%chk=000025236.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025236

0 1
 O   -1.330800       1.069000      -1.388900    
 O   -2.765800      -2.002500      -1.570500    
 N    1.464600      0.7605000     -0.8544000    
 C   0.9417000       1.804400      -1.737500    
 C    2.817400      0.3796000      -1.264100    
 C    1.455500       1.209800      0.5328000    
 C    3.338200     -0.7559000     -0.3846000    
 C    2.371600       2.420200      0.7046000    
 C  -0.4658000       2.193100      -1.283600    
 C   0.9567000       1.320900      -3.187900    
 C    4.743200      -1.184200     -0.8098000    
 C    2.360300       2.921100       2.149300    
 C    5.282900      -2.290100      8.3099999E-02
 C    3.297100       4.104000       2.336500    
 C   -2.394900       1.026200     -0.5268000    
 C   -2.909700     -0.1925000     -9.6100003E-02
 C   -2.952100       2.223200     -8.7600000E-02
 C   -3.992500     -0.2145000      0.7828000    
 C   -2.336400      -1.453300     -0.5462000    
 C   -4.034900       2.201000      0.7915000    
 C   -4.555100      0.9823000       1.226600    
 C   -1.227200      -2.133200      0.1863000    
 C  -0.7330000      -1.543800       1.327200    
 C  -0.7431000      -3.322500     -0.3079000    
 C   0.3031000      -2.179100       2.011700    
 C   0.2930000      -3.957700      0.3768000    
 C   0.8160000      -3.385900       1.536700    
 H    1.559900       2.708700      -1.737100    
 H    3.525300       1.214000      -1.313900    
 H    2.794800     -4.8000000E-02  -2.272900    
 H    1.757700      0.4131000       1.218700    
 H   0.4491000       1.427200      0.9015000    
 H    2.659700      -1.616000     -0.4352000    
 H    3.423000     -0.4597000      0.6648000    
 H    2.070000       3.269300      8.5600004E-02
 H    3.413000       2.184900      0.4653000    
 H  -0.8438000       2.957100      -1.977000    
 H  -0.4610000       2.668700     -0.2976000    
 H    1.962400       1.329500      -3.620800    
 H   0.5376000      0.3132000      -3.291100    
 H   0.3527000       1.985900      -3.816600    
 H    4.727300      -1.536100      -1.847800    
 H    5.424200     -0.3260000     -0.7681000    
 H    1.343700       3.217900       2.432800    
 H    2.663800       2.113800       2.826200    
 H    6.284700      -2.585900     -0.2436000    
 H    5.349900      -1.957800       1.124000    
 H    4.638200      -3.174100      4.5499999E-02
 H    3.271800       4.445800       3.375900    
 H    4.329100       3.830600       2.094600    
 H    3.004200       4.942600       1.696600    
 H   -2.606300       3.194500     -0.4274000    
 H   -4.407200      -1.157900       1.128800    
 H   -4.478900       3.132400       1.130700    
 H   -5.399400      0.9652000       1.909500    
 H   -1.105700     -0.6076000       1.727600    
 H   -1.133400      -3.786200      -1.208400    
 H   0.7120000      -1.733100       2.913800    
 H   0.6937000      -4.896900      6.6000000E-03
 H    1.624100      -3.879300       2.068600    


%chk=000025236-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000025236

0 1
O -1.210102 0.790918 -0.671177
O -3.593278 -2.319626 -1.061142
N 1.779428 0.706377 -0.679889
C 0.937011 1.497127 -1.621368
C 3.097802 0.333048 -1.256949
C 1.851870 1.217666 0.710667
C 3.893974 -0.674160 -0.400150
C 2.545584 2.595630 0.921708
C -0.387841 1.969564 -0.995591
C 0.632148 0.706587 -2.918541
C 5.089713 -1.273105 -1.177256
C 2.594474 2.998001 2.413141
C 5.938692 -2.233432 -0.316722
C 3.290638 4.355627 2.651462
C -2.511888 1.001421 -0.205786
C -3.322810 -0.164084 -0.048001
C -3.052275 2.286431 0.058476
C -4.679121 -0.000076 0.327172
C -2.849690 -1.562918 -0.359823
C -4.396702 2.414587 0.470458
C -5.219538 1.273583 0.601878
C -1.568075 -2.086915 0.214701
C -0.979284 -1.520294 1.374304
C -0.979491 -3.237692 -0.374131
C 0.176185 -2.098138 1.939869
C 0.186323 -3.802819 0.178834
C 0.765633 -3.235627 1.340279
H 1.452292 2.453645 -1.918924
H 3.741708 1.230303 -1.459407
H 2.912557 -0.144051 -2.235142
H 2.382612 0.460565 1.316191
H 0.827653 1.250140 1.126835
H 3.206624 -1.483964 -0.083704
H 4.279015 -0.193274 0.521504
H 2.015271 3.385684 0.349754
H 3.578512 2.559524 0.519031
H -0.921376 2.595690 -1.739970
H -0.226395 2.575585 -0.082943
H 1.526011 0.580661 -3.551835
H 0.229372 -0.286756 -2.661073
H -0.121914 1.244953 -3.521454
H 4.711652 -1.811986 -2.069650
H 5.731646 -0.451440 -1.557223
H 1.561375 3.035650 2.817172
H 3.120820 2.206757 2.986000
H 6.782679 -2.655037 -0.892983
H 6.357950 -1.711496 0.564349
H 5.326402 -3.077180 0.053818
H 3.310303 4.618801 3.725198
H 4.335741 4.333045 2.289459
H 2.768115 5.169292 2.113614
H -2.440965 3.184688 -0.064896
H -5.301576 -0.898408 0.396241
H -4.801455 3.412066 0.675818
H -6.265565 1.375041 0.907484
H -1.437804 -0.640911 1.839647
H -1.459410 -3.673196 -1.256947
H 0.617596 -1.665144 2.844613
H 0.641043 -4.685142 -0.285292
H 1.666331 -3.681886 1.777893


