%chk=000014690.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014690

0 1
 N    2.478600     -0.6560000      -1.139800    
 N   -4.653900      0.8983000     -0.6776000    
 C   0.1011000      0.4464000      0.4026000    
 C    1.214600      -1.205300      -1.626700    
 C  -9.7599998E-02  -1.015600      0.5046000    
 C   0.4465000      -1.836400     -0.4963000    
 C    1.446000       1.094800      0.3120000    
 C    2.545500      0.5328000     -0.4026000    
 C   -1.013900       1.192200      0.2731000    
 C   -2.394400      0.6194000      0.2304000    
 C  -0.7971000      -1.592900       1.573500    
 C   0.2851000      -3.225200     -0.4166000    
 C   -3.317600       1.481100     -0.6301000    
 C    1.631400       2.284700       1.058200    
 C    3.770900       1.244900     -0.3369000    
 C    3.698500      -1.357000      -1.533600    
 C  -0.9559000      -2.977000       1.641200    
 C  -0.4160000      -3.791500      0.6478000    
 C    2.853500       2.947700       1.090500    
 C    3.924700       2.428700      0.3881000    
 C   -5.534200       1.698000      -1.531200    
 C   -5.215800      0.7879000      0.6695000    
 H    1.393700      -1.951900      -2.411300    
 H   0.6141000     -0.4302000      -2.121600    
 H  -0.9410000       2.272200      0.1639000    
 H   -2.744900      0.6017000       1.267600    
 H   -2.427400     -0.3971000     -0.1747000    
 H   -3.349000       2.509000     -0.2427000    
 H   -2.905600       1.532900      -1.646700    
 H   -1.206400     -0.9793000       2.372400    
 H   0.7059000      -3.874100      -1.180300    
 H   0.8188000       2.706200       1.647900    
 H    4.650900      0.8921000     -0.8715000    
 H    3.482900      -2.379000      -1.865400    
 H    4.394700      -1.449400     -0.6924000    
 H    4.191200     -0.8402000      -2.363900    
 H   -1.495500      -3.420800       2.472800    
 H  -0.5379000      -4.869400      0.7044000    
 H    2.965700       3.859800       1.668400    
 H    4.885200       2.935100      0.4028000    
 H   -5.131300       1.760700      -2.548300    
 H   -5.667500       2.716600      -1.149000    
 H   -6.520700       1.228500      -1.615200    
 H   -6.274500      0.5048000      0.6181000    
 H   -5.152600       1.727800       1.229900    
 H   -4.741800     -1.2400000E-02   1.246000    


%chk=000014690-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000014690

0 1
N 2.478359 -0.584072 -1.294903
N -4.810224 0.992521 -0.520780
C 0.050921 0.385653 0.383146
C 1.176368 -1.162442 -1.698787
C -0.031911 -1.108245 0.491416
C 0.513132 -1.905942 -0.553174
C 1.420600 1.012890 0.337936
C 2.553304 0.508307 -0.412104
C -1.071985 1.174642 0.409337
C -2.514975 0.731358 0.514460
C -0.625138 -1.749742 1.607263
C 0.449991 -3.314984 -0.479041
C -3.394274 1.427498 -0.555363
C 1.626210 2.155046 1.162609
C 3.814001 1.171813 -0.260535
C 3.705362 -1.205832 -1.808062
C -0.683272 -3.160041 1.681086
C -0.148180 -3.947272 0.635609
C 2.867425 2.809911 1.282193
C 3.970813 2.299333 0.563777
C -5.533794 1.374082 -1.751140
C -5.530713 1.431705 0.690790
H 1.349396 -1.830197 -2.559571
H 0.513905 -0.343602 -2.044694
H -0.926228 2.261265 0.304378
H -2.901395 0.986164 1.524091
H -2.615885 -0.361919 0.401676
H -3.300674 2.541659 -0.440748
H -2.990126 1.174407 -1.554016
H -1.028893 -1.139164 2.422509
H 0.862998 -3.919871 -1.296138
H 0.781603 2.501393 1.768251
H 4.680287 0.813846 -0.822757
H 3.452783 -2.169373 -2.279788
H 4.426353 -1.411255 -0.992913
H 4.216734 -0.577815 -2.568755
H -1.144346 -3.642026 2.550460
H -0.197706 -5.040641 0.688390
H 2.975837 3.676264 1.942624
H 4.955502 2.774395 0.643815
H -5.015772 0.955928 -2.632643
H -5.619654 2.482525 -1.893826
H -6.556355 0.955845 -1.725764
H -6.566383 1.048481 0.660659
H -5.576972 2.547319 0.794414
H -5.050029 1.023786 1.595912


