%chk=000167505.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000167505

0 1
 O   -2.294500       1.577900      0.2188000    
 N   -4.621400      0.4860000      0.6531000    
 N   -1.087400     -0.4323000      0.4639000    
 C   -3.474700     -0.4200000      0.7143000    
 C   -3.725000      -1.473200     -0.3596000    
 C   -4.970900      -1.000800      -1.099700    
 C   -5.099500      0.4614000     -0.7256000    
 C   -2.234100      0.3722000      0.4374000    
 C   0.2381000     -5.0299998E-02  0.2534000    
 C    1.256700      -1.001500      0.3189000    
 C    2.595700     -0.6333000      0.1097000    
 C    2.905800      0.7189000     -0.1702000    
 C   0.5431000       1.279400     -2.2200000E-02
 C    1.867900       1.662900     -0.2329000    
 C    3.633700      -1.577300      0.1720000    
 C    4.244800       1.087200     -0.3795000    
 C    4.958400      -1.193500     -3.8400002E-02
 C    5.263500      0.1363000     -0.3135000    
 H   -3.393700     -0.8665000       1.711100    
 H   -3.908200      -2.458600      8.3300002E-02
 H   -2.896000      -1.575300      -1.068600    
 H   -4.890100      -1.148400      -2.180900    
 H   -5.844800      -1.562300     -0.7470000    
 H   -4.472100       1.086200      -1.371200    
 H   -6.132000      0.8139000     -0.8003000    
 H   -4.387500       1.430000      0.9537000    
 H   -1.223600      -1.419800      0.6702000    
 H    1.009600      -2.040100      0.5347000    
 H  -0.1898000       2.071300     -8.8900000E-02
 H    2.084600       2.707700     -0.4468000    
 H    3.418800      -2.622300      0.3856000    
 H    4.506300       2.120900     -0.5962000    
 H    5.751900      -1.933400      1.2800000E-02
 H    6.295000      0.4343000     -0.4772000    


%chk=000167505-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000167505

0 1
O -2.172267 1.696120 -0.001057
N -4.629496 0.520754 0.627835
N -1.002695 -0.318233 0.348554
C -3.459806 -0.362485 0.431284
C -3.799755 -1.232255 -0.828761
C -5.347875 -1.197418 -0.858623
C -5.657165 0.251893 -0.418192
C -2.157744 0.450903 0.238036
C 0.361166 0.061004 0.188496
C 1.342094 -0.932465 0.336042
C 2.730134 -0.628258 0.185738
C 3.122941 0.732058 -0.124701
C 0.746468 1.412399 -0.117503
C 2.096703 1.722653 -0.266962
C 3.750759 -1.627603 0.330578
C 4.514254 1.039732 -0.278039
C 5.098880 -1.297655 0.175174
C 5.486124 0.046695 -0.131951
H -3.319260 -1.029398 1.312196
H -3.388233 -2.254873 -0.766188
H -3.394513 -0.750992 -1.738734
H -5.761640 -1.436301 -1.853084
H -5.763301 -1.912898 -0.125565
H -5.570245 0.939144 -1.290475
H -6.677670 0.349683 -0.005780
H -4.350492 1.508629 0.700448
H -1.156892 -1.305886 0.571178
H 1.051498 -1.966003 0.569674
H -0.031080 2.170294 -0.225525
H 2.387517 2.753896 -0.500066
H 3.457685 -2.658056 0.565857
H 4.805661 2.070552 -0.512702
H 5.869423 -2.068403 0.288009
H 6.547421 0.290373 -0.250992


