%chk=000137496.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000137496

0 1
 O    2.715500     -0.6360000      0.5002000    
 N    1.276600       1.105600      0.1517000    
 C   -1.640000     -0.1878000     -0.2482000    
 C   -1.195300       1.199100      0.2451000    
 C  -0.6172000      -1.299600      3.8400002E-02
 C   8.2400002E-02   1.704400     -0.4143000    
 C   0.7055000      -1.125500     -0.7014000    
 C   -2.984300     -0.5498000      0.3928000    
 C    1.656800     -0.2103000      3.5599999E-02
 H   -1.798700     -0.1346000      -1.333500    
 H   -1.077900       1.192000       1.336300    
 H   -1.995200       1.915600      1.7899999E-02
 H   -1.052200      -2.256200     -0.2789000    
 H  -0.4414000      -1.377600       1.119000    
 H   7.3600002E-02   1.532200      -1.495600    
 H   0.1744000       2.783400     -0.2493000    
 H   0.5602000     -0.7695000      -1.726700    
 H    1.197600      -2.103400     -0.7760000    
 H   -3.349800      -1.510800      1.5699999E-02
 H   -2.898100     -0.6234000       1.482300    
 H   -3.742300      0.2063000      0.1625000    
 H    1.911800       1.724000      0.6471000    


%chk=000137496-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000137496

0 1
O 2.812880 -0.606540 0.509238
N 1.327047 1.122190 0.122992
C -1.667340 -0.191500 -0.241168
C -1.210681 1.207157 0.246645
C -0.634098 -1.315587 0.030752
C 0.091742 1.731206 -0.404592
C 0.736477 -1.154237 -0.686111
C -3.031875 -0.556146 0.389610
C 1.709171 -0.207273 0.020372
H -1.802505 -0.127826 -1.344474
H -1.083357 1.199533 1.348063
H -2.019709 1.931542 0.020134
H -1.079655 -2.273330 -0.303728
H -0.467716 -1.413536 1.122889
H 0.034320 1.590835 -1.504428
H 0.175065 2.819008 -0.229230
H 0.567415 -0.819269 -1.730632
H 1.254901 -2.126196 -0.730396
H -3.408195 -1.521334 0.002578
H -2.943201 -0.646985 1.489553
H -3.793896 0.216632 0.175951
H 1.995211 1.719757 0.616682


