%chk=000078499.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078499

0 1
 N    5.065500      0.5623000     -1.8400000E-02
 N    9.740000     -0.7009000      5.6400001E-02
 C   -2.494600      0.3768000     -5.1600002E-02
 C   -1.187000     -0.4201000     -6.9200002E-02
 C   -3.745500     -0.5059000     -3.0099999E-02
 C   6.3100003E-02  0.4610000     -1.6300000E-02
 C   -5.016900      0.3426000      5.9200000E-02
 C    1.339000     -0.3838000     -6.8599999E-02
 C   -6.303900     -0.4875000      6.1900001E-02
 C    2.590100      0.4998000     -4.4199999E-02
 C   -7.576200      0.3627000      7.6700002E-02
 C    3.892100     -0.3028000     -2.3900000E-02
 C   -8.827800     -0.5135000      5.5000000E-03
 C   -10.09510      0.3259000     -1.8600000E-02
 C    6.290900     -0.2239000      1.1500000E-02
 C    7.510600      0.6939000      2.6400000E-02
 C    8.755700     -8.6599998E-02  4.3299999E-02
 H   -2.527500       1.033900     -0.9294000    
 H   -2.499900       1.028200      0.8314000    
 H   -1.159800      -1.038200     -0.9752000    
 H   -1.175700      -1.109400      0.7843000    
 H   -3.774100      -1.123500     -0.9355000    
 H   -3.701600      -1.188200      0.8271000    
 H   5.0799999E-02   1.162000     -0.8596000    
 H   5.1899999E-02   1.059100      0.9028000    
 H   -5.043200       1.038300     -0.7888000    
 H   -4.984400      0.9542000      0.9693000    
 H    1.343100     -0.9964000     -0.9781000    
 H    1.358600      -1.071200      0.7857000    
 H   -6.311900      -1.130200     -0.8274000    
 H   -6.300800      -1.153700      0.9335000    
 H    2.579800       1.158000     -0.9226000    
 H    2.555300       1.150400      0.8392000    
 H   -7.563500       1.053400     -0.7752000    
 H   -7.599900      0.9726000      0.9876000    
 H    3.916200     -0.9615000     -0.9008000    
 H    3.896500     -0.9401000      0.8689000    
 H   -8.795500      -1.137900     -0.8950000    
 H   -8.858300      -1.189100      0.8682000    
 H    5.056600       1.160100     -0.8443000    
 H   -10.17480      0.9416000      0.8831000    
 H   -10.11040      0.9885000     -0.8899000    
 H   -10.97700     -0.3204000     -6.7900002E-02
 H    6.339900     -0.8846000     -0.8640000    
 H    6.307600     -0.8618000      0.9046000    
 H    7.504700       1.343900     -0.8569000    
 H    7.478800       1.347300      0.9067000    


%chk=000078499-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000078499

0 1
N 5.149730 0.458496 -0.098995
N 9.988502 -0.385757 0.163353
C -2.498238 0.384103 -0.017272
C -1.202572 -0.458004 -0.036686
C -3.785613 -0.470702 -0.013982
C 0.082779 0.399757 -0.043100
C -5.080072 0.373211 0.006455
C 1.379424 -0.440794 -0.060770
C -6.368801 -0.479902 0.008040
C 2.659477 0.424403 -0.067354
C -7.662685 0.364967 0.029140
C 3.951766 -0.414516 -0.083113
C -8.952099 -0.487939 0.028542
C -10.239029 0.365153 0.049818
C 6.440800 -0.252305 -0.101752
C 7.587418 0.770346 0.127945
C 8.917286 0.140111 0.146625
H -2.509519 1.059120 -0.898772
H -2.493673 1.042255 0.876891
H -1.207844 -1.117829 -0.929631
H -1.190039 -1.130993 0.846215
H -3.791246 -1.128354 -0.908559
H -3.774904 -1.146110 0.867169
H 0.069562 1.071651 -0.926939
H 0.086931 1.060434 0.848866
H -5.090181 1.049638 -0.873994
H -5.074947 1.030109 0.901578
H 1.373960 -1.102795 -0.951922
H 1.392506 -1.110382 0.824467
H -6.374664 -1.136295 -0.887545
H -6.359080 -1.156722 0.888194
H 2.642931 1.090425 -0.956972
H 2.677506 1.085056 0.821061
H -7.673147 1.042853 -0.850241
H -7.659088 1.020436 0.925385
H 3.921980 -1.120908 -0.951174
H 3.997853 -1.037702 0.832136
H -8.954757 -1.142299 -0.867250
H -8.940771 -1.165073 0.907139
H 5.093275 1.147229 -0.863974
H -10.274348 1.005636 0.951482
H -10.288154 1.029263 -0.833920
H -11.146210 -0.266952 0.048480
H 6.642699 -0.828701 -1.037192
H 6.437048 -0.981388 0.729494
H 7.571651 1.538747 -0.670175
H 7.408101 1.294321 1.084610


