%chk=000108050.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108050

0 1
 O   -2.686900       1.816900      0.2842000    
 O   -3.510000      0.4661000      -1.342200    
 N  -9.4599999E-02  0.1648000      0.4083000    
 N   -3.339000      -1.660200      0.3950000    
 C  -0.9947000     -0.9552000      0.2475000    
 C   -2.425100     -0.5379000      0.5990000    
 C    1.269000      9.2100002E-02  0.1797000    
 C   -2.934700      0.5998000     -0.2702000    
 C    1.870100      -1.112200     -0.2338000    
 C    2.092900       1.220400      0.3549000    
 C    3.244000      -1.185600     -0.4634000    
 C    3.466700       1.147100      0.1251000    
 C    4.042300     -5.5900000E-02 -0.2840000    
 H  -0.9609000      -1.305200     -0.7924000    
 H  -0.6898000      -1.781900      0.9013000    
 H   -2.488000     -0.2282000       1.649200    
 H  -0.4664000       1.051100      0.7322000    
 H   -4.270200      -1.409000      0.7257000    
 H   -3.041300      -2.452100      0.9637000    
 H    1.287200      -2.016600     -0.3867000    
 H    1.660800       2.166600      0.6735000    
 H    3.692700      -2.121900     -0.7821000    
 H    4.088500       2.026600      0.2646000    
 H    5.112000     -0.1130000     -0.4629000    
 H   -3.019400       2.548600     -0.2782000    


%chk=000108050-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000108050

0 1
O -2.542215 1.814190 0.464104
O -3.727471 0.529179 -1.072123
N -0.090274 0.179247 0.408521
N -3.285267 -1.801621 0.612355
C -0.998844 -0.955837 0.275309
C -2.444616 -0.611486 0.738545
C 1.280715 0.093121 0.155839
C -2.988430 0.587106 -0.069375
C 1.895841 -1.128292 -0.252259
C 2.102880 1.251364 0.308063
C 3.286171 -1.178121 -0.492143
C 3.487126 1.184775 0.063108
C 4.095997 -0.030106 -0.339069
H -1.043005 -1.324709 -0.775003
H -0.674205 -1.807559 0.904689
H -2.397812 -0.303803 1.798520
H -0.491948 1.090905 0.634701
H -3.498825 -2.049298 -0.359720
H -4.125191 -1.790388 1.197133
H 1.294280 -2.033403 -0.383464
H 1.645889 2.198343 0.623668
H 3.738422 -2.127178 -0.803984
H 4.096982 2.087433 0.187828
H 5.173364 -0.077578 -0.528015
H -2.884363 2.568917 -0.089227


