%chk=000026797.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026797

0 1
 O    5.833500     -0.5128000     -0.2864000    
 O  -0.3615000       1.946800       1.245200    
 O   -2.802100      -1.151300      -2.133100    
 N    3.486500       1.083300     -7.2499998E-02
 N   -2.669900       1.611800     -0.3527000    
 C    2.187400       1.405200      0.5144000    
 C    4.545700       1.133600      0.9448000    
 C    3.459000     -0.2427000     -0.7054000    
 C    1.117000       1.451800     -0.5668000    
 C    5.888900      0.7830000      0.3113000    
 C    4.828000     -0.5619000      -1.299400    
 C  -0.2297000       1.811600      2.8600000E-02
 C   -1.381700       1.962000     -0.9446000    
 C   -3.228700      0.3694000     -0.3586000    
 C   -3.482900       2.498600      0.2873000    
 C   -4.436700      0.4589000      0.2972000    
 C   -4.597400       1.806000      0.7060000    
 C   -2.639800     -0.7947000     -0.9470000    
 C   -1.737100      -1.694300     -0.1589000    
 C   -1.495600      -1.386600       1.157400    
 C   -1.191900      -2.786200     -0.7883000    
 C  -0.6555000      -2.224400       1.891100    
 C  -0.3519000      -3.624100     -5.4600000E-02
 C  -8.3700001E-02  -3.343100       1.285000    
 H    1.915300      0.6788000       1.292200    
 H    2.240900       2.388100       1.000600    
 H    4.328800      0.4253000       1.755100    
 H    4.609700       2.137900       1.379000    
 H    2.752000     -0.2925000      -1.537300    
 H    3.187700      -1.013400      2.7899999E-02
 H   0.9639000      0.4814000      -1.047000    
 H    1.365600       2.198700      -1.328900    
 H    6.668800      0.7620000       1.079200    
 H    6.186000       1.521900     -0.4430000    
 H    5.090100      0.1304000      -2.108900    
 H    4.826900      -1.574000      -1.716800    
 H   -1.228400       1.322100      -1.818800    
 H   -1.430600       3.002300      -1.282100    
 H   -3.213200       3.540300      0.3982000    
 H   -5.129300     -0.3546000      0.4657000    
 H   -5.433600       2.226100       1.246900    
 H   -1.922400     -0.5296000       1.665700    
 H   -1.381400      -3.030000      -1.828600    
 H  -0.4461000      -2.005900       2.934200    
 H   9.3999997E-02  -4.495000     -0.5263000    
 H   0.5708000      -3.995100       1.856200    


%chk=000026797-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000026797

0 1
O 6.740969 0.638142 -0.878672
O 0.010056 1.750021 1.329417
O -0.816230 -0.815667 -0.965173
N 4.009218 1.478078 -0.314210
N -2.297318 1.611398 -0.350322
C 2.707163 1.481378 0.398296
C 5.134924 1.831478 0.592064
C 4.298219 0.186478 -0.993668
C 1.521883 1.483734 -0.581846
C 6.445997 1.914341 -0.205579
C 5.622795 0.283354 -1.768101
C 0.180946 1.732056 0.085623
C -0.990861 1.999382 -0.891382
C -2.700086 0.304410 0.013398
C -3.318776 2.496000 -0.052995
C -4.025420 0.408634 0.513340
C -4.409933 1.777495 0.471925
C -1.862644 -0.873270 -0.219875
C -2.242892 -2.182728 0.413204
C -2.809040 -2.271360 1.713290
C -1.939874 -3.377241 -0.293860
C -3.085408 -3.533537 2.283417
C -2.231626 -4.635385 0.270113
C -2.808668 -4.717128 1.560862
H 2.607167 0.620171 1.102730
H 2.659469 2.397302 1.016073
H 5.254843 1.079065 1.412190
H 4.924833 2.813126 1.057984
H 3.484966 -0.049046 -1.704453
H 4.361533 -0.652779 -0.255261
H 1.415075 0.513915 -1.109278
H 1.696189 2.244781 -1.370896
H 7.305616 2.103233 0.458654
H 6.370059 2.726840 -0.960517
H 5.526333 1.047154 -2.570154
H 5.895969 -0.688621 -2.211181
H -0.795595 1.468498 -1.836222
H -1.013689 3.088392 -1.093705
H -3.202233 3.564577 -0.227594
H -4.641488 -0.431441 0.827020
H -5.362941 2.203065 0.779729
H -2.989830 -1.359580 2.291391
H -1.472388 -3.294666 -1.280663
H -3.505940 -3.593299 3.293326
H -2.007065 -5.550553 -0.288745
H -3.028877 -5.695097 2.003505


