%chk=000028197.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028197

0 1
 N    5.653000      0.1938000     -0.1716000    
 N  -0.4554000     -0.4257000     -0.4736000    
 N   0.1194000     -0.1490000      0.6077000    
 C   -4.023900      0.5212000     -0.3535000    
 C   -4.611300     -0.7030000     -3.4200002E-02
 C   -4.856700       1.746400     -0.5431000    
 C   -2.639800      0.6138000     -0.4998000    
 C   -1.843000     -0.5179000     -0.3268000    
 C   -3.814400      -1.834700      0.1387000    
 C   -2.430300      -1.742200     -7.6000001E-03
 C   -6.090800     -0.8263000      0.1278000    
 C   -5.053900       2.518800      0.7578000    
 C    4.258900      0.1072000      2.4700001E-02
 C    1.508200     -6.3199997E-02  0.4121000    
 C    3.462100       1.242600     -0.1226000    
 C    3.677000      -1.113500      0.3662000    
 C    2.083600       1.157200      7.1599998E-02
 C    2.298300      -1.198900      0.5604000    
 C    6.359000       1.427000      0.1131000    
 C    6.399700     -0.9537000     -0.6475000    
 H   -4.373200       2.407000      -1.274900    
 H   -5.829600       1.508600     -0.9867000    
 H   -2.176900       1.566600     -0.7471000    
 H   -4.255400      -2.796500      0.3868000    
 H   -1.817700      -2.629700      0.1282000    
 H   -6.599400     -0.6500000     -0.8255000    
 H   -6.374700      -1.831400      0.4604000    
 H   -6.468800     -0.1302000      0.8818000    
 H   -5.556400       1.914200       1.518900    
 H   -5.662900       3.410300      0.5771000    
 H   -4.093600       2.844900       1.171900    
 H    3.881700       2.205600     -0.3993000    
 H    4.269600      -2.013900      0.5009000    
 H    1.469500       2.046000     -4.6999998E-02
 H    1.853200      -2.153000      0.8296000    
 H    6.234500       2.143500     -0.7056000    
 H    7.433600       1.248900      0.2336000    
 H    6.009300       1.883300       1.046100    
 H    7.368400     -0.6508000      -1.060600    
 H    5.865800      -1.475900      -1.449500    
 H    6.595500      -1.655600      0.1699000    


%chk=000028197-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000028197

0 1
N 5.804573 0.210667 -0.124698
N -0.517709 -0.883051 -0.001513
N 0.122363 0.257777 -0.140711
C -4.075587 0.468707 -0.190053
C -4.799127 -0.760220 -0.035862
C -4.798649 1.804394 -0.321392
C -2.665955 0.448956 -0.183490
C -1.943713 -0.765738 -0.019968
C -4.069215 -1.966048 0.124266
C -2.660671 -1.979344 0.134446
C -6.317803 -0.797360 -0.060819
C -5.095978 2.454855 1.057869
C 4.409547 0.196514 -0.125146
C 1.537960 0.156324 -0.125576
C 3.654015 1.406504 -0.273410
C 3.680823 -1.034730 0.023183
C 2.252697 1.376658 -0.272409
C 2.282756 -1.052173 0.022575
C 6.527934 1.482374 -0.261849
C 6.559723 -1.042931 0.012642
H -4.175182 2.500821 -0.913264
H -5.748793 1.681399 -0.874687
H -2.094486 1.375390 -0.306962
H -4.618454 -2.908227 0.239939
H -2.094917 -2.908851 0.256819
H -6.716547 -0.475893 -1.042789
H -6.689884 -1.818155 0.131617
H -6.762381 -0.127290 0.698632
H -5.726790 1.798941 1.685198
H -5.621757 3.419756 0.934750
H -4.157175 2.640429 1.609933
H 4.163517 2.366432 -0.391055
H 4.220816 -1.978639 0.140602
H 1.673471 2.299467 -0.386266
H 1.731343 -1.990967 0.136227
H 6.306629 1.979357 -1.228071
H 7.611938 1.294409 -0.217283
H 6.270400 2.188810 0.552689
H 7.638364 -0.826795 -0.035215
H 6.319229 -1.756796 -0.800346
H 6.354875 -1.543934 0.980249


