%chk=000129468.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129468

0 1
 O   -1.013400      0.5324000      -1.491600    
 O    2.021400       1.960300      -1.726000    
 N   -3.589500      0.7152000      -1.410100    
 N  -0.8490000     -0.7926000      0.4151000    
 N    2.360400      0.7724000      0.7591000    
 N   0.7053000      0.8434000       2.158400    
 N    2.636200       1.795800       1.579500    
 N    1.620100       1.834600       2.433000    
 N    3.783800      0.7892000      -2.625400    
 C   -3.001100     -7.8000002E-02 -0.3311000    
 C   -3.405000      0.6044000      0.9717000    
 C   -4.205400       1.822000      0.5358000    
 C   0.5893000     -0.9525000      0.4199000    
 C   -4.725500       1.425000     -0.8299000    
 C   0.9741000      -2.312300       1.030100    
 C   -1.524200     -6.0800001E-02 -0.5451000    
 C   0.4346000      -3.548100      0.2799000    
 C    1.200300      0.2323000       1.139500    
 C   0.8949000      -3.505900      -1.180200    
 C   -1.090800      -3.643400      0.3346000    
 C    3.252100      0.4209000     -0.3152000    
 C    2.931400       1.145800      -1.602000    
 H   -3.367300      -1.110800     -0.3603000    
 H   -4.052100     -6.5099999E-02   1.551400    
 H   -2.570300      0.9047000       1.613500    
 H   -3.545300       2.694500      0.4556000    
 H   -5.008600       2.063700       1.237900    
 H   0.9141000     -0.9118000     -0.6248000    
 H   -5.010000       2.292600      -1.431300    
 H   -5.590700      0.7577000     -0.7411000    
 H   -3.883500      0.1218000      -2.183700    
 H   0.6337000      -2.357200       2.073800    
 H    2.069300      -2.383900       1.072200    
 H   0.8565000      -4.439100      0.7609000    
 H   -1.367700      -1.147900       1.213100    
 H   0.3924000      -2.725200      -1.759700    
 H    1.976400      -3.348000      -1.248600    
 H   0.6705000      -4.460600      -1.669300    
 H   -1.592300      -2.997400     -0.3896000    
 H   -1.473500      -3.440400       1.339800    
 H   -1.395200      -4.665900      7.9499997E-02
 H    3.209500     -0.6609000     -0.4735000    
 H    4.271600      0.6751000     -3.0000000E-03
 H    3.688700       1.197000      -3.549600    
 H    4.530300      0.1131000      -2.499300    


%chk=000129468-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000129468

0 1
O -0.471358 -0.478135 -1.714590
O 0.238720 2.504868 0.055868
N -3.193638 0.029084 -1.800971
N -0.510527 -1.062796 0.531420
N 2.340355 0.528924 0.542246
N 2.341367 -0.653257 2.421289
N 3.199908 1.198288 1.436548
N 3.189591 0.466712 2.565532
N 1.770773 3.484639 -1.390736
C -2.582564 -0.159030 -0.462357
C -2.768164 1.200796 0.329382
C -3.169055 2.218751 -0.768753
C 0.868343 -1.593550 0.552369
C -3.917918 1.331638 -1.798725
C 0.976177 -2.951571 1.294281
C -1.104853 -0.565632 -0.608104
C 0.210892 -4.153004 0.666390
C 1.826650 -0.588867 1.163317
C 0.502556 -4.321518 -0.844633
C -1.314794 -4.147537 0.940036
C 2.090816 1.117430 -0.774316
C 1.286763 2.431992 -0.643519
H -3.093884 -0.973304 0.094739
H -3.581741 1.085836 1.068892
H -1.849632 1.511224 0.853105
H -2.260488 2.655905 -1.220419
H -3.791468 3.039944 -0.371003
H 1.142894 -1.733010 -0.510055
H -3.938231 1.756974 -2.817697
H -4.967112 1.179002 -1.476758
H -2.456523 -0.017035 -2.522204
H 0.671225 -2.815055 2.349902
H 2.054205 -3.200822 1.330718
H 0.620161 -5.047003 1.183353
H -1.041658 -1.086025 1.404708
H 0.056624 -3.502663 -1.439966
H 1.590337 -4.343304 -1.048248
H 0.072904 -5.268835 -1.218536
H -1.831917 -3.355845 0.369615
H -1.529830 -4.000039 2.015675
H -1.760206 -5.114329 0.640092
H 1.467708 0.418961 -1.366306
H 3.057561 1.272232 -1.281567
H 1.257639 4.366427 -1.377136
H 2.657892 3.438643 -1.888981


