%chk=000058069.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000058069

0 1
 O   0.8669000      0.3404000     -1.1500000E-02
 O  -0.8055000      0.6647000       1.528900    
 N   -4.862500     -2.9800000E-02 -0.6285000    
 N   -1.225000      0.7180000     -0.7533000    
 C   -5.252700      0.6930000      0.5816000    
 C   -5.676100      -1.245200     -0.6238000    
 C   -6.766000      0.5372000      0.5980000    
 C   -7.044100     -0.7385000     -0.1912000    
 C   -3.436100     -0.3161000     -0.6691000    
 C   -2.637700      0.9788000     -0.7031000    
 C  -0.4240000      0.5822000      0.3660000    
 C    3.168100     -7.8599997E-02  0.4720000    
 C    1.809200      0.1780000       1.054400    
 C    3.594600      -1.376300      0.2084000    
 C    3.995900       1.005900      0.1994000    
 C    5.262900      0.7905000     -0.3426000    
 C    4.861600      -1.591900     -0.3335000    
 C    5.695800     -0.5086000     -0.6091000    
 C    2.719400      -2.552100      0.4943000    
 C    6.155300       1.948500     -0.6371000    
 H   -4.985800       1.753900      0.5542000    
 H   -4.823400      0.2420000       1.485500    
 H   -5.306800      -1.979400      0.1037000    
 H   -5.715500      -1.720000      -1.609200    
 H   -7.152100      0.4736000       1.620300    
 H   -7.251800       1.389000      0.1075000    
 H   -7.667500     -0.5068000      -1.062800    
 H   -7.574600      -1.481400      0.4130000    
 H   -3.125000     -0.9285000      0.1880000    
 H   -3.204200     -0.8981000      -1.570400    
 H   -2.822100       1.599500      0.1792000    
 H   -2.889300       1.567500      -1.592300    
 H  -0.7874000      0.6204000      -1.664500    
 H    1.832000       1.096700       1.655000    
 H    1.491000     -0.6291000       1.723500    
 H    3.659200       2.019000      0.4059000    
 H    5.215000      -2.597500     -0.5457000    
 H    6.681600     -0.6896000      -1.029300    
 H    3.147700      -3.479000      9.6299998E-02
 H    1.737000      -2.433800      2.5500000E-02
 H    2.597800      -2.686700       1.573900    
 H    6.837500       1.723300      -1.464000    
 H    6.748700       2.199900      0.2474000    
 H    5.574000       2.828600     -0.9328000    


%chk=000058069-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000058069

0 1
O 0.946828 1.536343 -0.056420
O -0.593515 1.160388 1.706570
N -4.692210 -0.165520 -0.503373
N -1.272687 1.489295 -0.520432
C -5.189668 -0.145540 0.901827
C -5.305409 -1.370843 -1.120051
C -6.646968 -0.690865 0.813297
C -6.764842 -1.305688 -0.620831
C -3.230208 -0.073792 -0.652436
C -2.713224 1.337661 -0.282039
C -0.346085 1.374288 0.489631
C 3.149604 0.521323 0.387905
C 2.085168 1.458691 0.911798
C 2.920285 -0.885475 0.296800
C 4.403466 1.055746 0.006250
C 5.462092 0.239329 -0.463279
C 3.977365 -1.699608 -0.176311
C 5.225315 -1.153780 -0.551824
C 1.582768 -1.506248 0.659936
C 6.807867 0.837786 -0.836006
H -5.144404 0.875019 1.320888
H -4.566243 -0.806437 1.555961
H -4.816943 -2.316095 -0.766932
H -5.217740 -1.332204 -2.220803
H -6.823934 -1.448863 1.596279
H -7.388558 0.112881 0.957608
H -7.350835 -0.637374 -1.274938
H -7.249019 -2.297719 -0.620707
H -2.688415 -0.829536 -0.026405
H -2.977545 -0.280423 -1.710996
H -2.888623 1.540018 0.787903
H -3.270862 2.087854 -0.872112
H -0.919367 1.653670 -1.463673
H 2.476659 2.486157 1.008616
H 1.667826 1.137170 1.884142
H 4.558875 2.140918 0.075436
H 3.818510 -2.782315 -0.253153
H 6.021045 -1.815926 -0.915003
H 1.677052 -2.597808 0.792831
H 0.835655 -1.327053 -0.137033
H 1.157543 -1.081741 1.587531
H 7.354384 0.191938 -1.545469
H 7.450684 0.964019 0.057093
H 6.694315 1.833961 -1.299972


