%chk=000026478.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026478

0 1
 O   0.8924000     -5.8699999E-02  7.2400004E-02
 N    4.524500     -0.6745000      0.1925000    
 N  -0.2051000     -0.9281000      0.1235000    
 N   -1.281600       1.639300      -1.325500    
 C    3.279700      8.7300003E-02  9.6900001E-02
 C    4.619300      -1.638500     -0.9031000    
 C    5.676800      0.2260000      0.1821000    
 C    2.076800     -0.8409000      0.1510000    
 C    5.882200      -2.466400     -0.7626000    
 C    5.571300       1.222400       1.320700    
 C   -1.338800     -0.2912000      5.7000000E-02
 C   -2.655800     -0.9721000      9.0099998E-02
 C   -1.313600       1.200300     -6.6900000E-02
 C   -3.804500     -0.2108000      6.0999999E-03
 C   -2.694600      -2.347400      0.2045000    
 C   -1.324000       1.951200       1.071600    
 C   -5.043300     -0.8513000      3.7700001E-02
 C   -3.933200      -2.988000      0.2359000    
 C   -5.107600      -2.239900      0.1526000    
 C   -1.298700       3.330800      0.8998000    
 C   -1.257500       2.984900      -1.453000    
 C   -1.264700       3.865600     -0.3833000    
 H    3.155100      0.7816000      0.9350000    
 H    3.240200      0.6954000     -0.8171000    
 H    3.808400      -2.370500     -0.8654000    
 H    4.591500      -1.154800      -1.887300    
 H    6.606100     -0.3258000      0.3552000    
 H    5.777000      0.7594000     -0.7714000    
 H    2.071600      -1.416600       1.084800    
 H    2.040600      -1.529400     -0.6974000    
 H    6.781900      -1.913500      -1.050200    
 H    6.009200      -2.851700      0.2552000    
 H    5.827800      -3.333200      -1.431500    
 H    4.852700       2.022200       1.116200    
 H    5.312200      0.7387000       2.269000    
 H    6.540800       1.713400       1.464900    
 H   -3.808400      0.8693000     -8.7899998E-02
 H   -1.794100      -2.950300      0.2711000    
 H   -1.349500       1.515500       2.063200    
 H   -5.958100     -0.2695000     -2.8100001E-02
 H   -3.983800      -4.069300      0.3254000    
 H   -6.072100      -2.738700      0.1769000    
 H   -1.305000       3.987900       1.764200    
 H   -1.231300       3.351500      -2.473900    
 H   -1.244400       4.937800     -0.5410000    


%chk=000026478-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000026478

0 1
O 0.941393 0.174748 0.067729
N 4.594590 -0.632235 0.082685
N -0.242370 -0.655092 0.240836
N -2.424405 1.766225 -1.281385
C 3.359086 0.184679 -0.018661
C 4.916975 -1.341238 -1.186154
C 5.749642 0.109545 0.653431
C 2.130864 -0.688500 0.276975
C 5.736106 -2.627485 -0.966225
C 5.631642 0.321911 2.174739
C -1.381897 -0.005646 0.029163
C -2.605859 -0.852651 0.149016
C -1.503932 1.450908 -0.311197
C -3.860536 -0.280950 0.493154
C -2.526448 -2.260689 -0.041995
C -0.720037 2.445518 0.333127
C -5.001825 -1.096122 0.649827
C -3.668075 -3.071846 0.113330
C -4.912711 -2.494299 0.461263
C -0.904055 3.798859 -0.020197
C -2.572926 3.075790 -1.625413
C -1.844571 4.127637 -1.022838
H 3.398540 1.003055 0.721962
H 3.243316 0.661611 -1.020364
H 3.960944 -1.612550 -1.671834
H 5.452493 -0.667937 -1.902906
H 6.660134 -0.483543 0.452518
H 5.896122 1.095724 0.143228
H 2.148500 -1.054514 1.318843
H 2.067742 -1.555358 -0.406663
H 6.719578 -2.418298 -0.507788
H 5.189583 -3.315067 -0.297654
H 5.919206 -3.137976 -1.930224
H 4.738108 0.916332 2.439837
H 5.555862 -0.651851 2.688923
H 6.517607 0.860492 2.560215
H -3.945435 0.800131 0.635467
H -1.562729 -2.701186 -0.314215
H 0.012391 2.153283 1.088086
H -5.961381 -0.639240 0.916729
H -3.591145 -4.153768 -0.043281
H -5.801377 -3.124947 0.577506
H -0.319226 4.581953 0.473913
H -3.308494 3.279540 -2.412412
H -2.012590 5.164447 -1.331194


