%chk=000040729.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040729

0 1
 O    2.010100      0.3777000      -1.705200    
 O   -2.425700      -1.999000     -0.3063000    
 N    3.073200      -1.076000       1.175000    
 C   0.2354000      0.5034000     -0.1009000    
 C    1.706000      0.6102000     -0.3232000    
 C  -0.4151000     -0.7126000     -0.3109000    
 C  -0.4896000       1.619100      0.3177000    
 C   -1.790700     -0.8127000     -0.1021000    
 C   -1.865100       1.519100      0.5264000    
 C   -2.515600      0.3032000      0.3165000    
 C    2.477000     -0.3325000      0.5128000    
 H    2.046000       1.629000     -0.1005000    
 H   0.1378000      -1.588300     -0.6427000    
 H   2.0000001E-03   2.573600      0.4858000    
 H   -2.429600       2.387800      0.8524000    
 H   -3.587500      0.2384000      0.4829000    
 H    2.960000      0.5469000      -1.828900    
 H   -3.372600      -1.886600     -0.1146000    


%chk=000040729-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000040729

0 1
O 2.026656 -0.188552 -1.642343
O -2.503700 -1.929325 -0.684954
N 3.191439 -0.172759 1.641219
C 0.219492 0.506016 -0.171318
C 1.718114 0.621080 -0.458660
C -0.481462 -0.652445 -0.559283
C -0.440765 1.557805 0.510138
C -1.859171 -0.754669 -0.264179
C -1.815833 1.438084 0.804690
C -2.534577 0.284481 0.421177
C 2.526367 0.174308 0.712770
H 1.971887 1.688476 -0.634847
H 0.022178 -1.455872 -1.101307
H 0.108736 2.457154 0.810435
H -2.334255 2.246465 1.330911
H -3.604813 0.198497 0.649490
H 3.006094 -0.198106 -1.797053
H -3.460387 -1.919936 -0.432687


