%chk=000018037.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018037

1 1
 N   -3.054200      0.3202000      3.5500001E-02
 N   0.6696000      8.1799999E-02  0.4187000    
 C    1.443800       1.292000      0.2441000    
 C   -1.635600      0.2498000     -0.3952000    
 C  -0.7294000      0.2045000      0.8223000    
 C    1.909600       1.392500      -1.210000    
 C    2.630400       1.289500       1.210900    
 C   -3.991100      0.3671000      -1.179300    
 C   -3.305400       1.576500      0.8807000    
 C   -3.428900     -0.9057000      0.8799000    
 C    2.813500       2.603800      -1.426000    
 C    3.532100       2.502000      0.9929000    
 C    3.993600       2.605100     -0.4582000    
 C    1.234000      -1.178900      0.1963000    
 C   -3.820600     -0.8994000      -1.989400    
 C   -2.943400       2.802400      7.0900001E-02
 C   -4.889200     -0.8171000       1.266100    
 C    1.861600      -1.869200       1.241000    
 C    1.178500      -1.765900      -1.074200    
 C    2.424700      -3.125800       1.018900    
 C    1.741600      -3.022700      -1.296200    
 C    2.364700      -3.702600     -0.2497000    
 H   0.8288000       2.175600      0.4613000    
 H   -1.492400     -0.6832000     -0.9456000    
 H   -1.396700       1.064800      -1.084900    
 H  -0.9420000     -0.6413000       1.480900    
 H  -0.8189000       1.101400       1.441000    
 H    1.047000       1.454300      -1.884200    
 H    2.485600      0.5102000      -1.510300    
 H    3.255800      0.3997000       1.078500    
 H    2.274300       1.277400       2.248200    
 H   -5.021700      0.5620000     -0.8731000    
 H   -3.673700       1.195300      -1.819900    
 H   -4.374100       1.652600       1.096100    
 H   -2.770600       1.509500       1.831500    
 H   -3.167700      -1.825300      0.3499000    
 H   -2.857700     -0.8766000       1.811500    
 H    3.182900       2.610100      -2.457700    
 H    2.229600       3.522500      -1.290700    
 H    2.989300       3.414400       1.269100    
 H    4.404100       2.437700       1.653500    
 H    4.656700       1.762600     -0.6907000    
 H    4.580600       3.520400     -0.5942000    
 H   -4.483700     -0.8315000      -2.861400    
 H   -2.820000      -1.035500      -2.405300    
 H   -4.126800      -1.809300      -1.469300    
 H   -3.138100       3.686400      0.6916000    
 H   -1.884300       2.863200     -0.1901000    
 H   -3.549200       2.945200     -0.8262000    
 H   -5.587100     -0.8719000      0.4285000    
 H   -5.143700      2.8100001E-02   1.908100    
 H   -5.120000      -1.701800       1.874800    
 H    1.907600      -1.438900       2.238500    
 H   0.6950000      -1.254300      -1.902600    
 H    2.907700      -3.656300       1.834200    
 H    1.694200      -3.472300      -2.283700    
 H    2.802400      -4.681400     -0.4224000    


%chk=000018037-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000018037

1 1
N -3.164416 0.222597 0.139860
N 0.643553 0.477817 -0.423932
C 1.730785 1.514095 -0.236864
C -1.762436 0.206161 -0.522724
C -0.595095 0.770538 0.321454
C 2.825522 1.447439 -1.325293
C 2.370556 1.469235 1.178870
C -4.223174 -0.156536 -0.929874
C -3.494318 1.631461 0.697947
C -3.168769 -0.797061 1.312506
C 3.844294 2.600557 -1.141893
C 3.396066 2.613306 1.368211
C 4.481777 2.578455 0.267202
C 1.035618 -0.922902 -0.462841
C -4.110588 -1.579130 -1.491056
C -3.463718 2.772887 -0.326592
C -4.523791 -1.026174 1.992674
C 0.946196 -1.768370 0.677593
C 1.500758 -1.475897 -1.685387
C 1.310784 -3.131470 0.593766
C 1.881265 -2.833504 -1.761946
C 1.783011 -3.669826 -0.624982
H 1.218101 2.493946 -0.354360
H -1.547636 -0.846029 -0.768336
H -1.835103 0.772128 -1.465220
H -0.612770 0.364041 1.358564
H -0.678290 1.868579 0.408783
H 2.358758 1.501456 -2.327301
H 3.359265 0.479616 -1.258809
H 2.878728 0.492835 1.309564
H 1.584841 1.536090 1.959211
H -5.208522 0.005865 -0.461364
H -4.106632 0.580930 -1.740072
H -4.496127 1.554533 1.151325
H -2.767854 1.813433 1.507588
H -2.773216 -1.738429 0.897481
H -2.433237 -0.418287 2.041084
H 4.627998 2.524353 -1.918597
H 3.334760 3.573770 -1.299326
H 2.870706 3.590527 1.332835
H 3.860003 2.539070 2.369829
H 5.088726 1.657195 0.380083
H 5.173156 3.433493 0.385963
H -4.908018 -1.703911 -2.244960
H -3.153624 -1.765244 -2.005199
H -4.264875 -2.360678 -0.728861
H -3.657668 3.714297 0.217374
H -2.485801 2.882902 -0.823370
H -4.247128 2.684303 -1.096825
H -5.283341 -1.448432 1.314547
H -4.933239 -0.120352 2.469396
H -4.369028 -1.765082 2.798930
H 0.624852 -1.361245 1.644190
H 1.547634 -0.834695 -2.570974
H 1.246557 -3.766586 1.484416
H 2.243794 -3.240791 -2.711929
H 2.073449 -4.723583 -0.687465


