%chk=000021780.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021780

0 1
 O  -4.4000000E-02  0.4092000      -1.689900    
 N    1.848300     -6.8499997E-02  0.2853000    
 N   0.4995000     -0.1615000      0.4945000    
 N   -4.536100     -0.1232000      0.4334000    
 C    2.574600       1.071900      0.4301000    
 C    2.643200      -1.104000     -9.5299996E-02
 C    3.883100      0.7619000      0.1318000    
 C    3.926500     -0.6147000     -0.2004000    
 C    1.979700       2.362600      0.8371000    
 C    2.132000      -2.471100     -0.3294000    
 C  -0.4060000      0.1036000     -0.5390000    
 C   -1.819100      2.6100000E-02 -0.2061000    
 C   -2.746900      0.7740000     -0.9225000    
 C   -2.248200     -0.7963000      0.8297000    
 C   -4.081600      0.6650000     -0.5665000    
 C   -3.605100     -0.8350000       1.107300    
 H    4.717300       1.449500      0.1506000    
 H    4.800500      -1.184300     -0.4850000    
 H   0.2273000     -0.3631000       1.450800    
 H    2.752300       3.128300      0.9637000    
 H    1.275300       2.722300      8.0200002E-02
 H    1.448700       2.266400       1.789700    
 H    1.625800      -2.857400      0.5613000    
 H    1.424700      -2.484100      -1.164900    
 H    2.948100      -3.159400     -0.5728000    
 H   -2.454300       1.430900      -1.734700    
 H   -1.578500      -1.423000       1.407500    
 H   -4.844700       1.228400      -1.093100    
 H   -3.992200      -1.465500       1.901100    


%chk=000021780-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000021780

0 1
O -0.022735 0.505320 -1.698546
N 1.889420 -0.043688 0.310389
N 0.510096 -0.101717 0.497754
N -4.634038 -0.191973 0.417372
C 2.671964 1.125382 0.462479
C 2.686352 -1.139869 -0.095391
C 3.984126 0.748689 0.171759
C 3.993161 -0.655161 -0.173639
C 2.064572 2.444873 0.837366
C 2.098274 -2.491357 -0.374249
C -0.390978 0.162691 -0.542493
C -1.845814 0.016490 -0.162410
C -2.803092 0.737579 -0.917419
C -2.313264 -0.828208 0.876766
C -4.170087 0.607901 -0.591785
C -3.703608 -0.897482 1.125410
H 4.844611 1.415886 0.195396
H 4.861700 -1.246965 -0.459326
H 0.175817 -0.246744 1.453689
H 2.856589 3.209900 0.886014
H 1.319123 2.779533 0.090719
H 1.562338 2.421720 1.824679
H 1.591871 -2.926886 0.509521
H 1.359935 -2.456998 -1.198219
H 2.901565 -3.184222 -0.673569
H -2.470116 1.372608 -1.743616
H -1.635142 -1.458756 1.462483
H -4.934600 1.156714 -1.152147
H -4.097840 -1.546257 1.915514


