%chk=000026428.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026428

0 1
 O  -0.7794000      0.1049000      0.1642000    
 O   0.2941000      -1.870200     -0.3700000    
 N    4.886200      0.9894000      0.1676000    
 C   -3.162700      0.4725000      0.3460000    
 C   -2.045300     -0.5324000      5.2600000E-02
 C   -3.141300       1.635700     -0.6479000    
 C   -4.522900     -0.2213000      0.3219000    
 C   0.3070000     -0.6858000     -7.4500002E-02
 C    1.520900      0.1446000      8.6700000E-02
 C    2.728400     -0.4029000     -9.6400000E-02
 C    3.915000      0.3654000      4.9699999E-02
 H   -2.999200      0.8933000       1.346400    
 H   -2.093500      -1.358100      0.7730000    
 H   -2.159500     -0.9420000     -0.9588000    
 H   -3.945900       2.346200     -0.4302000    
 H   -3.272300       1.281300      -1.676000    
 H   -2.194800       2.183500     -0.5962000    
 H   -5.324400      0.4853000      0.5617000    
 H   -4.560000      -1.030200       1.059100    
 H   -4.733600     -0.6506000     -0.6636000    
 H    1.399400       1.190100      0.3523000    
 H    2.841900      -1.448800     -0.3620000    


%chk=000026428-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000026428

0 1
O -0.783040 0.142596 0.192585
O 0.308551 -1.833189 -0.426569
N 5.084694 0.891734 0.194631
C -3.202998 0.480785 0.339414
C -2.103492 -0.547218 0.045926
C -3.183509 1.639953 -0.682440
C -4.572853 -0.240429 0.351406
C 0.344742 -0.627591 -0.074298
C 1.572509 0.187906 0.120492
C 2.799437 -0.373089 -0.092475
C 4.034490 0.330948 0.068223
H -3.013334 0.895553 1.349725
H -2.123369 -1.396972 0.753339
H -2.172433 -0.947457 -0.983579
H -3.954680 2.391523 -0.434487
H -3.391924 1.265591 -1.703477
H -2.201890 2.144363 -0.694690
H -5.381614 0.475724 0.581416
H -4.607535 -1.045487 1.108992
H -4.793799 -0.688977 -0.636093
H 1.447949 1.228539 0.433613
H 2.852196 -1.424906 -0.406056


