%chk=000034208.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034208

0 1
 O    2.895400      -4.095200     -0.1174000    
 N   0.2090000      -1.558200      1.3500000E-02
 C   0.7085000     -0.6102000       1.026700    
 C  -0.6267000     -0.9635000      -1.037600    
 C  -0.3442000       2.258800      0.5689000    
 C   -1.291400       2.001400     -0.6077000    
 C    1.576900      0.5354000      0.5392000    
 C   -1.967100     -0.4775000     -0.5278000    
 C    1.085200       1.837200      0.3026000    
 C   -2.271900      0.8836000     -0.3308000    
 C    1.255300      -2.400300     -0.5605000    
 C    2.945400      0.2803000      0.3167000    
 C   -2.940600      -1.448000     -0.2163000    
 C    1.964300       2.818700     -0.1991000    
 C   -3.538400       1.230800      0.1785000    
 C    1.911600      -3.271500      0.4950000    
 C    3.801800       1.268100     -0.1672000    
 C   -4.191300      -1.084200      0.2792000    
 C    3.308600       2.537100     -0.4338000    
 C   -4.490200      0.2571000      0.4779000    
 H  -0.1549000     -0.2119000       1.569600    
 H    1.240200      -1.130200       1.831700    
 H  -8.5600004E-02 -0.1905000      -1.591300    
 H  -0.8585000      -1.722600      -1.798900    
 H  -0.3400000       3.340300      0.7668000    
 H  -0.7069000       1.825100       1.507700    
 H   -1.868800       2.918800     -0.7893000    
 H  -0.7601000       1.829300      -1.550400    
 H    1.999600      -1.826100      -1.123600    
 H   0.8167000      -3.084400      -1.300400    
 H    3.365200     -0.7003000      0.5233000    
 H   -2.722200      -2.504400     -0.3589000    
 H    1.601700       3.824300     -0.4032000    
 H   -3.791500       2.275000      0.3497000    
 H    1.177100      -3.928400      0.9730000    
 H    2.424200      -2.711600       1.279300    
 H    4.850700       1.043500     -0.3357000    
 H   -4.927200      -1.847700      0.5126000    
 H    3.968400       3.310700     -0.8147000    
 H   -5.461000      0.5475000      0.8681000    
 H    3.560500      -3.509100     -0.5174000    


%chk=000034208-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000034208

0 1
O 2.861750 -4.272009 -0.244120
N 0.238978 -1.525799 -0.016290
C 0.646601 -0.562473 1.057837
C -0.632218 -0.918869 -1.066053
C -0.343184 2.350739 0.490166
C -1.377235 2.051140 -0.664862
C 1.567163 0.572716 0.594602
C -1.974712 -0.467444 -0.504952
C 1.091376 1.879184 0.257271
C -2.329513 0.903837 -0.348919
C 1.319710 -2.358469 -0.591278
C 2.955540 0.295565 0.454662
C -2.901344 -1.472921 -0.124615
C 2.016438 2.826759 -0.260689
C -3.614011 1.218526 0.174183
C 1.921749 -3.353834 0.421593
C 3.861928 1.248312 -0.054914
C -4.169434 -1.147911 0.397642
C 3.383021 2.522386 -0.433636
C -4.529826 0.212103 0.544912
H -0.287327 -0.165645 1.491368
H 1.144983 -1.144056 1.853522
H -0.122732 -0.086066 -1.601841
H -0.812686 -1.712840 -1.815270
H -0.307781 3.447014 0.630564
H -0.745014 1.937557 1.433184
H -1.980867 2.963422 -0.825617
H -0.823466 1.878149 -1.605036
H 2.143676 -1.756045 -1.052947
H 0.879081 -2.962697 -1.406241
H 3.333500 -0.682167 0.779382
H -2.604362 -2.522682 -0.233922
H 1.654697 3.831890 -0.512436
H -3.894339 2.273154 0.289115
H 1.130239 -4.001747 0.828506
H 2.422758 -2.837265 1.266903
H 4.926685 1.005707 -0.144988
H -4.870240 -1.940737 0.681920
H 4.069274 3.278064 -0.831869
H -5.515118 0.483836 0.940349
H 3.594062 -3.741185 -0.649185


