%chk=000039554.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039554

0 1
 N    1.318900      0.7357000     -0.5699000    
 N   -4.056900      0.5423000      1.1600000E-02
 C    3.577600     -0.3897000     -0.7963000    
 C    3.899700     -0.1654000      0.7141000    
 C    2.490700     -0.4843000       1.277000    
 C    2.836700      -1.756100     -0.7856000    
 C    2.122900      -1.812700      0.5772000    
 C    2.589300      0.7084000      -1.307700    
 C    1.466000      0.6057000      0.8843000    
 C    4.805000     -0.4263000      -1.709000    
 C    4.954300      -1.151000       1.279200    
 C    4.412000       1.243100       1.070100    
 C   0.5049000       1.890000     -0.9320000    
 C  -0.8406000       1.781000     -0.3610000    
 C   -1.944800       1.696000      0.1045000    
 C   -3.287400       1.595000      0.6742000    
 C   -3.390900     -0.7582000      0.1700000    
 C   -5.430100      0.5031000      0.5339000    
 C   -4.157300      -1.862900     -0.5589000    
 C   -6.263200     -0.5604000     -0.1835000    
 C   -5.606900      -1.933200     -9.2299998E-02
 H    2.496500     -0.6025000       2.366400    
 H    3.534400      -2.597400     -0.8720000    
 H    2.125500      -1.851000      -1.613900    
 H    1.041600      -1.947300      0.4656000    
 H    2.491200      -2.667900       1.155400    
 H    3.078100       1.690100      -1.282800    
 H    2.362200      0.5104000      -2.363900    
 H   0.5059000      0.3147000       1.328500    
 H    1.744100       1.559700       1.347300    
 H    5.349900      0.5229000      -1.679500    
 H    5.500700      -1.222800      -1.426800    
 H    4.511700     -0.6097000      -2.748900    
 H    4.754300      -2.197700       1.035900    
 H    5.954700     -0.9197000      0.8963000    
 H    4.998800      -1.078300       2.372300    
 H    4.502400       1.353800       2.157100    
 H    5.403100       1.418700      0.6367000    
 H    3.769900       2.055100      0.7234000    
 H   0.9780000       2.824400     -0.6053000    
 H   0.4072000       1.946100      -2.023300    
 H   -3.220700       1.416900       1.755100    
 H   -3.791700       2.559800      0.5388000    
 H   -3.294200      -1.020500       1.232300    
 H   -2.381300     -0.7519000     -0.2553000    
 H   -5.914100       1.475200      0.3803000    
 H   -5.432200      0.3047000       1.613900    
 H   -3.667900      -2.828500     -0.3875000    
 H   -4.129800      -1.677800      -1.640300    
 H   -6.384300     -0.2824000      -1.238200    
 H   -7.267300     -0.6011000      0.2535000    
 H   -6.162700      -2.657200     -0.6982000    
 H   -5.640700      -2.287000      0.9454000    


%chk=000039554-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000039554

0 1
N 1.464982 0.661736 -0.400379
N -4.239509 0.412430 0.065259
C 3.720642 -0.399183 -0.774252
C 4.163171 -0.047461 0.706038
C 2.804306 -0.350263 1.430819
C 2.981199 -1.768126 -0.591253
C 2.399829 -1.745591 0.861644
C 2.679269 0.656756 -1.250864
C 1.728042 0.695326 1.059190
C 4.868104 -0.466763 -1.799903
C 5.271064 -1.004979 1.227708
C 4.694545 1.393907 0.901551
C 0.481623 1.673632 -0.850706
C -0.852008 1.526241 -0.237935
C -1.986689 1.430216 0.236630
C -3.335655 1.321553 0.821451
C -3.743382 -0.987575 0.048190
C -5.629149 0.496862 0.581456
C -4.642641 -1.874943 -0.834771
C -6.586874 -0.346136 -0.284875
C -6.111919 -1.815635 -0.357124
H 2.924508 -0.359148 2.531459
H 3.686815 -2.608098 -0.735721
H 2.177095 -1.875647 -1.340043
H 1.302824 -1.864591 0.858402
H 2.825127 -2.558055 1.478686
H 3.167612 1.663647 -1.310921
H 2.364960 0.398034 -2.282805
H 0.780063 0.452661 1.575917
H 2.032790 1.712836 1.412312
H 5.371782 0.511882 -1.918992
H 5.629777 -1.208534 -1.500890
H 4.485682 -0.767421 -2.794191
H 5.039391 -2.068750 1.050146
H 6.243014 -0.786729 0.747809
H 5.402511 -0.866764 2.318225
H 4.956970 1.563114 1.963684
H 5.614440 1.549367 0.306161
H 3.975616 2.177107 0.612042
H 0.845392 2.719668 -0.659893
H 0.379078 1.577437 -1.950457
H -3.233914 1.003625 1.894309
H -3.804189 2.325838 0.835184
H -3.712234 -1.411567 1.089083
H -2.708340 -0.980073 -0.337235
H -5.942611 1.558568 0.569589
H -5.690698 0.141850 1.646647
H -4.265750 -2.915625 -0.812541
H -4.576764 -1.515632 -1.879796
H -6.611025 0.083644 -1.304851
H -7.610676 -0.284398 0.132062
H -6.765082 -2.400423 -1.032297
H -6.189911 -2.277930 0.649242


