%chk=000045219.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000045219

0 1
 N   0.2640000      0.1827000     -0.1019000    
 N   -3.195100       1.567100      0.1289000    
 C   -1.175000      0.2697000     -0.3477000    
 C   -1.762800       1.470100      0.3884000    
 C   0.9402000       1.381900     -0.5953000    
 C   0.8191000      -1.013600     -0.7338000    
 C   -3.773000       2.702800      0.8489000    
 C   -3.450600       1.692400      -1.307000    
 C    2.417100       1.353000     -0.3043000    
 C   0.1447000      -2.268900     -0.2478000    
 C   -3.519000       2.592600       2.342700    
 C   -4.941200       1.729000      -1.598100    
 C    2.889400       1.886600      0.8867000    
 C   0.6512000      -2.930800      0.8621000    
 C    3.285400      0.7927000      -1.230900    
 C  -0.9742000      -2.746300     -0.9160000    
 C    4.257700       1.859700       1.156500    
 C   2.6400000E-02  -4.093600       1.312700    
 C    4.653700      0.7657000     -0.9608000    
 C   -1.599000      -3.909200     -0.4653000    
 C    5.139700       1.299300      0.2329000    
 C   -1.098700      -4.582800      0.6490000    
 H   -1.319200      0.3107000      -1.430200    
 H   -1.714200     -0.5936000      5.0700001E-02
 H   -1.312300       2.420200      9.0899996E-02
 H   -1.555900       1.317300       1.453500    
 H   0.5809000       2.299100     -0.1217000    
 H   0.7796000       1.520400      -1.673900    
 H    1.878000      -1.150000     -0.4940000    
 H   0.7511000     -0.9652000      -1.829900    
 H   -3.389500       3.662600      0.4799000    
 H   -4.861800       2.716400      0.7352000    
 H   -2.962300       2.574400      -1.739800    
 H   -3.105800      0.8147000      -1.857600    
 H   -3.760100       1.594700       2.725000    
 H   -2.487500       2.840100       2.612100    
 H   -4.157300       3.306800       2.875300    
 H   -5.477100      0.9273000      -1.078100    
 H   -5.395300       2.689400      -1.335600    
 H   -5.109900       1.589700      -2.672200    
 H    2.211800       2.322900       1.615300    
 H    1.524900      -2.557800       1.389100    
 H    2.924800      0.3878000      -2.172300    
 H   -1.366700      -2.242600      -1.795000    
 H    4.636200       2.274500       2.086200    
 H   0.4154000      -4.617900       2.180600    
 H    5.341100      0.3326000      -1.681500    
 H   -2.473000      -4.292200     -0.9841000    
 H    6.205100       1.278900      0.4427000    
 H   -1.584800      -5.488500      0.9995000    


%chk=000045219-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000045219

0 1
N 0.208594 0.119708 -0.624306
N -3.137232 1.855467 -0.009302
C -1.248448 0.383127 -0.753243
C -1.731723 1.452974 0.251679
C 1.036436 1.122960 -1.336465
C 0.593497 -1.270880 -0.970390
C -3.888039 2.188876 1.230641
C -3.235772 2.910762 -1.053675
C 2.486575 1.169648 -0.862992
C 0.062789 -2.309643 0.012682
C -4.289999 0.939629 2.037901
C -4.599654 2.929723 -1.770510
C 2.799680 1.088686 0.517911
C 0.039236 -2.045253 1.405805
C 3.540916 1.346894 -1.792363
C -0.370167 -3.577875 -0.447207
C 4.137301 1.186568 0.958741
C -0.401560 -3.028915 2.317769
C 4.881655 1.449310 -1.354480
C -0.808089 -4.567236 0.463325
C 5.184300 1.369954 0.024046
C -0.824987 -4.296002 1.850521
H -1.521825 0.685083 -1.793999
H -1.797605 -0.549887 -0.542660
H -1.043088 2.334979 0.239923
H -1.657831 1.018536 1.263778
H 0.572017 2.112974 -1.160873
H 1.019294 0.963829 -2.445351
H 1.701096 -1.307522 -0.967368
H 0.271723 -1.547250 -2.006656
H -3.308643 2.892102 1.882395
H -4.808211 2.724845 0.934956
H -3.015378 3.925083 -0.630638
H -2.449110 2.711393 -1.805883
H -4.919802 0.276211 1.420187
H -3.408426 0.358805 2.365024
H -4.856746 1.228458 2.943122
H -4.799589 1.945324 -2.228311
H -5.429408 3.155969 -1.076566
H -4.608761 3.700835 -2.563638
H 1.981286 0.935843 1.230160
H 0.360831 -1.057735 1.754379
H 3.312262 1.402340 -2.864508
H -0.366458 -3.791636 -1.523767
H 4.365747 1.120092 2.028833
H -0.413928 -2.810955 3.392163
H 5.686672 1.584397 -2.085973
H -1.140610 -5.543134 0.091112
H 6.222757 1.445171 0.366114
H -1.167377 -5.059832 2.557955


