%chk=000023228.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023228

0 1
 O    1.902100      0.3499000      0.2390000    
 O   0.9685000      -1.578500     -0.5914000    
 N   -2.681300      0.3951000      0.2786000    
 N  -0.3173000      6.0800001E-02  0.4235000    
 C   -1.603200     -0.5969000      0.2834000    
 C   -2.570200       1.302600     -0.8672000    
 C   -3.981500     -0.2785000      0.2500000    
 C   0.8614000     -0.4927000     -3.0700000E-02
 C    3.194900     -0.1026000     -0.1785000    
 C    4.226600      0.9408000      0.1934000    
 H   -1.602200      -1.214700     -0.6230000    
 H   -1.697800      -1.262400       1.149100    
 H  -0.2786000      0.9474000      0.9164000    
 H   -3.394900       2.024700     -0.8637000    
 H   -2.591100      0.7652000      -1.822500    
 H   -1.650300       1.895200     -0.8233000    
 H   -4.796000      0.4533000      0.2955000    
 H   -4.097000     -0.9284000       1.124700    
 H   -4.113500     -0.8872000     -0.6520000    
 H    3.429000      -1.049200      0.3211000    
 H    3.195600     -0.2536000      -1.263800    
 H    5.228600      0.6264000     -0.1120000    
 H    3.995500       1.898700     -0.2844000    
 H    4.225000       1.116200       1.274200    


%chk=000023228-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000023228

0 1
O 1.898112 0.304483 0.385857
O 0.863676 -1.254690 -1.053492
N -2.626229 0.366622 0.159022
N -0.313441 -0.137998 0.657356
C -1.635448 -0.704772 0.389550
C -2.434574 1.067733 -1.127535
C -4.017516 -0.078287 0.370002
C 0.801969 -0.443404 -0.092189
C 3.183040 0.064488 -0.326742
C 4.222330 0.966791 0.332162
H -1.509382 -1.398581 -0.473065
H -1.984045 -1.293997 1.260133
H -0.229355 0.570675 1.387894
H -3.082918 1.961187 -1.162152
H -2.668968 0.427533 -2.013484
H -1.386603 1.401042 -1.213996
H -4.693148 0.793303 0.308411
H -4.122816 -0.519238 1.377809
H -4.367108 -0.832905 -0.378179
H 3.441146 -1.006840 -0.240173
H 3.042996 0.296863 -1.398240
H 5.202730 0.829671 -0.159639
H 3.934587 2.028568 0.244294
H 4.333265 0.723354 1.402797


