%chk=000078646.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078646

0 1
 O    2.283600     -0.4649000      0.1326000    
 O   -3.035100      0.8145000     -0.3521000    
 O    1.087600       1.460100     -0.3156000    
 N   -1.055300      0.5256000      0.8641000    
 C   6.6299997E-02 -0.3705000      0.8623000    
 C  -0.4389000      -1.580200      9.8999999E-02
 C   -1.513900      -1.018100     -0.8307000    
 C   -2.005600      0.2075000     -0.1001000    
 C    1.180000      0.3355000      0.1576000    
 C    3.431400      9.0499997E-02 -0.5171000    
 H   0.3552000     -0.5898000       1.894000    
 H  -0.9085000      -2.282800      0.7992000    
 H   0.3327000      -2.126700     -0.4514000    
 H   -2.326000      -1.731400     -0.9907000    
 H   -1.089900     -0.7089000      -1.791100    
 H   -1.132800       1.332600       1.475400    
 H    3.208200      0.2974000      -1.568000    
 H    4.239000     -0.6448000     -0.4678000    
 H    3.753700       1.001200     -3.3000000E-03


%chk=000078646-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000078646

0 1
O 2.363577 -0.448241 0.174485
O -3.201757 0.832527 -0.214396
O 1.215035 1.489701 -0.432810
N -1.133432 0.510638 0.875727
C 0.053251 -0.337853 0.810702
C -0.464908 -1.596178 0.022067
C -1.661087 -1.063737 -0.800799
C -2.135712 0.189020 -0.041174
C 1.229676 0.363172 0.105032
C 3.592097 0.105289 -0.454741
H 0.410654 -0.635653 1.813381
H -0.806574 -2.349542 0.751930
H 0.335134 -2.047044 -0.584235
H -2.489037 -1.783102 -0.896963
H -1.368627 -0.752343 -1.820817
H -1.156125 1.396893 1.381525
H 3.418923 0.287785 -1.528198
H 4.357397 -0.667030 -0.298923
H 3.873216 1.052500 0.034507


