%chk=000020118.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020118

0 1
 O    2.385200      -1.948700       1.040700    
 N  -0.1212000      -1.083100     -8.2099997E-02
 C    1.069600     -0.2457000     -8.8200003E-02
 C    2.340100      -1.104400     -0.1088000    
 C   -1.329700     -0.2673000     -3.3799998E-02
 C   -2.593100      -1.137600     -3.7599999E-02
 C    3.587600     -0.2481000     -0.1155000    
 C   -3.844200     -0.3259000     -1.4700000E-02
 C    4.131400      0.1443000      -1.326600    
 C    4.158100      0.1250000       1.089300    
 C   -5.003600     -0.8145000     -0.6170000    
 C   -3.855000      0.9216000      0.6092000    
 C    5.281300      0.9339000      -1.333000    
 C    5.307900      0.9147000       1.082800    
 C   -6.173800     -5.5599999E-02 -0.5954000    
 C   -5.025200       1.680400      0.6308000    
 C    5.869400       1.319100     -0.1284000    
 C   -6.184600       1.191800      2.8400000E-02
 H    1.060700      0.4170000     -0.9624000    
 H    1.074100      0.3849000      0.8107000    
 H    2.349500      -1.761700     -0.9878000    
 H   -1.274100      0.3291000      0.8825000    
 H   -1.353100      0.4182000     -0.8905000    
 H   -2.592400      -1.805200      0.8333000    
 H   -2.579800      -1.771200     -0.9342000    
 H  -0.1052000      -1.707400      0.7233000    
 H    3.678900     -0.1492000      -2.269200    
 H    3.732200     -0.1635000       2.045600    
 H   -5.009200      -1.785800      -1.104600    
 H   -2.993800       1.342200       1.114500    
 H    1.687700      -2.618200      0.9407000    
 H    5.718100       1.249600      -2.275900    
 H    5.764100       1.218000       2.020600    
 H   -7.076800     -0.4363000      -1.063600    
 H   -5.036200       2.649500       1.121400    
 H    6.764000       1.934900     -0.1333000    
 H   -7.096200       1.782000      4.6500001E-02


%chk=000020118-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000020118

0 1
O 1.664561 -1.882239 0.290588
N -0.023937 -0.171119 1.441050
C 1.249372 0.420427 0.961982
C 1.838077 -0.505905 -0.158074
C -1.228416 0.140328 0.633447
C -2.476131 -0.573496 1.210189
C 3.304250 -0.192402 -0.413355
C -3.729624 -0.261924 0.405422
C 3.661549 0.930986 -1.201312
C 4.325354 -0.986938 0.161494
C -4.089267 -1.057307 -0.713211
C -4.540997 0.855836 0.729304
C 5.020063 1.265545 -1.399642
C 5.684336 -0.655625 -0.040593
C -5.228309 -0.744155 -1.488856
C -5.681242 1.173287 -0.042919
C 6.036982 0.473243 -0.816968
C -6.028287 0.373857 -1.156525
H 1.138831 1.459290 0.581143
H 1.963699 0.433848 1.804997
H 1.262711 -0.339691 -1.097253
H -1.421830 1.237299 0.577398
H -1.057252 -0.208291 -0.401992
H -2.613721 -0.253094 2.262979
H -2.276237 -1.661029 1.224174
H -0.184511 -0.005869 2.442578
H 2.878063 1.539982 -1.671348
H 4.031530 -1.867967 0.739905
H -3.477022 -1.930193 -0.973095
H -4.281929 1.476988 1.596394
H 0.853514 -1.819302 0.892653
H 5.285303 2.134837 -2.012429
H 6.468799 -1.281063 0.401309
H -5.493949 -1.372533 -2.346583
H -6.299374 2.037906 0.224642
H 7.091403 0.727501 -0.974707
H -6.913664 0.615780 -1.755086


