%chk=000031752.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031752

0 1
 N   -2.236200       1.401600     -0.9851000    
 N    2.118400      -1.298300      -1.645800    
 C   -1.160200      0.8707000      -1.808900    
 C   0.5423000     -0.7147000      0.1379000    
 C  -0.7398000      -1.346100     -0.5056000    
 C   0.6047000      0.8451000      4.1700002E-02
 C   -1.179800     -0.6605000      -1.822000    
 C   0.2007000       1.394300      -1.339200    
 C   -2.244600       2.863900     -0.9520000    
 C   -3.558600       1.025500      -1.483700    
 C   -1.936100      -1.541700      0.4324000    
 C    1.899200       1.421100      0.6078000    
 C   -3.623000       3.184600     -0.3928000    
 C   -4.485700       1.974900     -0.7392000    
 C    1.818500      -1.422100     -0.3373000    
 C   -2.264300     -0.5469000       1.347600    
 C    2.058900       1.527100       1.983700    
 C   -2.684400      -2.712000      0.3610000    
 C    2.903700       1.832600     -0.2590000    
 C    2.573300      -2.129700      0.5783000    
 C   -3.353100     -0.7246000       2.201200    
 C    3.242400       2.053300       2.501400    
 C   -3.773300      -2.889500       1.214600    
 C    4.087400       2.358800      0.2587000    
 C    3.723900      -2.758800      0.1160000    
 C    3.244000      -1.923100      -2.058600    
 C   -4.107600      -1.895800       2.134600    
 C    4.256600       2.469100       1.638800    
 C    4.072800      -2.658500      -1.226300    
 H   -1.296900       1.210100      -2.845900    
 H   0.4877000     -0.9380000       1.214500    
 H  -0.4580000      -2.372500     -0.7895000    
 H  -0.1527000       1.254200      0.7158000    
 H  -0.4652000     -0.9728000      -2.597500    
 H   -2.138700      -1.060500      -2.172200    
 H   0.2517000       2.489200      -1.355000    
 H   0.9323000       1.074800      -2.092400    
 H   -2.142000       3.299800      -1.954000    
 H   -1.475400       3.286400     -0.2984000    
 H   -3.836500     -1.0200000E-02  -1.271700    
 H   -3.651100       1.196300      -2.564200    
 H   -4.026400       4.106700     -0.8234000    
 H   -3.583200       3.310500      0.6956000    
 H   -4.862100       1.512900      0.1810000    
 H   -5.348900       2.255200      -1.351200    
 H   -1.708800      0.3696000       1.460000    
 H    1.276400       1.204600       2.665000    
 H   -2.437800      -3.492900     -0.3530000    
 H    2.817000       1.751000      -1.336700    
 H    2.297600      -2.204700       1.624300    
 H   -3.612000      4.7400001E-02   2.920000    
 H    3.374600       2.138400       3.576000    
 H   -4.361400      -3.801100       1.162300    
 H    4.878900       2.679400     -0.4124000    
 H    4.347700      -3.325700      0.8003000    
 H    3.471900      -1.813500      -3.113700    
 H   -4.955200      -2.034200       2.799500    
 H    5.178600       2.877700       2.041900    
 H    4.965400      -3.140100      -1.608900    


%chk=000031752-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000031752

0 1
N -2.206348 1.632929 -1.144371
N 1.668085 -1.745153 -1.971415
C -1.138364 0.872437 -1.860574
C 0.479455 -0.918035 0.060292
C -0.865605 -1.460886 -0.557408
C 0.472931 0.661943 0.101764
C -1.323232 -0.672248 -1.828447
C 0.269697 1.225043 -1.321337
C -2.027242 3.117772 -1.184110
C -3.582837 1.401447 -1.669258
C -1.910952 -1.653547 0.549788
C 1.686018 1.216078 0.844938
C -3.433410 3.714304 -0.881329
C -4.414464 2.504305 -0.982726
C 1.721570 -1.484221 -0.623741
C -2.707374 -0.596975 1.067510
C 1.677796 1.234916 2.265810
C -2.056681 -2.945132 1.125649
C 2.841301 1.696579 0.177263
C 2.898596 -1.744475 0.128866
C -3.614094 -0.830770 2.126623
C 2.786536 1.712475 2.998088
C -2.963615 -3.180973 2.183029
C 3.952886 2.180592 0.904686
C 4.035986 -2.278536 -0.511586
C 2.775339 -2.260746 -2.580100
C -3.748009 -2.119831 2.691769
C 3.932780 2.188772 2.317893
C 3.979074 -2.545232 -1.899222
H -1.168733 1.172076 -2.943628
H 0.521590 -1.259653 1.113313
H -0.632441 -2.477750 -0.931027
H -0.425670 0.933020 0.691942
H -0.693528 -1.054006 -2.652051
H -2.367898 -0.944913 -2.065370
H 0.425954 2.318624 -1.326610
H 1.009090 0.789727 -2.019720
H -1.677791 3.447838 -2.195175
H -1.269246 3.439056 -0.449106
H -3.939608 0.389445 -1.414826
H -3.618070 1.510819 -2.783408
H -3.684632 4.502056 -1.613142
H -3.472237 4.172521 0.121643
H -4.713244 2.166431 0.025544
H -5.332680 2.743181 -1.546983
H -2.613819 0.403703 0.621263
H 0.786326 0.878429 2.798670
H -1.454184 -3.775928 0.735350
H 2.877201 1.692885 -0.917705
H 2.912960 -1.522326 1.200554
H -4.219854 -0.001228 2.511837
H 2.755230 1.721611 4.093850
H -3.061001 -4.188039 2.605411
H 4.834830 2.549548 0.368133
H 4.947657 -2.483040 0.060039
H 2.680870 -2.453665 -3.655651
H -4.454592 -2.297359 3.510818
H 4.793730 2.565328 2.881856
H 4.835565 -2.962919 -2.437864


