%chk=000029701.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029701

0 1
 O   0.2466000      0.8275000      0.2288000    
 O   -1.203000       2.496200     -0.4137000    
 N    2.865200     -5.7200000E-02 -0.3728000    
 N    4.242800      -1.795600      -1.040300    
 N    4.891600     -0.6078000      0.7935000    
 C    1.340500       1.750200      0.1914000    
 C    2.619300       1.030200      0.5783000    
 C   -2.011200      0.2880000     -1.9400001E-02
 C  -0.9884000       1.318800     -9.6000001E-02
 C   -3.338500      0.5991000     -0.3150000    
 C   -1.665200      -1.012200      0.3492000    
 C   -4.319700     -0.3896000     -0.2418000    
 C   -2.646600      -2.000800      0.4222000    
 C   -3.973700      -1.689400      0.1266000    
 C    3.940400     -0.7574000     -0.1910000    
 H    1.428700       2.158500     -0.8222000    
 H    1.148600       2.567700      0.8954000    
 H    2.502900      0.6159000       1.587100    
 H    3.448000       1.747300      0.5734000    
 H   -3.629600       1.605500     -0.6043000    
 H  -0.6453000      -1.300500      0.5878000    
 H   -5.353200     -0.1474000     -0.4719000    
 H   -2.377900      -3.013500      0.7091000    
 H   -4.737700      -2.459300      0.1835000    
 H    3.634900      -2.030400      -1.817500    
 H    5.078300      -2.356700     -0.9157000    
 H    5.699200      -1.220100      0.8371000    
 H    4.824100      0.1096000       1.506600    


%chk=000029701-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000029701

0 1
O 0.370264 0.922030 0.190276
O -1.181953 2.492526 -0.555638
N 3.214180 0.337281 -0.552461
N 4.140572 -1.730065 -1.160800
N 4.412878 -1.043268 1.063298
C 1.443940 1.941706 0.025460
C 2.755790 1.292854 0.465834
C -1.913943 0.227069 -0.006231
C -0.916458 1.327890 -0.160942
C -3.277178 0.520264 -0.269026
C -1.533769 -1.083491 0.383483
C -4.253973 -0.488353 -0.139575
C -2.514788 -2.089828 0.510677
C -3.874714 -1.795150 0.251147
C 3.889453 -0.733073 -0.205185
H 1.491391 2.239019 -1.036051
H 1.185424 2.823460 0.640795
H 2.596479 0.849329 1.479093
H 3.495673 2.116556 0.582880
H -3.544087 1.538099 -0.572489
H -0.478190 -1.296086 0.574330
H -5.305944 -0.259929 -0.342499
H -2.221788 -3.102497 0.808977
H -4.633970 -2.579262 0.350782
H 3.707932 -1.567401 -2.068944
H 5.030988 -2.225634 -1.142069
H 4.540959 -2.015686 1.335571
H 4.395930 -0.341758 1.797709


