%chk=000086053.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086053

0 1
 O    6.590200       1.099300      0.4679000    
 N    4.766400      6.8999999E-03 -0.1288000    
 N    5.371700      0.9784000      0.6306000    
 C   -3.202400     -0.2677000      9.5299996E-02
 C   -1.759100     -4.4399999E-02  4.9999999E-03
 C   -3.788700      0.9641000     -0.2491000    
 C   -1.554900       1.335800     -0.3966000    
 C  -0.7961000     -0.9393000      0.2452000    
 C   -2.743300       1.942500     -0.5499000    
 C   0.6533000     -0.6928000      0.1482000    
 C   -3.975500      -1.366900      0.4244000    
 C   -5.164300       1.117500     -0.2697000    
 C    1.303500     -0.9351000      -1.051100    
 C    1.338100     -0.2238000       1.257600    
 C    3.379200     -0.2301000     -3.5300002E-02
 C   -5.364700      -1.217100      0.4053000    
 C   -5.953400      1.2800000E-02  6.1700001E-02
 C    2.675700     -0.7023000      -1.143400    
 C    2.710300      9.2000002E-03   1.165200    
 C    5.514000     -0.8472000      -1.082600    
 H  -0.5972000       1.808500     -0.5505000    
 H   -1.051400      -1.954600      0.5409000    
 H   -2.921700       2.964200     -0.8413000    
 H   -3.531500      -2.319600      0.6904000    
 H   -5.625300       2.063200     -0.5342000    
 H   0.7652000      -1.299100      -1.922300    
 H   0.8284000     -3.6699999E-02   2.199100    
 H   -6.000200      -2.061500      0.6590000    
 H   -7.036400      0.1035000      5.4099999E-02
 H    3.154200     -0.8819000      -2.101700    
 H    3.230700      0.3652000       2.050500    
 H    5.436300     -0.4427000      -2.097600    
 H    5.148000      -1.880600      -1.068400    
 H    6.578600     -0.9015000     -0.8280000    


%chk=000086053-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000086053

0 1
O 6.760168 0.996793 0.409130
N 4.928336 -0.195394 -0.200355
N 5.482699 0.938736 0.440984
C -3.278282 -0.127201 -0.000197
C -1.832330 0.237767 -0.008362
C -4.033368 1.073430 0.220505
C -1.788749 1.700289 0.203297
C -0.811359 -0.671731 -0.213992
C -3.077043 2.187734 0.330902
C 0.640855 -0.495924 -0.178711
C -3.935579 -1.361846 -0.147271
C -5.440143 1.037867 0.289017
C 1.458923 -1.488651 -0.793718
C 1.314806 0.588703 0.467220
C 3.506228 -0.292817 -0.184439
C -5.353368 -1.396165 -0.081541
C -6.097007 -0.209986 0.134656
C 2.860906 -1.392675 -0.810419
C 2.711440 0.693882 0.469986
C 5.787961 -1.202339 -0.845322
H -0.885433 2.309304 0.195947
H -1.129196 -1.696393 -0.460951
H -3.355827 3.234717 0.472411
H -3.377013 -2.291419 -0.309695
H -6.019498 1.952279 0.459221
H 0.979570 -2.345579 -1.282171
H 0.736095 1.334329 1.017689
H -5.879004 -2.350417 -0.198364
H -7.190574 -0.259878 0.184106
H 3.442755 -2.174110 -1.306815
H 3.202137 1.524200 0.980954
H 5.563350 -1.274629 -1.923540
H 5.656421 -2.190868 -0.371964
H 6.828825 -0.865809 -0.708300


