%chk=000013241.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013241

0 1
 O  -0.8957000     -0.4172000      0.5071000    
 N   -2.235400     -0.5823000      0.1438000    
 N   -4.258400      0.4161000     -0.4905000    
 N   -2.578000       1.765700      0.3729000    
 C    1.303100     -9.4899997E-02 -0.3558000    
 C  -0.1465000     -0.2753000     -0.6984000    
 C    1.809200       1.184800     -0.1561000    
 C    2.127400      -1.208800     -0.2405000    
 C    3.156700       1.352600      0.1627000    
 C    3.474900      -1.040800      7.8299999E-02
 C    3.989500      0.2400000      0.2799000    
 C   -2.752700      -1.915800      0.3713000    
 C   -2.993900      0.5759000      2.5500000E-02
 H  -0.5006000      0.5877000      -1.277000    
 H  -0.2750000      -1.166600      -1.326900    
 H    1.168700       2.058300     -0.2425000    
 H    1.736500      -2.211100     -0.3931000    
 H    3.557300       2.349700      0.3203000    
 H    4.123400      -1.907200      0.1704000    
 H    5.038600      0.3707000      0.5285000    
 H   -1.938200      -2.641400      0.4711000    
 H   -3.376700      -2.242100     -0.4660000    
 H   -3.346500      -1.943400       1.290100    
 H   -4.604700     -0.4839000     -0.8018000    
 H   -4.880600       1.208700     -0.6074000    
 H   -3.325900       2.442500      0.1858000    


%chk=000013241-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000013241

0 1
O -0.915103 -0.775899 0.255142
N -2.322260 -0.727569 -0.153296
N -4.243489 0.661424 -0.080551
N -2.033959 1.602202 -0.460485
C 1.337475 -0.309086 -0.468475
C -0.034062 -0.699410 -0.963648
C 1.509027 0.958735 0.147678
C 2.452007 -1.169593 -0.614374
C 2.782494 1.355679 0.607586
C 3.730326 -0.768039 -0.160234
C 3.896992 0.495020 0.452395
C -3.050864 -1.840794 0.470169
C -2.845418 0.593165 -0.212273
H -0.461567 0.080593 -1.616084
H -0.035663 -1.681804 -1.474707
H 0.629302 1.603639 0.255811
H 2.321420 -2.153596 -1.082230
H 2.911165 2.334479 1.084078
H 4.589737 -1.437717 -0.279789
H 4.886419 0.806286 0.807321
H -2.428238 -2.741977 0.366119
H -3.996276 -2.025612 -0.072487
H -3.259732 -1.687224 1.550767
H -4.805748 -0.099737 0.290071
H -4.711001 1.535246 -0.304821
H -2.526483 2.513488 -0.491982


