%chk=000121503.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121503

0 1
 I   -5.236700      0.3016000       1.022400    
 O    1.348600       1.935700      -1.137700    
 O    3.304100      -1.503100       1.251700    
 N    2.561400      0.4425000      0.1869000    
 C   0.7444000     -0.4082000      -1.016300    
 C    1.461100      -1.555900     -0.2987000    
 C    1.569800      0.8162000     -0.6950000    
 C  -0.6584000     -0.2424000     -0.5380000    
 C    2.558000     -0.8999000      0.4928000    
 C    3.511200       1.390700      0.7371000    
 C   -1.704500     -0.8730000      -1.211600    
 C  -0.9243000      0.5441000      0.5830000    
 C   -3.016400     -0.7172000     -0.7640000    
 C   -2.236200      0.6997000       1.030400    
 C   -3.282200      6.9100000E-02  0.3570000    
 H   0.7725000     -0.5564000      -2.102600    
 H    1.921300      -2.235500      -1.024100    
 H   0.8146000      -2.133300      0.3697000    
 H   -1.509800      -1.489600      -2.085000    
 H  -0.1377000       1.034300       1.148900    
 H    2.959600       2.146000       1.304700    
 H    4.026700       1.891100     -8.7899998E-02
 H    4.235600      0.8919000       1.385100    
 H   -3.816600      -1.217700      -1.303300    
 H   -2.421200       1.313000       1.908800    


%chk=000121503-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121503

0 1
I -5.488982 0.497800 0.734850
O 1.333219 1.726784 -1.440012
O 3.616950 -1.150536 1.465203
N 2.664078 0.511755 0.080541
C 0.741745 -0.633357 -0.793853
C 1.528581 -1.580790 0.154184
C 1.564994 0.682282 -0.790511
C -0.717630 -0.382770 -0.420992
C 2.723885 -0.775835 0.669991
C 3.660721 1.561049 0.327344
C -1.728035 -0.456446 -1.408364
C -1.089963 -0.043198 0.904751
C -3.082493 -0.208782 -1.089837
C -2.437837 0.207539 1.242077
C -3.427342 0.120557 0.237683
H 0.771063 -1.011427 -1.832015
H 1.902679 -2.482414 -0.360445
H 0.926077 -1.930024 1.009487
H -1.462443 -0.703444 -2.442761
H -0.330004 0.035763 1.692102
H 3.178810 2.450614 0.766190
H 4.144173 1.857218 -0.618518
H 4.409946 1.154069 1.024732
H -3.849249 -0.272100 -1.866720
H -2.708044 0.469394 2.269196


