%chk=000002046.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002046

0 1
 O   -2.314900      -2.115100      0.4768000    
 O   -4.159200       1.469800     -0.1391000    
 O   -4.291600     -0.6364000      0.4657000    
 N   -3.631700      0.3504000      6.2100001E-02
 N    5.378200     -0.3226000     -0.7709000    
 N    2.450300      0.8157000       2.401800    
 C   0.4977000     -7.5000003E-02 -0.6495000    
 C   -2.238200      0.1945000     -0.1755000    
 C   -1.611300      -1.033300      3.6800001E-02
 C  -0.2434000      -1.168000     -0.2002000    
 C  -0.1294000       1.152800     -0.8619000    
 C   -1.497300       1.287600     -0.6250000    
 C    1.924100     -0.2153000     -0.8965000    
 C    2.926500      1.2500000E-02 -1.1800000E-02
 C    4.278500     -0.1725000     -0.4318000    
 C    2.661600      0.4550000       1.319100    
 H   0.2375000      -2.129400     -3.2099999E-02
 H   0.4348000       2.013800      -1.212500    
 H   -1.949300       2.260200     -0.8021000    
 H    2.165100     -0.5448000      -1.906600    
 H   -3.115900      -1.834600      0.9448000    


%chk=000002046-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000002046

0 1
O -2.577006 -2.287854 -0.502072
O -4.177390 1.524003 0.351667
O -4.530706 -0.686093 -0.086661
N -3.729603 0.352403 0.090944
N 5.449895 -0.777028 -0.541740
N 3.032971 2.835218 0.305199
C 0.504047 -0.255723 -0.222113
C -2.294898 0.125694 -0.020027
C -1.788107 -1.185472 -0.311104
C -0.384391 -1.344928 -0.406127
C -0.034101 1.045349 0.067078
C -1.414436 1.223457 0.164888
C 1.929975 -0.563749 -0.346251
C 3.042175 0.253586 -0.224046
C 4.358307 -0.311183 -0.394396
C 3.015766 1.662882 0.067594
H -0.010012 -2.349281 -0.628100
H 0.621417 1.904720 0.212998
H -1.846667 2.203468 0.384116
H 2.155665 -1.614481 -0.571959
H -3.550801 -1.989689 -0.398288


