%chk=000014420.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014420

0 1
 O   -2.992500      0.5724000     -0.4185000    
 O    3.318600      1.3100000E-02 -0.9610000    
 O   -2.038300       1.711200      -2.194000    
 O    2.861600      -1.486000      0.7429000    
 N   0.5659000       2.352100       1.390100    
 C   0.2030000      0.1599000     -0.3647000    
 C  -0.8237000       1.287900     -0.2031000    
 C    1.510100      0.4284000      0.3876000    
 C  -0.3917000      -1.142400      8.9800000E-02
 C  -0.6128000       2.306700      0.6613000    
 C    1.626400       1.473800       1.237000    
 C   -2.007400       1.230500      -1.076100    
 C    2.634100     -0.4775000      0.1003000    
 C   -1.567100       3.439200      0.9283000    
 C    2.842300       1.796200       2.062700    
 C  -0.2606000      -1.531000       1.417600    
 C   -1.066900      -1.944800     -0.8220000    
 C  -0.8130000      -2.740100       1.840000    
 C   -1.619400      -3.154000     -0.3995000    
 C   -1.492400      -3.551600      0.9315000    
 C   -4.218600      0.4334000      -1.143900    
 C    4.450000     -0.7646000      -1.365600    
 C   -5.216000     -0.3170000     -0.2871000    
 C    5.108500     -9.6000001E-02  -2.553500    
 H   0.4617000      9.7199999E-02  -1.431900    
 H   0.6879000       3.125500       2.034300    
 H   -1.096400       4.396400      0.6801000    
 H   -1.846800       3.456100       1.987200    
 H   -2.490100       3.364800      0.3463000    
 H    3.231100       2.784100       1.793300    
 H    3.652900       1.074400       1.928200    
 H    2.584400       1.805200       3.127200    
 H   0.2335000     -0.9182000       2.164900    
 H   -1.171200      -1.648400      -1.862100    
 H  -0.7203000      -3.047000       2.877800    
 H   -2.148900      -3.785500      -1.106700    
 H   -1.924100      -4.492200       1.260700    
 H   -4.613000       1.426000      -1.388300    
 H   -4.033800     -0.1229000      -2.069800    
 H    5.162800     -0.8312000     -0.5360000    
 H    4.120200      -1.772000      -1.643400    
 H   -6.166900     -0.4423000     -0.8123000    
 H   -4.826700      -1.304800     -1.9200001E-02
 H   -5.397200      0.2181000      0.6509000    
 H    5.979500     -0.6655000      -2.889800    
 H    4.402000     -5.7999999E-03  -3.385300    
 H    5.427600      0.9194000      -2.296100    


%chk=000014420-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000014420

0 1
O -3.185716 1.376897 -0.638525
O 2.890097 -0.222519 -1.206583
O -1.780256 0.155103 -2.036846
O 4.028472 0.922069 0.476684
N 0.094238 1.840604 2.046271
C 0.379376 0.115659 -0.185181
C -0.918100 0.899787 0.094881
C 1.577401 0.779900 0.496771
C 0.213563 -1.362077 0.238132
C -1.048513 1.646209 1.253479
C 1.402965 1.546166 1.635020
C -1.952142 0.760636 -0.940498
C 2.931947 0.533377 -0.023014
C -2.286683 2.344084 1.777197
C 2.491374 2.153932 2.492438
C 0.442480 -1.782843 1.573282
C -0.202941 -2.326311 -0.715622
C 0.254016 -3.131904 1.949347
C -0.391310 -3.675814 -0.342706
C -0.164712 -4.084840 0.992359
C -4.234615 1.234623 -1.690529
C 4.209788 -0.547564 -1.815380
C -5.474954 1.963652 -1.181661
C 3.921611 -1.351717 -3.079763
H 0.540598 0.117720 -1.275516
H -0.016781 2.378359 2.906631
H -2.590745 3.166497 1.107676
H -2.107763 2.759144 2.786799
H -3.141914 1.652804 1.820752
H 3.063396 2.909134 1.926344
H 3.228935 1.394398 2.796379
H 2.065039 2.632941 3.394165
H 0.783706 -1.056836 2.320203
H -0.389790 -2.004171 -1.745718
H 0.438198 -3.440898 2.985190
H -0.712103 -4.407937 -1.093010
H -0.307938 -5.132302 1.282087
H -3.848485 1.664845 -2.632444
H -4.416822 0.157733 -1.859603
H 4.744408 0.397299 -2.024661
H 4.803269 -1.118353 -1.077843
H -6.285455 1.888754 -1.929660
H -5.835204 1.521185 -0.236697
H -5.262358 3.032983 -1.008422
H 4.871456 -1.634989 -3.569475
H 3.364222 -2.272869 -2.838006
H 3.323047 -0.761349 -3.794623


