%chk=000096409.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096409

0 1
 O   -3.022000      -1.049400     -0.3822000    
 N  -0.1163000      0.7105000     -0.7980000    
 N    1.554700       1.914600      5.4800000E-02
 N   0.8395000      -1.515300     -0.6179000    
 N    3.073900      -1.443800      0.3612000    
 N    4.117300      0.6024000       1.033200    
 C   -1.398800      0.4101000      -1.386800    
 C   0.8626000     -0.1826000     -0.4669000    
 C    1.889500      0.5838000      6.0699999E-02
 C   -2.442800      0.1616000     -0.3319000    
 C   0.3463000       1.956400     -0.4665000    
 C    3.027600     -9.5299996E-02  0.4840000    
 C   -2.917400      0.9332000      0.6710000    
 C   -3.890500      0.1355000       1.318800    
 C    1.992900      -2.060900     -0.1741000    
 C   -3.916600      -1.060900      0.6407000    
 H   -1.280200     -0.4587000      -2.043900    
 H   -1.693900       1.260400      -2.011800    
 H  -0.2374000       2.852900     -0.6260000    
 H   -2.621300       1.941000      0.9238000    
 H   -4.497400      0.3995000       2.172800    
 H    2.064400      -3.140100     -0.2572000    
 H   -4.484600      -1.972700      0.7546000    
 H    4.933200      8.6400002E-02   1.333200    
 H    4.085300       1.608700       1.125500    


%chk=000096409-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000096409

0 1
O -2.685419 -0.776811 0.702942
N -0.101870 0.501301 -0.458265
N 1.442375 1.582265 0.854028
N 1.284494 -1.410075 -1.229488
N 3.564771 -1.322520 -0.307619
N 4.308161 0.398343 1.132053
C -1.361060 0.176810 -1.166763
C 1.071043 -0.258089 -0.531794
C 2.011635 0.426527 0.284600
C -2.572541 0.221794 -0.290201
C 0.179979 1.587733 0.383827
C 3.308658 -0.158505 0.379649
C -3.685283 1.047370 -0.237320
C -4.535764 0.557296 0.829463
C 2.559582 -1.872543 -1.057830
C -3.896815 -0.542290 1.374897
H -1.206782 -0.831884 -1.592887
H -1.509333 0.880811 -2.005230
H -0.571389 2.334892 0.629786
H -3.878883 1.902141 -0.883271
H -5.491840 0.969606 1.144808
H 2.813069 -2.797853 -1.583484
H -4.127614 -1.232135 2.181564
H 5.214541 -0.063233 1.166813
H 4.134283 1.256347 1.650821


