%chk=000097121.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097121

0 1
 O  -6.9600001E-02  -2.248000     -0.3166000    
 N   -3.226300      0.6147000      0.8170000    
 N    3.600300      0.3720000     -0.5348000    
 C   -2.356700     -0.1882000     -5.8600001E-02
 C    2.516200     -0.3119000      0.1896000    
 C   -4.561800      0.6948000      0.2560000    
 C   -3.604800       1.845900      0.1490000    
 C    3.206400       1.730800     -0.8557000    
 C    4.145100       1.442400      0.2792000    
 C  -0.9584000     -0.2096000      0.5895000    
 C    1.282100     -0.3078000     -0.7339000    
 C   7.1699999E-02  -1.033600     -0.1673000    
 C   -2.958100      -1.596400     -0.1717000    
 C   -2.337900      0.4851000      -1.436500    
 C    2.996300      -1.736600      0.4966000    
 C    2.255400      0.4463000       1.498100    
 H   -5.365100      0.7827000      0.9793000    
 H   -4.872800      0.2172000     -0.6622000    
 H   -3.493100       2.248800     -0.8484000    
 H   -3.759900       2.679400      0.8340000    
 H    2.254400       2.172500     -0.5956000    
 H    3.634300       2.138100      -1.764700    
 H    5.204000       1.627100      0.1020000    
 H    3.866000       1.920100       1.209000    
 H   -1.006300     -0.6251000       1.605000    
 H  -0.5798000      0.8144000      0.6983000    
 H   0.9274000      0.6888000      -1.014100    
 H    1.521400     -0.8045000      -1.685100    
 H   -3.982600      -1.628200     -0.5530000    
 H   -2.957600      -2.103600      0.8006000    
 H   -2.389000      -2.219000     -0.8692000    
 H   -1.792900       1.438700      -1.458600    
 H   -3.285700      0.5370000      -1.983900    
 H   -1.728500     -0.1490000      -2.099600    
 H    3.169700      -2.307100     -0.4233000    
 H    2.264400      -2.286000       1.098500    
 H    3.935500      -1.728100       1.063100    
 H    1.463600     -8.7099999E-02   2.044100    
 H    3.088800      0.4023000       2.212400    
 H    1.850800       1.459800       1.398700    


%chk=000097121-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000097121

0 1
O 0.035899 -2.298020 0.206658
N -3.470477 0.552755 0.603213
N 3.311724 0.701411 -0.673088
C -2.509202 -0.345578 -0.145258
C 2.436345 -0.166937 0.205024
C -4.749453 0.992280 -0.050208
C -3.636698 1.998720 0.218126
C 3.373003 2.191890 -0.472318
C 4.566455 1.311930 -0.118302
C -1.190674 -0.258871 0.706289
C 1.093171 -0.262762 -0.604597
C -0.015869 -1.036436 0.111029
C -3.113239 -1.765646 -0.076485
C -2.227874 0.047250 -1.622043
C 3.135577 -1.542461 0.275363
C 2.168623 0.372208 1.637382
H -5.634712 0.960026 0.593305
H -4.939589 0.733652 -1.100864
H -3.106394 2.391180 -0.659436
H -3.713487 2.697015 1.058348
H 2.833183 2.649423 0.367283
H 3.376564 2.784486 -1.393394
H 5.437281 1.266330 -0.780482
H 4.799260 1.202083 0.949717
H -1.429431 -0.671898 1.702975
H -0.927129 0.808486 0.822604
H 0.757481 0.764926 -0.834696
H 1.332210 -0.772823 -1.555573
H -4.011584 -1.834174 -0.718057
H -3.410661 -1.994214 0.961470
H -2.382434 -2.524037 -0.401811
H -1.689134 1.008875 -1.705370
H -3.161888 0.118424 -2.209103
H -1.603951 -0.728147 -2.101485
H 3.417245 -1.869067 -0.740475
H 2.467961 -2.303498 0.711389
H 4.055046 -1.477370 0.886606
H 1.612125 -0.382292 2.221698
H 3.111887 0.568622 2.179470
H 1.569740 1.301358 1.632295


