%chk=000041373.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041373

0 1
 O   0.2625000      8.3099999E-02  -2.005000    
 O    1.463300       1.717500       2.128700    
 O    3.013900     -0.6449000      6.3000001E-02
 O    5.142900     -0.3202000     -0.7734000    
 N  -0.6011000       1.405400       1.090800    
 N    1.243900      0.8776000     -4.3200001E-02
 C   -1.122800      0.9504000     -0.1879000    
 C   -1.710600       2.149700     -0.9427000    
 C   0.1938000      0.5702000     -0.8830000    
 C   -2.036600     -0.2543000     -1.2200000E-02
 C   0.7930000       1.375000       1.163300    
 C   -2.921900       2.721500     -0.2271000    
 C    2.640200      0.6658000     -0.3681000    
 C   -1.953000      -1.031600       1.143700    
 C   -2.959000     -0.5823000      -1.006500    
 C   -2.790300      -2.135500       1.304900    
 C   -3.796500      -1.686200     -0.8452000    
 C   -3.712000      -2.462700      0.3106000    
 C    4.300900      -1.004700     -0.2077000    
 C    4.549400      -2.393800      0.2970000    
 H   -1.980900       1.888100      -1.972200    
 H  -0.9593000       2.946700      -1.033100    
 H   -1.183800       1.719000       1.861300    
 H   -3.735200       1.997100     -0.1319000    
 H   -2.670600       3.090300      0.7720000    
 H   -3.313300       3.573000     -0.7944000    
 H    2.772500      0.7496000      -1.452100    
 H    3.246800       1.410000      0.1589000    
 H   -1.239500     -0.8213000       1.934700    
 H   -3.039700     -1.1300000E-02  -1.925600    
 H   -2.722400      -2.742800       2.202800    
 H   -4.511500      -1.944000      -1.621100    
 H   -4.362800      -3.323200      0.4353000    
 H    4.400300      -2.427300       1.379100    
 H    5.582400      -2.679600      7.8699999E-02
 H    3.880300      -3.096300     -0.2063000    


%chk=000041373-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000041373

0 1
O 0.543291 0.286610 -1.873309
O 1.449582 2.122065 2.369681
O 3.057035 -0.529019 0.346811
O 4.463447 -0.668682 -1.519080
N -0.583443 1.658430 1.218926
N 1.347142 1.115805 0.197205
C -1.021601 1.093056 -0.072336
C -1.752334 2.165978 -0.943700
C 0.355267 0.760208 -0.730875
C -1.844414 -0.203379 0.084820
C 0.787306 1.685320 1.400857
C -3.095825 2.632301 -0.348263
C 2.760839 0.896084 0.022734
C -2.087005 -0.772642 1.358322
C -2.352008 -0.856235 -1.068741
C -2.845873 -1.959016 1.481758
C -3.105420 -2.042894 -0.944548
C -3.362459 -2.596015 0.331838
C 3.899592 -1.219408 -0.550939
C 3.986795 -2.674875 -0.154694
H -1.906554 1.738013 -1.950224
H -1.070003 3.028981 -1.066217
H -1.214085 2.078809 1.898284
H -3.791876 1.786013 -0.213245
H -2.962884 3.131379 0.630358
H -3.576121 3.364029 -1.021595
H 3.071060 1.093001 -1.017187
H 3.302150 1.523273 0.748126
H -1.671218 -0.300638 2.254453
H -2.135236 -0.455785 -2.064391
H -3.026972 -2.385684 2.474585
H -3.486519 -2.538759 -1.844069
H -3.949925 -3.515852 0.426929
H 4.123329 -2.773244 0.934429
H 4.816486 -3.156389 -0.692022
H 3.041754 -3.182839 -0.418581


