%chk=000129095.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129095

0 1
 O   0.5215000       2.336500     -0.3315000    
 N   0.1037000      0.1270000      -1.044600    
 N   0.8129000      -1.068200      -1.014000    
 N   -3.715000      0.8758000       1.125000    
 C   -1.206300      0.2723000      -1.621400    
 C    2.050100      0.5577000      4.0300000E-02
 C    1.966800     -0.7946000     -0.2876000    
 C   0.8098000       1.160800     -0.4533000    
 C   -2.268500      1.2000000E-02 -0.5896000    
 C    3.116100       1.112600      0.7164000    
 C    3.002800      -1.646300      3.8400002E-02
 C    4.156700      0.2504000       1.062400    
 C    4.101600      -1.116100      0.7257000    
 C   -2.763100      -1.264700     -0.4003000    
 C   -2.761800       1.041700      0.1807000    
 C   -3.744700      -1.475200      0.5619000    
 C   -4.182800     -0.3817000       1.291400    
 H   -1.303400     -0.4161000      -2.469200    
 H   -1.313800       1.289000      -2.018700    
 H   0.8222000      -1.669500      -1.825900    
 H    3.152000       2.165100      0.9697000    
 H    2.976300      -2.697300     -0.2283000    
 H    5.022100      0.6354000       1.595200    
 H    4.928200      -1.766800      0.9995000    
 H   -2.398100      -2.102400     -0.9873000    
 H   -2.407200       2.061200      6.9600001E-02
 H   -4.153400      -2.464000      0.7357000    
 H   -4.946700     -0.4929000       2.053900    


%chk=000129095-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000129095

0 1
O 0.598377 2.497384 -0.958901
N 0.172316 0.176168 -1.230133
N 0.722370 -1.055207 -0.748752
N -3.193769 0.369202 1.623845
C -1.224125 0.266123 -1.666267
C 2.119003 0.679342 -0.136084
C 1.964434 -0.735366 -0.164063
C 0.947260 1.289596 -0.793515
C -2.243171 -0.097390 -0.592124
C 3.252196 1.268030 0.463575
C 2.947016 -1.599205 0.369233
C 4.236252 0.418654 1.008815
C 4.081759 -0.997538 0.952932
C -3.176541 -1.143322 -0.778136
C -2.299153 0.629066 0.627399
C -4.112791 -1.427685 0.241993
C -4.083123 -0.650154 1.421105
H -1.379182 -0.357505 -2.568501
H -1.334514 1.326301 -1.966203
H 0.626550 -1.854567 -1.384319
H 3.350938 2.357897 0.491273
H 2.832282 -2.687793 0.348420
H 5.128483 0.843534 1.479775
H 4.861030 -1.637413 1.381965
H -3.175094 -1.725885 -1.708061
H -1.602006 1.455351 0.812183
H -4.848495 -2.230274 0.129057
H -4.790308 -0.835643 2.237588


