%chk=000068494.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068494

0 1
 O  -9.8300003E-02   1.262300       1.177800    
 O    6.338700      -1.437100     -0.5058000    
 O   -6.494900     -0.8044000      0.9096000    
 O    6.800700      0.7297000      2.6000000E-03
 O   -6.677800      0.7746000     -0.7152000    
 N   0.3574000      0.3908000      0.3596000    
 N  -0.3529000     -0.3780000     -0.3790000    
 C    1.800100      0.2464000      0.2243000    
 C   -1.745100     -0.2771000     -0.2921000    
 C    2.601100       1.346700      0.4440000    
 C    2.315200     -0.9855000     -0.1186000    
 C    4.531100     -2.6500000E-02 -3.1399999E-02
 C    3.983100       1.208600      0.3145000    
 C    3.697200      -1.123500     -0.2480000    
 C   -4.522300     -7.6499999E-02 -0.1205000    
 C   -2.433300      0.6073000      -1.122700    
 C   -2.445600      -1.061400      0.6244000    
 C   -3.821900      0.7077000      -1.036800    
 C   -3.834300     -0.9611000      0.7101000    
 C    5.971900     -0.1709000     -0.1658000    
 C   -5.970100      2.7899999E-02 -3.1199999E-02
 H    2.191000       2.317200      0.7063000    
 H    1.687700      -1.856800     -0.2798000    
 H    4.615600       2.075800      0.4858000    
 H    4.081900      -2.103600     -0.5161000    
 H   -1.895900       1.222100      -1.840100    
 H   -1.917600      -1.753600       1.275100    
 H   -4.339100       1.402900      -1.692900    
 H   -4.339800      -1.590100       1.437300    
 H    7.311900      -1.523900     -0.5933000    
 H   -7.471500     -0.7267000      0.9615000    


%chk=000068494-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000068494

0 1
O 0.089838 0.640195 1.938312
O 6.423314 -0.594527 -1.557940
O -6.743588 0.156384 0.875785
O 6.972116 0.177797 0.563365
O -6.759355 -0.637018 -1.307796
N 0.426734 0.204888 0.738803
N -0.381765 -0.162763 -0.245034
C 1.867122 0.106319 0.437532
C -1.785428 -0.125610 -0.095939
C 2.773025 0.481979 1.454826
C 2.312707 -0.349785 -0.825087
C 4.621435 -0.058434 -0.059120
C 4.153493 0.397090 1.200214
C 3.695536 -0.430344 -1.068758
C -4.624680 -0.204479 -0.203334
C -2.462938 -0.564435 -1.279340
C -2.559273 0.276764 1.041796
C -3.860432 -0.604062 -1.334059
C -3.963919 0.232197 0.973290
C 6.092996 -0.130610 -0.276005
C -6.106244 -0.262463 -0.303097
H 2.381376 0.828282 2.413773
H 1.579176 -0.630014 -1.582798
H 4.884815 0.678710 1.964114
H 4.069621 -0.779196 -2.034589
H -1.852107 -0.866889 -2.135137
H -2.057076 0.612220 1.947861
H -4.385211 -0.938630 -2.234231
H -4.562907 0.537055 1.835767
H 7.413623 -0.622233 -1.646189
H -7.727802 0.094909 0.746615


