%chk=000015130.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000015130

0 1
 O    1.262200      -1.546200     -0.6022000    
 O    1.064700      -3.293000      -2.101100    
 N    2.493900      0.7223000       1.087200    
 C  -0.5010000      3.3700000E-02  0.1856000    
 C   0.1705000     -5.7999999E-03   1.623300    
 C  -0.1556000      -1.373000     -0.4962000    
 C    1.686200     -0.3184000       1.726900    
 C   0.1677000       1.213500     -0.5882000    
 C   -2.055100      0.1493000      0.2241000    
 C  -0.7580000      -2.628500      0.1740000    
 C    2.109100     -0.4181000       3.195700    
 C  -4.5299999E-02   2.473100     -0.1179000    
 C   -2.715700      0.1612000     -0.9675000    
 C   0.9188000      0.9025000      -1.680100    
 C   -2.650900      0.2304000       1.446700    
 C   -2.283900      -2.598800      0.1756000    
 C    3.914200      0.3859000       1.168100    
 C    2.238100       2.019900       1.709500    
 C   0.5522000       3.527300     -0.8089000    
 C   -4.106300      0.2644000     -0.9331000    
 C    1.516300       1.956700      -2.371100    
 C   -4.041600      0.3334000       1.481000    
 C    1.666600      -2.690400      -1.222700    
 C    1.333000       3.269100      -1.935300    
 C   -4.769200      0.3504000      0.2910000    
 C    2.989100      -3.121000     -0.6646000    
 H  -9.1100000E-02  0.8864000       2.201700    
 H  -0.3112000     -0.8141000       2.192100    
 H  -0.5483000      -1.364300      -1.523300    
 H    1.913900      -1.310000       1.346200    
 H  -0.3769000      -2.758500       1.192600    
 H  -0.4659000      -3.546400     -0.3439000    
 H    3.145200     -0.7396000       3.335900    
 H    1.938100      0.4968000       3.771200    
 H    1.503500      -1.190800       3.687800    
 H  -0.6731000       2.689600      0.7396000    
 H   -2.215600      0.1090000      -1.928000    
 H    1.046100     -5.7599999E-02  -2.150800    
 H   -2.143400      0.2306000       2.400800    
 H   -2.716600      -2.134400       1.054900    
 H   -2.611400      -3.643400      0.2893000    
 H   -2.720700      -2.302300     -0.7772000    
 H    4.357700      0.5102000       2.161500    
 H    4.106300     -0.6348000      0.8217000    
 H    4.473000       1.044400      0.4922000    
 H    2.620900       2.806600       1.048700    
 H    1.217700       2.287000       1.966400    
 H    2.804100       2.141000       2.643100    
 H   0.4038000       4.549600     -0.4736000    
 H   -4.672800      0.2806000      -1.859700    
 H    2.107900       1.759500      -3.260500    
 H   -4.558700      0.4021000       2.433700    
 H    1.793500       4.090300      -2.476600    
 H   -5.851900      0.4316000      0.3177000    
 H    3.299200      -4.050800      -1.150600    
 H    3.743100      -2.357200     -0.8680000    
 H    2.901500      -3.307400      0.4083000    


%chk=000015130-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000015130

0 1
O 0.958781 -1.971172 -0.317750
O 0.484405 -2.958771 -2.386492
N 2.282578 1.478833 2.282591
C -0.456368 0.025114 0.195358
C 0.181646 0.307163 1.600352
C -0.464845 -1.515124 -0.142038
C 1.732685 0.191448 1.734448
C 0.256936 0.846214 -0.919766
C -1.969918 0.443828 0.204945
C -1.115421 -2.426909 0.916634
C 2.164701 -1.061939 2.545085
C 0.786232 2.133001 -0.628698
C -2.704670 0.463821 -1.011821
C 0.332763 0.395926 -2.265902
C -2.667477 0.773794 1.396780
C -1.306914 -3.879295 0.430551
C 3.706469 1.691756 1.961022
C 1.994535 1.725135 3.710263
C 1.354135 2.938110 -1.640023
C -4.075666 0.794631 -1.038867
C 0.904939 1.197817 -3.278763
C -4.039917 1.113471 1.373764
C 1.297229 -2.679578 -1.474624
C 1.414981 2.479032 -2.975180
C -4.754764 1.122800 0.156713
C 2.772632 -3.015267 -1.469932
H -0.084669 1.341804 1.880006
H -0.306314 -0.348187 2.344882
H -0.977910 -1.680873 -1.107426
H 2.162052 0.099542 0.720871
H -2.097635 -1.992467 1.180101
H -0.502083 -2.424632 1.836365
H 3.262557 -1.090562 2.681100
H 1.696374 -1.078019 3.547297
H 1.868077 -1.977638 2.006716
H 0.795292 2.503904 0.400860
H -2.198206 0.246008 -1.957335
H -0.044864 -0.590930 -2.551835
H -2.150257 0.773516 2.359902
H -1.910920 -3.916931 -0.493968
H -1.821408 -4.480400 1.201955
H -0.338522 -4.365835 0.216698
H 4.404822 0.983232 2.474536
H 3.855540 1.593075 0.870830
H 4.000850 2.716782 2.254288
H 2.249807 2.772289 3.958198
H 0.917732 1.585573 3.912573
H 2.563307 1.064194 4.409927
H 1.752116 3.925886 -1.379825
H -4.610704 0.803658 -1.995283
H 0.946886 0.815964 -4.305372
H -4.548247 1.369001 2.310771
H 1.854006 3.104709 -3.760529
H -5.818366 1.385322 0.138372
H 2.975612 -3.809717 -2.203097
H 3.349513 -2.115369 -1.752243
H 3.103771 -3.323141 -0.464985


