%chk=000070669.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070669

0 1
 O  -0.1880000       1.581900     -0.7167000    
 O    3.393900      -2.172300      0.5609000    
 N   -2.131900     -0.1544000     -0.8596000    
 C   -3.522500     -0.3340000     -0.4877000    
 C   -3.649600     -0.4428000       1.035200    
 C   -4.368300      0.8168000      -1.041800    
 C   -3.393300      0.8859000       1.746700    
 C   -4.109300       2.141000     -0.3230000    
 C   -4.269100       2.002700       1.187700    
 C   -1.121500      -1.082200     -0.5158000    
 C   0.2122000     -0.7164000     -0.2981000    
 C    1.155500      -1.689900      3.7799999E-02
 C   -1.506500      -2.418000     -0.3971000    
 C   0.6106000      0.7002000     -0.4261000    
 C    2.021300       1.072100     -0.1944000    
 C    2.566200      -1.318100      0.2689000    
 C    2.964600      9.8700002E-02  0.1411000    
 C   0.7647000      -3.029200      0.1562000    
 C  -0.5654000      -3.389400     -6.1900001E-02
 C    2.411900       2.411400     -0.3131000    
 C    4.298500      0.4644000      0.3582000    
 C    3.742400       2.771400     -9.6299998E-02
 C    4.683500       1.800000      0.2388000    
 H   -3.912600      -1.246500     -0.9528000    
 H   -2.995800      -1.207400       1.465500    
 H   -4.674000     -0.7621000       1.270200    
 H   -5.430300      0.5615000     -0.9335000    
 H   -4.181900      0.9452000      -2.115100    
 H   -2.337000       1.163200       1.647600    
 H   -3.590000      0.7702000       2.818700    
 H   -4.807900       2.899100     -0.6954000    
 H   -3.101700       2.505900     -0.5531000    
 H   -5.319900       1.795700       1.425600    
 H   -4.013200       2.950700       1.674100    
 H   -1.825000      0.7790000      -1.104800    
 H   -2.520800      -2.758900     -0.5766000    
 H    1.479500      -3.805500      0.4154000    
 H  -0.8659000      -4.429600      2.5400000E-02
 H    1.699300       3.189400     -0.5730000    
 H    5.051400     -0.2741000      0.6204000    
 H    4.044800       3.810600     -0.1887000    
 H    5.718600       2.083000      0.4073000    


%chk=000070669-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000070669

0 1
O -0.129875 1.701987 -0.387040
O 3.649510 -2.290160 0.202988
N -2.044116 -0.073220 -0.370372
C -3.502620 -0.296953 -0.419410
C -4.108825 -0.486445 1.003840
C -4.174497 0.903858 -1.135164
C -4.035593 0.812478 1.840837
C -4.121492 2.206013 -0.297244
C -4.724306 1.991543 1.112042
C -1.084532 -1.038028 -0.198248
C 0.322236 -0.665612 -0.145681
C 1.310924 -1.696815 0.009987
C -1.427109 -2.429628 -0.076747
C 0.728292 0.738570 -0.247622
C 2.181200 1.074181 -0.187223
C 2.773910 -1.374347 0.068076
C 3.169564 0.059747 -0.037101
C 0.937341 -3.049245 0.114714
C -0.434210 -3.404580 0.070638
C 2.581333 2.430443 -0.283433
C 4.541383 0.411711 0.014305
C 3.946892 2.773306 -0.231002
C 4.930779 1.761762 -0.081902
H -3.697523 -1.210284 -1.017930
H -3.587004 -1.309570 1.528499
H -5.168482 -0.794023 0.887551
H -5.234395 0.637151 -1.317388
H -3.702008 1.056364 -2.124270
H -2.973110 1.066771 2.028157
H -4.503650 0.645398 2.829712
H -4.669641 3.005730 -0.831020
H -3.075176 2.560509 -0.201028
H -5.809598 1.778191 1.016256
H -4.630481 2.917512 1.710886
H -1.658388 0.890849 -0.438710
H -2.477372 -2.731943 -0.103366
H 1.724029 -3.799694 0.231631
H -0.725739 -4.457208 0.155814
H 1.802467 3.190072 -0.398927
H 5.275440 -0.391989 0.129909
H 4.250390 3.823176 -0.306008
H 5.991547 2.031626 -0.041907


