%chk=000129965.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129965

0 1
 O  -0.7032000      -1.151000       1.652600    
 O   -3.922000      0.6943000      -1.072800    
 N   -2.176900      0.1890000      0.4136000    
 N    4.128400     -0.7715000     -0.1714000    
 N    5.122800      -1.325100     -0.1340000    
 C  -0.7199000       2.090000     -0.1706000    
 C   -1.742700       1.506500      0.7950000    
 C   0.5365000       1.276600     -0.2485000    
 C   0.7173000      0.3055000      -1.160200    
 C    1.963400     -0.5200000      -1.257800    
 C    1.574800       1.581900      0.7177000    
 C   -1.625700     -0.9840000      0.8729000    
 C   -3.202300     -7.7600002E-02 -0.4623000    
 C    2.976800     -0.1305000     -0.2148000    
 C    2.746300      0.9366000      0.7660000    
 C   -2.370900      -2.078400      0.2319000    
 C   -3.302900      -1.542500     -0.5573000    
 H   -1.170300       2.161600      -1.170100    
 H  -0.4885000       3.123000      0.1187000    
 H   -1.326900       1.462000       1.808400    
 H   -2.620600       2.162500      0.8190000    
 H  -6.6900000E-02  8.7600000E-02  -1.880700    
 H    1.713700      -1.578500      -1.126400    
 H    2.412700     -0.3933000      -2.248700    
 H    1.381700       2.373000       1.436700    
 H    3.507100       1.179600       1.497300    
 H   -2.174600      -3.125200      0.3905000    
 H   -4.017200      -2.066300      -1.169700    


%chk=000129965-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000129965

0 1
O -1.186205 -0.878623 2.377028
O -3.472878 0.561351 -1.465755
N -2.214634 0.210171 0.523852
N 4.149898 -0.824476 -0.296290
N 5.172800 -1.436805 -0.326227
C -0.759681 2.109936 -0.268695
C -1.776440 1.588835 0.785070
C 0.528357 1.303780 -0.325069
C 0.851274 0.556707 -1.427477
C 2.116873 -0.277953 -1.557674
C 1.429184 1.337966 0.836368
C -1.865578 -0.913977 1.322300
C -3.006605 -0.197397 -0.577770
C 3.001206 -0.160191 -0.306191
C 2.615654 0.639096 0.839366
C -2.495269 -2.112569 0.655302
C -3.164529 -1.693787 -0.453199
H -1.251740 2.124145 -1.256909
H -0.536556 3.162281 0.000310
H -1.334464 1.585868 1.797292
H -2.663926 2.247496 0.791368
H 0.178178 0.542121 -2.295002
H 1.843690 -1.340782 -1.739100
H 2.680360 0.040562 -2.461550
H 1.152285 1.933981 1.712860
H 3.289357 0.669800 1.702640
H -2.390056 -3.118146 1.062705
H -3.740554 -2.273591 -1.174552


