%chk=000018271.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018271

0 1
 O  -0.2838000       3.246400      -1.079000    
 N  -0.2339000      0.6857000      0.1313000    
 C   -1.467000      0.3435000     -0.5354000    
 C   -2.338800     -0.5361000      0.3568000    
 C  -0.1792000       1.923700      0.9113000    
 C   -3.639900     -0.9640000     -0.3268000    
 C   0.8936000     -0.1445000      5.5599999E-02
 C   0.4725000       3.036800      0.1064000    
 C   -4.454700      -1.891600      0.5614000    
 C   0.8447000      -1.335500     -0.6767000    
 C    2.077300      0.2112000      0.7108000    
 C    1.966500      -2.161100     -0.7529000    
 C    3.199100     -0.6143000      0.6345000    
 C    3.143600      -1.800500     -9.7300000E-02
 H   -2.033800       1.259300     -0.7518000    
 H   -1.310400     -0.1005000      -1.524700    
 H   -2.575700      1.0000000E-03   1.284300    
 H   -1.783200      -1.433000      0.6569000    
 H   0.3006000       1.785000       1.886300    
 H   -1.206000       2.233100       1.149000    
 H   -3.412800      -1.477700      -1.268100    
 H   -4.237400     -7.9099998E-02 -0.5742000    
 H    1.500900       2.805200     -0.1824000    
 H   0.4737000       3.966400      0.6842000    
 H   -4.721200      -1.399400       1.502100    
 H   -5.380600      -2.183000      5.6000002E-02
 H   -3.894800      -2.802400      0.7961000    
 H  -4.3200001E-02  -1.679000      -1.196100    
 H    2.189100       1.116900       1.296600    
 H    1.923300      -3.086700      -1.319700    
 H    4.116200     -0.3347000       1.145000    
 H    4.016800      -2.443700     -0.1559000    
 H   0.1432000       3.972200      -1.565300    


%chk=000018271-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000018271

0 1
O -0.676451 3.465542 -0.846564
N -0.157893 0.658192 0.169248
C -1.428563 0.309511 -0.499349
C -2.358224 -0.592708 0.350864
C -0.124450 1.917988 0.921353
C -3.671654 -0.939841 -0.386198
C 0.972414 -0.170998 0.089255
C 0.386898 3.126698 0.117171
C -4.622659 -1.809361 0.464298
C 0.911261 -1.456193 -0.542568
C 2.237527 0.230475 0.631384
C 2.050487 -2.280297 -0.625104
C 3.364965 -0.611405 0.548623
C 3.291676 -1.874799 -0.081148
H -1.944887 1.255268 -0.742029
H -1.212297 -0.178734 -1.469447
H -2.594058 -0.072738 1.302055
H -1.825484 -1.523594 0.627952
H 0.489643 1.804357 1.834835
H -1.150311 2.157958 1.257366
H -3.432864 -1.468920 -1.331953
H -4.187535 -0.001930 -0.677871
H 1.331814 2.867909 -0.401664
H 0.570989 3.979877 0.806638
H -4.909454 -1.286616 1.396165
H -5.550151 -2.053185 -0.085915
H -4.138263 -2.761786 0.750732
H -0.031525 -1.821490 -0.959536
H 2.352192 1.206635 1.112139
H 1.961658 -3.257603 -1.114918
H 4.314672 -0.267657 0.976298
H 4.171938 -2.522402 -0.146018
H -0.326712 4.091448 -1.527793


