      0.4918000    
 H   -2.460700       1.859000      -1.009300    
 H   -3.871200      -1.729400      0.9627000    
 H   -4.784700       2.509300      -1.451400    
 H   -6.184000      -1.057900      0.4925000    
 H   -6.656100       1.059700     -0.7102000    


%chk=000013798-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000013798

0 1
O 0.122870 -1.348290 -0.452805
N 4.252740 0.205280 -0.262826
N -1.324069 -1.337468 -0.672252
C 2.830490 0.005015 -0.627630
C 1.926782 -0.059889 0.637276
C 4.592067 1.636449 -0.034758
C 5.196805 -0.478354 -1.189310
C 0.473407 -0.222753 0.313571
C 5.780779 1.827390 0.926960
C 5.256676 -2.001217 -0.965652
C -0.672016 0.500941 0.587787
C -1.762480 -0.215937 -0.034100
C -3.200192 0.124752 -0.044773
C -3.685342 1.249605 0.673921
C -4.122467 -0.673654 -0.776951
C -5.059709 1.570644 0.661221
C -5.493676 -0.351104 -0.787400
C -5.969723 0.772509 -0.069130
H 2.454257 0.805843 -1.310067
H 2.726116 -0.948653 -1.172616
H 2.049372 0.858486 1.238432
H 2.282354 -0.902534 1.258967
H 4.796384 2.164408 -1.000870
H 3.704055 2.129870 0.403716
H 4.948281 -0.260949 -2.258894
H 6.203246 -0.057758 -1.011687
H 5.557825 1.362715 1.903131
H 6.705200 1.365399 0.535803
H 5.984887 2.903427 1.082231
H 5.568257 -2.220134 0.070427
H 4.276573 -2.482995 -1.134979
H 5.980978 -2.465657 -1.660816
H -0.727511 1.425355 1.156152
H -2.993108 1.874674 1.248723
H -3.747805 -1.540570 -1.330470
H -5.419731 2.440848 1.221082
H -6.193361 -0.973924 -1.355562
H -7.036512 1.021929 -0.078752


