%chk=000129890.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129890

0 1
 O    2.834400      0.4515000     -0.9389000    
 O   -4.544900       1.485200      0.1233000    
 O   -1.666900       2.441800      0.4236000    
 N    1.329800      -1.059600      5.2900001E-02
 N  -0.8900000      -1.528200     -0.1389000    
 N  -0.1249000      0.7355000      0.2474000    
 N   -3.782800      0.3387000     -9.8999999E-03
 N   -3.293100      -1.821800     -0.3123000    
 C    3.670200      -1.159600      0.6734000    
 C    2.509700     -0.2532000      0.2617000    
 C    4.958200     -0.3554000      0.8200000    
 C    5.206700      0.4907000     -0.4236000    
 C    3.968700       1.303300     -0.7783000    
 C   8.3999999E-02 -0.5519000      6.2600002E-02
 C   -2.159200      -1.086500     -0.1398000    
 C   -2.421500      0.2462000      4.9100000E-02
 C   -1.417600       1.253600      0.2563000    
 C   -4.260900     -0.9302000     -0.2286000    
 H    3.829800      -1.929300     -9.3500003E-02
 H    3.442400      -1.681300       1.610200    
 H    2.327100      0.4730000       1.065100    
 H    5.805100      -1.028300      0.9936000    
 H    4.881100      0.2990000       1.696900    
 H    6.065900       1.151700     -0.2695000    
 H    5.448000     -0.1783000      -1.258800    
 H    3.753200       2.057900     -1.2800000E-02
 H    4.127300       1.829200      -1.725100    
 H    1.465200      -2.041600     -0.1696000    
 H  -0.6322000      -2.500400     -0.2720000    
 H   -5.318700      -1.135700     -0.3169000    
 H   -4.576600       1.782000     -0.8024000    


%chk=000129890-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000129890

0 1
O 3.062546 0.028776 -1.274599
O -4.542889 1.423492 0.547253
O -1.841270 2.194168 1.039689
N 1.358072 -1.111147 -0.141178
N -0.927554 -1.545559 -0.544817
N -0.190972 0.563695 0.444242
N -3.882361 0.255959 0.072284
N -3.429836 -1.786769 -0.803244
C 3.578877 -0.902288 0.967027
C 2.506915 -0.249128 0.074372
C 4.818425 0.021720 1.067803
C 5.344321 0.387433 -0.340833
C 4.203478 0.968008 -1.196266
C 0.054912 -0.649937 -0.076221
C -2.260047 -1.142672 -0.444162
C -2.502597 0.120445 0.099797
C -1.502489 1.044889 0.562862
C -4.422442 -0.890919 -0.469551
H 3.874312 -1.876731 0.527022
H 3.148343 -1.096764 1.966823
H 2.128370 0.689863 0.522890
H 5.609454 -0.467178 1.665166
H 4.536460 0.949460 1.606540
H 6.166708 1.125344 -0.270854
H 5.747173 -0.516146 -0.837829
H 3.852416 1.933761 -0.770340
H 4.506422 1.129260 -2.243758
H 1.550008 -2.013719 -0.579992
H -0.693125 -2.448051 -0.963394
H -5.486897 -1.048403 -0.607439
H -3.747232 2.007137 0.845905


