%chk=000110772.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000110772

0 1
 O  -0.2899000       1.039100       1.686700    
 O    5.820500      0.9118000     -0.6970000    
 N   -2.517200     -0.1533000      1.5300000E-02
 N   0.5815000     -0.7220000      0.3322000    
 C   -1.677800     -0.8117000       1.016000    
 C   -1.217200      -2.193200      0.5763000    
 C   -2.788400       1.237200      0.4062000    
 C   -3.765800     -0.9029000     -0.1818000    
 C   -3.624600       1.955500     -0.6541000    
 C   -4.634100     -0.2546000      -1.261200    
 C   1.5200000E-02  -1.918500     -0.2619000    
 C   -4.922000       1.207100     -0.9376000    
 C  -0.3814000     -2.7899999E-02   1.095400    
 C    1.920200     -0.3044000      6.9799997E-02
 C    2.395400      0.9034000      0.5889000    
 C    2.765000      -1.100300     -0.7094000    
 C    3.703900       1.312000      0.3309000    
 C    4.073600     -0.6918000     -0.9674000    
 C    4.543100      0.5143000     -0.4472000    
 H   -2.154100     -0.8533000       2.002800    
 H   -1.932300      -2.834400      6.0800001E-02
 H  -0.9117000      -2.750100       1.473600    
 H   -1.885800       1.846700      0.4605000    
 H   -3.295000       1.286700       1.378700    
 H   -4.333000     -0.9674000      0.7563000    
 H   -3.586400      -1.924900     -0.5229000    
 H   -3.045700       2.045300      -1.582500    
 H   -3.852900       2.974300     -0.3202000    
 H   -5.578100     -0.8031000      -1.356900    
 H   -4.125500     -0.3209000      -2.231500    
 H   0.6961000      -2.771800     -0.2005000    
 H  -0.2417000      -1.706800      -1.305500    
 H   -5.577500       1.265500     -5.9999999E-02
 H   -5.454900       1.679100      -1.770300    
 H    1.800900       1.570400       1.198100    
 H    2.444300      -2.040200      -1.146300    
 H    4.058700       2.253600      0.7417000    
 H    4.722400      -1.315900      -1.576000    
 H    5.975400       1.767300     -0.2606000    


%chk=000110772-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000110772

0 1
O -0.183843 0.871793 1.992339
O 5.863681 1.020794 -0.764661
N -2.586294 -0.234661 0.036792
N 0.589117 -0.724086 0.402113
C -1.701538 -0.888965 1.054860
C -1.214279 -2.268149 0.548935
C -2.690341 1.249730 0.168486
C -3.947165 -0.844766 0.060564
C -3.514009 1.838140 -0.995014
C -4.813475 -0.325752 -1.104502
C 0.042804 -1.925821 -0.282770
C -4.925487 1.214239 -1.055839
C -0.367376 -0.122506 1.230950
C 1.912163 -0.254170 0.140171
C 2.500534 0.794059 0.901571
C 2.670307 -0.842969 -0.911356
C 3.808996 1.230188 0.614421
C 3.977566 -0.406934 -1.194042
C 4.552476 0.631762 -0.430173
H -2.198944 -0.945468 2.051282
H -1.966059 -2.798119 -0.055924
H -0.937847 -2.907894 1.407059
H -1.678644 1.684736 0.166117
H -3.163002 1.532709 1.143561
H -4.462523 -0.616714 1.031628
H -3.853802 -1.943677 -0.006104
H -2.979408 1.638799 -1.944277
H -3.576792 2.936434 -0.871510
H -5.814807 -0.795599 -1.052063
H -4.346876 -0.633982 -2.060285
H 0.785511 -2.742353 -0.272161
H -0.217530 -1.685559 -1.330851
H -5.499149 1.512467 -0.153762
H -5.483054 1.592434 -1.933462
H 1.924616 1.258306 1.703812
H 2.241369 -1.637331 -1.528488
H 4.245660 2.040353 1.213241
H 4.559621 -0.856924 -2.003397
H 6.171021 1.755357 -0.177860


