%chk=000060816.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060816

0 1
 O    7.723300      -1.075900     -4.2300001E-02
 N    2.664600      0.9523000      1.4700000E-02
 N    4.085500     -0.9151000      3.0500000E-02
 N    4.981200       1.320900     -4.1800000E-02
 C   -2.307400       1.072100      6.3800000E-02
 C   -1.069800      0.1731000      0.1158000    
 C   -3.628400      0.2936000      7.2899997E-02
 C   0.2178000       1.003300      7.2999999E-02
 C   -4.898400       1.152900      3.9000001E-02
 C    1.474300      0.1365000      5.7999998E-02
 C   -6.176600      0.3538000     -4.3000001E-03
 C   -6.717200       0.000000      -1.231300    
 C   -6.790500     -1.3800000E-02   1.183400    
 C    3.950700      0.4365000      1.1000000E-03
 C   -7.899800     -0.7388000      -1.271500    
 C   -7.972900     -0.7527000       1.143300    
 C   -8.527600      -1.115100     -8.4200002E-02
 C    5.350900      -1.382800      1.5100000E-02
 C    6.219100      0.7846000     -5.5000000E-02
 C    6.467100     -0.5726000     -2.7500000E-02
 C    5.501400      -2.867900      4.9100000E-02
 C    7.352700       1.755100     -0.1018000    
 H   -2.269200       1.692400     -0.8402000    
 H   -2.292800       1.758300      0.9196000    
 H   -1.089400     -0.4312000       1.030500    
 H   -1.087400     -0.5212000     -0.7329000    
 H   -3.636100     -0.3889000     -0.7871000    
 H   -3.654900     -0.3449000      0.9656000    
 H   0.2473000       1.676700      0.9391000    
 H   0.2106000       1.643600     -0.8185000    
 H   -4.862300       1.822100     -0.8307000    
 H   -4.913500       1.816100      0.9137000    
 H    1.488400     -0.4937000      0.9555000    
 H    1.447200     -0.5257000     -0.8158000    
 H    2.577000       1.961800     -8.9999996E-03
 H   -6.234600      0.2865000      -2.161400    
 H   -6.365200      0.2620000       2.144200    
 H   -8.331400      -1.021500      -2.227200    
 H   -8.461500      -1.046200       2.067700    
 H   -9.448100      -1.690500     -0.1153000    
 H    6.060200      -3.175600      0.9387000    
 H    4.524100      -3.361200      8.0300003E-02
 H    6.025600      -3.220000     -0.8451000    
 H    7.952000       1.608400      -1.006100    
 H    6.981000       2.785600     -0.1187000    
 H    7.989200       1.651100      0.7828000    
 H    8.383100     -0.3656000     -7.2800003E-02


%chk=000060816-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000060816

0 1
O 7.777604 -1.161674 0.019703
N 2.698465 0.955481 -0.004694
N 4.100547 -0.940215 0.014420
N 5.007266 1.339022 -0.006253
C -2.346764 1.112770 0.005274
C -1.083323 0.223404 0.003742
C -3.660047 0.299791 0.007000
C 0.227922 1.039894 0.001259
C -4.925862 1.202342 0.008114
C 1.478066 0.139159 -0.000451
C -6.217762 0.398628 0.009506
C -6.823521 -0.007325 -1.208101
C -6.824021 -0.002616 1.228409
C 3.971089 0.429505 0.002049
C -7.998972 -0.791939 -1.210162
C -7.999482 -0.787242 1.232984
C -8.591587 -1.186092 0.012058
C 5.369959 -1.443305 0.020325
C 6.272046 0.830554 -0.000579
C 6.492229 -0.573549 0.013174
C 5.546945 -2.940091 0.034451
C 7.425769 1.811150 -0.009584
H -2.328955 1.778654 -0.883072
H -2.326690 1.778910 0.893369
H -1.101358 -0.441103 0.891986
H -1.104146 -0.441882 -0.883878
H -3.690053 -0.365006 -0.879824
H -3.688148 -0.364530 0.894222
H 0.250465 1.701060 0.892291
H 0.247103 1.700087 -0.890679
H -4.888600 1.861574 -0.881748
H -4.886939 1.861909 0.897642
H 1.475679 -0.525176 0.886741
H 1.470241 -0.528552 -0.885349
H 2.634893 1.973386 -0.016435
H -6.372364 0.299387 -2.160514
H -6.373237 0.307724 2.179818
H -8.454227 -1.091811 -2.161182
H -8.455122 -1.083471 2.184962
H -9.504576 -1.792210 0.013038
H 6.120665 -3.260022 0.923698
H 4.560144 -3.427165 0.036334
H 6.125486 -3.276111 -0.845660
H 8.067110 1.687612 -0.904982
H 7.021621 2.834420 -0.019939
H 8.066227 1.705520 0.888762
H 8.477515 -0.462456 0.014654


