%chk=000115650.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115650

0 1
 O   -1.351200       1.264400      0.9057000    
 N  -0.4425000     -0.6863000      3.5300002E-02
 N   -5.265700     -9.8200001E-02  1.8000000E-03
 C    1.583300      0.3638000     -0.9312000    
 C   0.9364000     -0.3515000      0.2889000    
 C    2.339600     -0.7284000      -1.734100    
 C    1.782500      -1.582200      0.4293000    
 C    2.572600      -1.790500     -0.7054000    
 C    2.448700       1.536300     -0.4846000    
 C    1.825300      -2.464800       1.497700    
 C    3.413100      -2.887800     -0.8001000    
 C   -1.487300      0.1668000      0.3720000    
 C    1.884600       2.803800     -0.3394000    
 C    3.804500       1.341800     -0.2209000    
 C    2.677400      -3.567900       1.415500    
 C    3.465600      -3.778400      0.2739000    
 C   -2.837900     -0.4186000     -8.9999998E-04
 C   -3.991500      0.5097000      0.3644000    
 C    2.676400       3.876700      6.9399998E-02
 C    4.596200       2.414900      0.1881000    
 C    4.032100       3.682400      0.3333000    
 C   -6.380600      0.7618000      0.4034000    
 C   -5.321000     -0.3609000      -1.437500    
 C   -6.343400       1.048000       1.895000    
 C   -6.617200      -1.055300      -1.819600    
 H   0.8157000      0.7876000      -1.594700    
 H   0.9970000      0.2582000       1.198600    
 H    1.680900      -1.141300      -2.507800    
 H    3.259700     -0.3820000      -2.212600    
 H  -0.6529000      -1.562700     -0.4349000    
 H    1.212100      -2.308100       2.378800    
 H    4.018800      -3.055500      -1.684200    
 H   0.8291000       2.967500     -0.5395000    
 H    4.281300      0.3711000     -0.3035000    
 H    2.728700      -4.272600       2.241000    
 H    4.119900      -4.644600      0.2252000    
 H   -2.767900     -0.5909000      -1.079400    
 H   -2.945600      -1.387900      0.5011000    
 H   -3.918100      0.6719000       1.445000    
 H   -3.859700       1.487000     -0.1191000    
 H    2.237100       4.863400      0.1834000    
 H    5.651200       2.263400      0.3977000    
 H    4.648300       4.517600      0.6529000    
 H   -7.337500      0.2616000      0.2222000    
 H   -6.389600       1.707800     -0.1526000    
 H   -4.542100      -1.062600      -1.745800    
 H   -5.198700      0.5550000      -2.029200    
 H   -7.302600       1.475800       2.208500    
 H   -5.576900       1.781900       2.162500    
 H   -6.188200      0.1362000       2.482100    
 H   -6.537700      -1.445700      -2.840700    
 H   -7.474000     -0.3747000      -1.814200    
 H   -6.832500      -1.905000      -1.162400    


%chk=000115650-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000115650

0 1
O -1.271202 1.273708 0.892919
N -0.463629 -0.801786 0.246802
N -5.272852 0.098806 -0.270649
C 1.479014 0.526268 -0.751763
C 0.956766 -0.411408 0.417196
C 2.096231 -0.463496 -1.788685
C 1.851610 -1.637958 0.308086
C 2.498628 -1.672619 -0.953896
C 2.446999 1.570489 -0.188044
C 2.051741 -2.662604 1.254968
C 3.360380 -2.740525 -1.278887
C -1.496375 0.075928 0.522535
C 1.896831 2.702839 0.472787
C 3.857247 1.440270 -0.247081
C 2.919371 -3.733938 0.929696
C 3.568174 -3.771097 -0.328953
C -2.913490 -0.484891 0.376597
C -3.853499 0.529316 -0.315657
C 2.735125 3.687094 1.038799
C 4.698737 2.424718 0.322336
C 4.142114 3.553927 0.963564
C -6.217244 1.250998 -0.264632
C -5.599916 -0.906778 -1.318569
C -6.288100 1.959244 1.101664
C -6.807088 -1.791138 -0.950916
H 0.612430 1.061299 -1.175891
H 1.035080 0.117219 1.383879
H 1.333902 -0.757215 -2.537622
H 2.936612 -0.021595 -2.352169
H -0.671995 -1.752840 -0.064265
H 1.556487 -2.627096 2.232223
H 3.868188 -2.775193 -2.249854
H 0.806066 2.791987 0.549648
H 4.310760 0.567249 -0.729388
H 3.097297 -4.534298 1.656571
H 4.241314 -4.602927 -0.566232
H -2.904677 -1.455653 -0.155692
H -3.321552 -0.672942 1.388013
H -3.745707 1.486185 0.221980
H -3.505541 0.711699 -1.363495
H 2.292361 4.556118 1.539079
H 5.787292 2.307455 0.266560
H 4.794387 4.318218 1.401382
H -7.222500 0.864103 -0.511925
H -5.958151 1.991813 -1.063457
H -4.716080 -1.559261 -1.448204
H -5.776390 -0.418266 -2.311498
H -7.013785 2.793449 1.067252
H -5.310528 2.378378 1.400380
H -6.604200 1.245682 1.882371
H -6.992095 -2.542811 -1.741263
H -7.732094 -1.198589 -0.831831
H -6.616655 -2.315535 0.001629


