%chk=000028883.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028883

0 1
 O   0.7776000       2.125300     -8.2300000E-02
 N    1.251200     -0.1998000      9.4200000E-02
 N    5.237700       1.508300      0.3578000    
 C    2.677400     -0.1079000      0.2470000    
 C    3.351800      0.5678000     -0.9453000    
 C    4.869800      0.7190000     -0.8114000    
 C   0.6270000      -1.529400      9.6100003E-02
 C   0.2270000      -2.033400       1.295800    
 C   0.4927000      -2.161600      -1.102000    
 C   0.4161000      0.9486000     -5.9400000E-02
 C  -0.3663000      -3.295800       1.297500    
 C  -0.1007000      -3.424000      -1.100400    
 C   0.3889000      -1.313600       2.595500    
 C   0.9427000      -1.580700      -2.403400    
 C    6.693400       1.572400      0.4997000    
 C    4.677000       2.857600      0.2663000    
 C  -0.5302000      -3.991000      9.9399999E-02
 C   -1.038800      0.6383000     -0.2023000    
 C   -1.952300       1.541600      0.1821000    
 C   -3.409400       1.361700      5.9799999E-02
 C   -3.926100      8.3700001E-02 -8.0700003E-02
 C   -4.235600       2.473700      8.8000000E-02
 C   -5.305800     -8.6900003E-02 -0.1960000    
 C   -5.615200       2.303200     -2.7100001E-02
 C   -6.150200       1.022800     -0.1691000    
 H    2.854500      0.4792000       1.155200    
 H    3.105700      -1.104300      0.4090000    
 H    2.893500       1.532500      -1.182200    
 H    3.175700     -4.1200001E-02  -1.838500    
 H    5.269700       1.161700      -1.733200    
 H    5.303700     -0.2858000     -0.7275000    
 H  -0.7072000      -3.752800       2.222800    
 H  -0.2332000      -3.978900      -2.025500    
 H    1.445800      -1.108100       2.793300    
 H  -0.1697000     -0.3726000       2.592100    
 H   1.4600000E-02  -1.907100       3.437000    
 H    1.995600      -1.822200      -2.575700    
 H   0.7999000     -0.4984000      -2.457100    
 H   0.3650000      -2.000500      -3.235400    
 H    6.968400       2.120200       1.408000    
 H    7.114800      0.5661000      0.6029000    
 H    7.171500       2.061100     -0.3570000    
 H    3.588500       2.857800      0.3744000    
 H    5.045900       3.479100       1.091400    
 H    4.943300       3.357400     -0.6723000    
 H  -0.9919000      -4.974100      0.1007000    
 H   -1.338700     -0.2732000     -0.6978000    
 H   -1.635800       2.481400      0.6290000    
 H   -3.310800     -0.8105000     -8.2000002E-02
 H   -3.833800       3.477600      0.1968000    
 H   -5.723400      -1.084100     -0.3009000    
 H   -6.273000       3.167200     -6.2000002E-03
 H   -7.224500      0.8901000     -0.2574000    


%chk=000028883-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000028883

0 1
O 0.893461 1.957481 0.130750
N 1.214854 -0.347894 0.215817
N 5.030419 1.723990 0.383948
C 2.673057 -0.115486 0.411568
C 3.411818 0.256487 -0.893978
C 4.880387 0.655317 -0.632453
C 0.733522 -1.713274 0.125176
C 0.689000 -2.505887 1.312180
C 0.334156 -2.247850 -1.137517
C 0.388937 0.781396 0.126216
C 0.252483 -3.849953 1.212889
C -0.098736 -3.596257 -1.191013
C 1.079522 -1.927757 2.660345
C 0.344412 -1.403902 -2.399199
C 6.449128 1.948433 0.723454
C 4.338284 2.982090 0.022412
C -0.136207 -4.396155 -0.028824
C -1.079019 0.541704 0.063019
C -1.941124 1.594189 -0.071900
C -3.409325 1.542688 -0.133108
C -4.154984 0.329519 -0.049059
C -4.128052 2.763598 -0.285255
C -5.561362 0.342515 -0.116533
C -5.536929 2.777454 -0.352701
C -6.260748 1.565733 -0.268820
H 2.808617 0.706193 1.135393
H 3.109081 -1.034514 0.841835
H 2.871582 1.086283 -1.382938
H 3.409330 -0.602034 -1.593893
H 5.343881 0.951578 -1.612190
H 5.443023 -0.228222 -0.268055
H 0.209901 -4.464596 2.119892
H -0.403616 -4.018321 -2.155879
H 2.176093 -1.948171 2.812253
H 0.765573 -0.873644 2.753522
H 0.622914 -2.505306 3.482152
H 1.264221 -0.800767 -2.481018
H -0.501904 -0.690546 -2.412729
H 0.260828 -2.040388 -3.296530
H 6.523639 2.687776 1.541012
H 6.905462 1.003831 1.072116
H 7.058044 2.326999 -0.138502
H 3.249846 2.818084 -0.053216
H 4.509295 3.728239 0.818999
H 4.705382 3.416869 -0.942868
H -0.470776 -5.437757 -0.090098
H -1.434724 -0.490689 0.147672
H -1.476526 2.589171 -0.140674
H -3.631916 -0.625846 0.070487
H -3.568048 3.704610 -0.350336
H -6.118229 -0.598926 -0.049831
H -6.068970 3.727973 -0.469865
H -7.355156 1.571440 -0.320427


