%chk=000121396.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121396

0 1
 O  -0.2462000       2.862600      0.8366000    
 O   -1.200900       2.294400      -1.142400    
 O    3.748000     -0.6760000      -1.187500    
 O    3.310500      -1.024700       1.011200    
 O   -2.474600      -1.682500       1.181100    
 N   -1.516900     -0.2677000     -0.3978000    
 N   -2.931800      -1.959900      -1.051400    
 C  -0.7625000      0.5594000      0.5096000    
 C   0.6394000      4.8000002E-03  0.7903000    
 C    1.574100     -9.3500003E-02 -0.4221000    
 C  -0.7626000       1.968400     -4.6799999E-02
 C    2.939900     -0.6577000     -9.5200002E-02
 C   -2.316400      -1.327800      1.4400000E-02
 H   -1.320200      0.5945000       1.454300    
 H    1.124900      0.6294000       1.551600    
 H   0.5429000     -0.9936000       1.237400    
 H    1.722600      0.9035000     -0.8514000    
 H    1.124400     -0.7408000      -1.183000    
 H   -1.442000     -8.7899998E-02  -1.394900    
 H  -0.2615000       3.777000      0.4818000    
 H   -2.789400      -1.652900      -2.007600    
 H   -3.547300      -2.753300     -0.9071000    
 H    4.640300      -1.024300     -0.9761000    


%chk=000121396-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000121396

0 1
O -0.172036 2.893701 0.858938
O -1.126274 2.377332 -1.193125
O 3.693618 -0.722760 -1.199265
O 3.241624 -1.150583 1.037781
O -2.099997 -1.813374 1.117426
N -1.523887 -0.221673 -0.492259
N -2.879335 -2.058689 -1.071133
C -0.804690 0.592853 0.490785
C 0.611179 0.041506 0.840412
C 1.531272 -0.054466 -0.387449
C -0.738743 2.014206 -0.057125
C 2.866208 -0.693535 -0.062893
C -2.166418 -1.389418 -0.078665
H -1.377286 0.609600 1.439753
H 1.061798 0.687639 1.613527
H 0.465969 -0.955775 1.288812
H 1.736276 0.937608 -0.835672
H 1.052130 -0.654047 -1.185643
H -1.715137 0.219885 -1.396174
H -0.144039 3.810752 0.472550
H -2.915988 -1.758609 -2.042673
H -3.361506 -2.909483 -0.793645
H 4.559963 -1.151271 -0.959262


