%chk=000040761.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040761

0 1
 N    8.210200      0.3291000     -0.1156000    
 C  -0.6550000     -0.4336000     -2.2900000E-02
 C   0.6436000      0.3774000      4.5600001E-02
 C   -1.914600      0.4348000      2.3100000E-02
 C    1.939900     -0.4390000      5.9700001E-02
 C   -3.211900     -0.3764000     -5.2900001E-02
 C    3.204600      0.4235000      4.3800000E-02
 C   -4.471600      0.4926000     -3.1199999E-02
 C    4.465200     -0.4439000      9.0999998E-02
 C   -5.737700     -0.3671000     -3.4899998E-02
 C    5.763600      0.3649000      5.7000001E-03
 C   -6.997000      0.4973000      2.5500000E-02
 C    7.018200     -0.5076000     -2.4900001E-02
 C   -8.257500     -0.3519000     -1.1900000E-02
 H  -0.6768000      -1.143600      0.8128000    
 H  -0.6567000      -1.028500     -0.9443000    
 H   0.6694000       1.063300     -0.8108000    
 H   0.6197000       1.006900      0.9442000    
 H   -1.888900       1.149300     -0.8089000    
 H   -1.912900       1.024900      0.9478000    
 H    1.945200      -1.079900      0.9499000    
 H    1.948200      -1.106700     -0.8107000    
 H   -3.206400     -0.9805000     -0.9687000    
 H   -3.240300      -1.078600      0.7896000    
 H    3.214500       1.040200     -0.8629000    
 H    3.197600       1.107100      0.9010000    
 H   -4.461500       1.126300      0.8638000    
 H   -4.472400       1.160300     -0.9011000    
 H    4.468200      -1.032700       1.016700    
 H    4.439100      -1.160200     -0.7398000    
 H   -5.757200     -0.9853000     -0.9407000    
 H   -5.722500      -1.050800      0.8226000    
 H    5.734600      0.9889000     -0.8970000    
 H    5.810500       1.050300      0.8618000    
 H   -7.010200       1.195700     -0.8193000    
 H   -6.993100       1.097400      0.9428000    
 H    6.986500      -1.181300     -0.8876000    
 H    7.072000      -1.123400      0.8793000    
 H   -8.291000      -1.041700      0.8376000    
 H   -8.307800     -0.9394000     -0.9342000    
 H   -9.145700      0.2860000      3.3300001E-02
 H    8.263100      0.9404000      0.6982000    
 H    9.040100     -0.2615000     -8.3600000E-02


%chk=000040761-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000040761

0 1
N 8.307714 0.352290 0.021311
C -0.640226 -0.421921 0.003427
C 0.661056 0.411585 0.015153
C -1.921619 0.441916 0.010388
C 1.942747 -0.451816 0.007794
C -3.222996 -0.391562 -0.002166
C 3.243335 0.382792 0.018291
C -4.504694 0.472135 0.004284
C 4.525352 -0.480431 0.012000
C -5.806023 -0.361539 -0.008508
C 5.822059 0.359244 0.016981
C -7.087919 0.502697 -0.001111
C 7.101289 -0.501936 0.017571
C -8.382694 -0.338740 -0.014853
H -0.649782 -1.098357 0.883863
H -0.646298 -1.078607 -0.891837
H 0.670418 1.088010 -0.865221
H 0.667052 1.068376 0.910395
H -1.911779 1.118523 -0.869869
H -1.915917 1.098439 0.905796
H 1.934034 -1.127873 0.888570
H 1.936467 -1.108791 -0.887238
H -3.228569 -1.048166 -0.897495
H -3.232973 -1.068116 0.878152
H 3.252894 1.058182 -0.862498
H 3.249165 1.040204 0.913058
H -4.499360 1.128750 0.899658
H -4.494755 1.148599 -0.876117
H 4.515776 -1.154887 0.894193
H 4.517866 -1.138553 -0.882190
H -5.813245 -1.017576 -0.904281
H -5.817208 -1.038603 0.871436
H 5.852132 1.025877 -0.866531
H 5.826071 1.019144 0.911407
H -7.075337 1.179283 -0.880078
H -7.079779 1.157383 0.894366
H 7.120433 -1.115890 -0.904095
H 7.048798 -1.216497 0.877537
H -8.432824 -1.002076 0.869394
H -8.428735 -0.979161 -0.916054
H -9.284146 0.301549 -0.008723
H 8.360102 0.982225 0.828977
H 9.187419 -0.153103 -0.123238


