%chk=000038605.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038605

0 1
 O   -1.743400      -1.496300      8.3999999E-02
 O   0.1122000      5.2800000E-02   2.957600    
 O   -3.155800       2.849500      -1.470400    
 O   0.4926000       2.527200       1.429100    
 O   -3.525700     -3.7900001E-02  -1.466600    
 O    6.764500      -2.330800     -0.2433000    
 N   -3.106600      -3.961000     -0.3078000    
 C   0.3188000     -0.2953000       1.581900    
 C  -0.6303000      0.5114000      0.7514000    
 C    1.813000     -8.7899998E-02   1.249000    
 C   -1.636100     -0.1349000      2.8200001E-02
 C  -0.4956000       1.906100      0.7143000    
 C    2.220300     -0.4953000     -0.1732000    
 C   -1.395600       2.650200     -6.8499997E-02
 C   -2.541800      0.5851000     -0.7567000    
 C   -2.382800       1.969600     -0.7737000    
 C    3.694200     -0.3534000     -0.4596000    
 C   -1.590200       4.025600     -0.3622000    
 C   -2.576100      -2.034800       1.106300    
 C   -2.580200      -3.550300      0.9853000    
 C   -2.667700       4.091300      -1.214800    
 C    4.558300      -1.420800     -0.2154000    
 C    4.193200      0.8454000     -0.9689000    
 C    5.921400      -1.289300     -0.4806000    
 C   7.8100003E-02   3.468900       2.412600    
 C    5.556200      0.9770000      -1.234200    
 C    6.420300     -9.0499997E-02 -0.9901000    
 C   -4.870800      0.3180000      -1.156700    
 C   -4.569100      -3.877100     -0.3225000    
 C   -2.675400      -5.322500     -0.6343000    
 H   0.1215000      -1.368800       1.506800    
 H    2.150600      0.9318000       1.458300    
 H    2.393600     -0.6952000       1.959100    
 H    1.918700      -1.535200     -0.3552000    
 H    1.662800      0.1011000     -0.9066000    
 H   -1.017500       4.871000     -9.9999998E-03
 H   -2.175700      -1.759900       2.089400    
 H   -3.585500      -1.615100       1.037600    
 H   0.6991000     -0.5071000       3.493900    
 H   -3.130800      -4.004500       1.818300    
 H   -1.535900      -3.878500       1.075000    
 H   -3.182600       4.904400      -1.705300    
 H    4.168600      -2.354300      0.1835000    
 H    3.529900       1.684700      -1.161000    
 H   0.7843000       3.417900       3.246600    
 H  -0.9231000       3.251000       2.800700    
 H   0.1149000       4.480600       2.000900    
 H    5.944800       1.910600      -1.630200    
 H    7.481200      1.7999999E-02  -1.198700    
 H   -5.007900      0.4730000     -8.1000000E-02
 H   -5.162900       1.214700      -1.710400    
 H   -5.519700     -0.5043000      -1.471300    
 H   -5.029000      -4.516100      0.4403000    
 H   -4.918400      -2.851400     -0.1717000    
 H   -4.956600      -4.185300      -1.300600    
 H   -1.582500      -5.378600     -0.6907000    
 H   -3.052900      -5.620300      -1.619000    
 H   -3.022800      -6.053400      0.1049000    
 H    6.251100      -3.079000      0.1070000    


%chk=000038605-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000038605

0 1
O -1.755679 -1.415797 0.593720
O 0.269955 0.359464 3.315546
O -3.462731 2.932096 -1.106450
O 0.530947 2.836392 1.464614
O -3.762381 -0.123719 -0.863574
O 6.272276 -2.648394 -1.509308
N -2.703850 -4.197435 0.022077
C 0.366415 -0.102488 1.898536
C -0.655637 0.694396 1.103052
C 1.818701 0.024468 1.379065
C -1.741804 -0.011053 0.482301
C -0.554259 2.098709 0.937615
C 1.970210 -0.463652 -0.086891
C -1.537817 2.779791 0.179288
C -2.733311 0.649394 -0.303768
C -2.604100 2.048674 -0.407809
C 3.410596 -0.392033 -0.573747
C -1.743601 4.173138 -0.183726
C -2.936814 -2.005672 1.280745
C -2.763473 -3.522965 1.332371
C -2.890273 4.225171 -0.942470
C 4.151926 -1.573983 -0.818841
C 4.041597 0.863689 -0.775671
C 5.497543 -1.498940 -1.252998
C 0.261150 3.468347 2.779034
C 5.384444 0.926915 -1.210939
C 6.125280 -0.250034 -1.452208
C -4.239879 0.264642 -2.209170
C -3.832530 -3.891542 -0.874724
C -2.466543 -5.644272 0.171634
H 0.067102 -1.166656 1.853541
H 2.140147 1.076154 1.464867
H 2.479645 -0.589121 2.027813
H 1.586564 -1.498937 -0.171763
H 1.325365 0.165782 -0.730151
H -1.101947 5.011019 0.078762
H -2.974558 -1.612476 2.317366
H -3.855187 -1.702652 0.749590
H 0.991739 -0.091339 3.825599
H -3.615469 -3.906443 1.963000
H -1.828861 -3.758216 1.877397
H -3.434585 5.028220 -1.431545
H 3.673096 -2.552871 -0.672713
H 3.477054 1.786219 -0.596115
H 1.172091 4.036875 3.023403
H 0.076144 2.679793 3.528709
H -0.605176 4.155422 2.711371
H 5.861686 1.900812 -1.368343
H 7.164929 -0.221417 -1.791180
H -4.736611 1.248402 -2.185118
H -3.397229 0.285593 -2.924709
H -4.955896 -0.521886 -2.491472
H -4.831191 -4.176645 -0.450246
H -3.846091 -2.814019 -1.110069
H -3.698178 -4.442937 -1.822549
H -1.549424 -5.812326 0.765565
H -2.317766 -6.101973 -0.822739
H -3.307178 -6.187838 0.678340
H 5.740627 -3.468047 -1.353113


