%chk=000008832.chk
%nprocshared=24
%mem=100GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000008832

0 1
 O    2.904600     -0.6572000     -0.4476000    
 O   -2.907900     -0.6495000     -0.4637000    
 O  -6.5000001E-03 -0.1467000       1.336600    
 N    1.150200      0.8762000     -0.3960000    
 N   -1.149200      0.8795000     -0.4032000    
 C    2.482600      0.5898000      9.1300003E-02
 C   -2.485100      0.5966000      7.6399997E-02
 C  -2.0999999E-03  0.4792000      0.2774000    
 C    4.229400     -0.9775000     -4.5499999E-02
 C   -4.216100     -0.9905000     -2.5699999E-02
 H    3.139700       1.395000     -0.2523000    
 H    2.475100      0.5471000       1.185500    
 H   -2.482600      0.5563000       1.170800    
 H   -3.139600       1.402100     -0.2715000    
 H    1.055900       1.362600      -1.282000    
 H   -1.048200       1.365800      -1.288600    
 H    4.932700     -0.2203000     -0.4054000    
 H    4.499300      -1.941700     -0.4844000    
 H    4.289500      -1.060100       1.044000    
 H   -4.240600      -1.092700       1.063600    
 H   -4.490100      -1.949800     -0.4728000    
 H   -4.937800     -0.2345000     -0.3499000    


%chk=000008832-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000008832

0 1
O 2.937642 -0.594027 -0.582020
O -2.932875 -0.600898 -0.574445
O 0.003654 0.315834 1.466988
N 1.177186 0.982175 -0.452389
N -1.175965 0.979714 -0.449517
C 2.467254 0.637971 0.082789
C -2.463947 0.632558 0.088737
C 0.001777 0.710059 0.265069
C 4.216363 -1.046471 -0.032720
C -4.208664 -1.056801 -0.021210
H 3.201899 1.450664 -0.108686
H 2.346624 0.478259 1.171993
H -2.340479 0.473600 1.177733
H -3.200982 1.443380 -0.101434
H 1.127557 1.212574 -1.445817
H -1.129214 1.210325 -1.443036
H 5.017046 -0.286340 -0.166922
H 4.483292 -1.956487 -0.591757
H 4.131794 -1.289956 1.047385
H -4.120113 -1.299956 1.058650
H -4.474806 -1.967590 -0.579364
H -5.011843 -0.298888 -0.153026


