%chk=000014713.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014713

0 1
 O    5.666800     -0.8569000      0.2133000    
 N    2.834600     -0.6216000      5.5599999E-02
 N   5.2000001E-02   2.660900      -2.494400    
 C  -0.5589000       1.240000     -0.3317000    
 C   -1.318900       2.216600      0.6718000    
 C   0.8004000      0.7333000      0.2705000    
 C    1.603400     -0.2214000     -0.6225000    
 C   -1.370100     -1.6700000E-02 -0.7444000    
 C  -0.4412000       3.425500       1.108200    
 C   -2.658900       2.740100      0.1117000    
 C    3.689300      0.5451000      0.3166000    
 C    3.568700      -1.615600     -0.7395000    
 C   -1.799600     -0.9067000      0.2137000    
 C  -0.2155000       2.038200      -1.551900    
 C   -1.604800     -0.1465000      -2.089000    
 C   -1.148900       4.363000       2.080200    
 C    4.972900      0.1017000       1.012700    
 C    4.854500      -2.008500     -1.7600000E-02
 C   -2.534700      -2.032700     -0.2274000    
 C   -2.327700      -1.253700      -2.522800    
 C   -1.543900     -0.7477000       1.585400    
 C   -2.790400      -2.191600      -1.599200    
 C   -2.992700      -2.966500      0.7162000    
 C   -2.006600      -1.685500       2.509100    
 C   -2.729600      -2.792700       2.075300    
 H   -1.595500       1.723700       1.599600    
 H    1.400000       1.640100      0.3974000    
 H   0.7297000      0.3103000       1.271700    
 H    1.825000      0.2401000      -1.592500    
 H    1.015500      -1.124800     -0.8163000    
 H  -0.1108000       4.010000      0.2429000    
 H   0.4558000       3.062400       1.620000    
 H   -3.254800       3.226400      0.8907000    
 H   -2.505600       3.461700     -0.6971000    
 H   -3.274300       1.921900     -0.2750000    
 H    3.225000       1.263700      0.9963000    
 H    3.937300       1.059200     -0.6209000    
 H    3.816000      -1.205400      -1.727300    
 H    2.957100      -2.513000     -0.8874000    
 H   -1.289300      0.5224000      -2.876500    
 H   -1.946200       4.929500       1.590400    
 H  -0.4350000       5.091800       2.478600    
 H   -1.573500       3.812700       2.925700    
 H    5.637700      0.9602000       1.152600    
 H    4.770500     -0.3255000       2.002600    
 H    4.646600      -2.507500      0.9368000    
 H    5.431300      -2.703900     -0.6358000    
 H   -2.533000      -1.390200      -3.580800    
 H  -0.9784000      4.3499999E-02   2.044200    
 H   -3.353400      -3.049500      -1.961000    
 H   -3.559400      -3.839700      0.3997000    
 H   -1.798200      -1.556000       3.567400    
 H   -3.088200      -3.523200       2.794700    


%chk=000014713-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000014713

0 1
O 5.830977 -1.010112 0.104465
N 2.977439 -0.443613 0.132925
N 0.242159 2.874211 -2.310838
C -0.495986 1.315829 -0.258616
C -1.353954 2.258894 0.709446
C 0.875614 0.873610 0.391405
C 1.609135 -0.230621 -0.399176
C -1.344264 0.098556 -0.741613
C -0.513011 3.425011 1.298947
C -2.628243 2.770940 -0.002708
C 3.959394 0.554041 -0.369349
C 3.490815 -1.818286 -0.107179
C -1.825193 -0.932976 0.166254
C -0.109289 2.155846 -1.424571
C -1.671195 -0.004307 -2.102122
C -1.290888 4.300260 2.307403
C 5.316007 0.352158 0.324723
C 4.849151 -1.993802 0.591742
C -2.633492 -2.017438 -0.375880
C -2.460231 -1.071246 -2.625320
C -1.558187 -0.972314 1.580875
C -2.937552 -2.063273 -1.774945
C -3.126624 -3.049134 0.491044
C -2.048094 -1.992231 2.399614
C -2.845240 -3.044688 1.856136
H -1.675986 1.618497 1.552714
H 1.526383 1.762863 0.456971
H 0.721309 0.524259 1.425438
H 1.624256 0.025739 -1.487855
H 1.051473 -1.179519 -0.303121
H -0.137393 4.061339 0.472592
H 0.375884 3.016062 1.815572
H -3.285678 3.296407 0.710627
H -2.374163 3.477354 -0.815032
H -3.208776 1.940428 -0.439657
H 3.593288 1.576338 -0.161204
H 4.094948 0.461769 -1.476482
H 3.613796 -2.029607 -1.199272
H 2.768755 -2.548807 0.304222
H -1.316971 0.763171 -2.797747
H -2.103518 4.868949 1.822743
H -0.614505 5.032178 2.785421
H -1.739677 3.683623 3.109738
H 6.081420 1.026451 -0.093790
H 5.206661 0.539209 1.414951
H 4.716649 -1.878119 1.689382
H 5.287189 -2.981387 0.371284
H -2.684607 -1.096427 -3.696736
H -0.951445 -0.194364 2.044892
H -3.547826 -2.889423 -2.158250
H -3.734094 -3.849734 0.052149
H -1.817474 -1.983809 3.470607
H -3.227044 -3.837753 2.507783


