%chk=000129786.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129786

0 1
 O   0.3813000       1.356000       1.722600    
 O   -2.459900      -1.335200      -3.046900    
 N    2.280300     -0.2851000       1.050500    
 N    4.826300      0.1654000     -0.1400000    
 N   -1.263300      0.1461000      0.5614000    
 N    6.307400       1.423300      -1.335000    
 N   -2.903800      0.5836000      -1.898900    
 N    6.523500     -0.9188000      -1.316700    
 N   -2.053300       2.268300       1.300400    
 C    2.406500      0.5549000     -0.1494000    
 C    3.299900      -1.344300       1.042200    
 C    3.793900       1.194700     -0.2245000    
 C    4.707100     -0.7468000      0.9940000    
 C   0.9398000     -0.8633000       1.134300    
 C  -1.7100001E-02  0.3113000       1.198800    
 C    5.912300      0.1702000     -0.9462000    
 C   -1.906000      -1.119700      0.4352000    
 C   -2.108500       1.287800      0.3534000    
 C   -2.543800      -1.541400     -0.7316000    
 C   -2.881200       1.453500     -0.7974000    
 C   -1.919000      -1.985100       1.549000    
 C   -2.585500     -0.7503000      -1.970900    
 C   -3.145700      -2.812200     -0.7898000    
 C   -3.593600       2.653700     -0.9542000    
 C   -2.525500      -3.240600       1.491400    
 C   -3.136400      -3.656800      0.3176000    
 C   -3.559200       3.635800      2.3200000E-02
 C   -2.776300       3.395200       1.127500    
 H    1.688600       1.378700     -0.1970000    
 H    2.242900     -5.2200001E-02  -1.051300    
 H    3.155400      -2.014000      0.1837000    
 H    3.214300      -1.952400       1.950900    
 H    3.928500       1.917500      0.5897000    
 H    3.841500       1.747300      -1.170500    
 H    5.437700      -1.561900      0.9363000    
 H    4.917600     -0.1963000       1.919400    
 H   0.7325000      -1.506900      0.2728000    
 H   0.8367000      -1.439900       2.059100    
 H   -1.472400      -1.678700       2.492800    
 H    7.103200       1.546500      -1.952100    
 H    5.922900       2.267200     -0.9255000    
 H   -3.227400      0.9934000      -2.772400    
 H   -3.637900      -3.156500      -1.696900    
 H    7.311900     -0.6626000      -1.921100    
 H   -4.185700       2.831300      -1.849900    
 H   -2.522300      -3.886400       2.364300    
 H   -3.609700      -4.632400      0.2634000    
 H   -4.115100       4.559000     -8.6499996E-02
 H   -2.695400       4.124100       1.926600    


%chk=000129786-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000129786

0 1
O 0.221782 1.982950 0.889379
O -2.367935 -0.953099 -3.161781
N 2.348702 0.074476 0.819277
N 5.147712 0.268093 0.106355
N -1.423761 0.350451 0.676634
N 6.460868 0.456282 -1.845929
N -2.779722 0.851323 -1.796682
N 6.174166 -1.689931 -0.731692
N -2.754467 2.033973 1.749998
C 2.760427 0.793433 -0.412612
C 3.291464 -1.034459 1.137711
C 4.196104 1.344617 -0.254431
C 4.718738 -0.477501 1.307867
C 0.957687 -0.385248 0.795271
C -0.070837 0.763468 0.811171
C 5.947888 -0.390474 -0.840871
C -1.861496 -1.010995 0.483955
C -2.455940 1.355928 0.618824
C -2.356423 -1.417218 -0.786639
C -3.099659 1.588090 -0.629845
C -1.812140 -1.932770 1.555528
C -2.469380 -0.509959 -1.976595
C -2.741089 -2.770285 -0.975952
C -4.054212 2.636457 -0.690211
C -2.210681 -3.271122 1.357530
C -2.668286 -3.693382 0.085499
C -4.337092 3.375859 0.474933
C -3.677081 3.032507 1.678314
H 2.068545 1.637041 -0.571961
H 2.723544 0.120228 -1.308233
H 3.306411 -1.816293 0.339415
H 2.969709 -1.510651 2.083737
H 4.194601 2.103292 0.551296
H 4.503149 1.823655 -1.197872
H 5.427652 -1.303789 1.469758
H 4.732681 0.218620 2.168958
H 0.724609 -1.043534 -0.084645
H 0.788534 -1.012654 1.690977
H -1.470402 -1.585476 2.535925
H 6.918671 0.038246 -2.650820
H 6.622566 1.444708 -1.663161
H -2.925358 1.326865 -2.694771
H -3.083301 -3.072893 -1.970558
H 6.929596 -2.019755 -1.360677
H -4.565748 2.858920 -1.633869
H -2.166722 -3.980684 2.190684
H -2.971249 -4.733492 -0.072496
H -5.064871 4.192647 0.457913
H -3.879957 3.568535 2.611194


