%chk=000030796.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030796

0 1
 I   -1.133700      -2.143000      0.9412000    
 I   -3.572000       3.251000     -0.6508000    
 I    2.287900       2.857100      0.3914000    
 O   -3.295900     -0.3948000      -2.210700    
 O    1.400400     -0.2017000      0.9231000    
 O    2.111900      -2.976700      -1.165500    
 O    2.058800      -2.917900       1.099200    
 N   -3.378600      5.8699999E-02  9.2100002E-02
 C   -5.354000     -0.8304000       1.366500    
 C   -4.278800      0.2362000       1.244200    
 C   -6.070800     -0.9673000      4.1499998E-02
 C   -5.070700      -1.394400      -1.010500    
 C   -3.839900     -0.5096000      -1.109000    
 C   -2.074500      0.6809000      0.1645000    
 C  -0.9563000     -7.4600004E-02  0.5136000    
 C   -1.941700       2.039800     -0.1158000    
 C   0.2985000      0.5309000      0.5829000    
 C  -0.6871000       2.645100     -4.6500001E-02
 C   0.4331000       1.890800      0.3028000    
 C    2.117500     -0.8189000     -0.1416000    
 C    3.526800     -0.2710000     -0.1758000    
 C    2.082700      -2.326900      2.7400000E-02
 C    4.133900      0.1087000       1.009300    
 C    4.180800     -0.1610000      -1.391300    
 C    5.433800      0.6137000      0.9779000    
 C    5.480700      0.3440000      -1.422500    
 C    6.107100      0.7314000     -0.2378000    
 H   -6.061600     -0.5581000       2.157200    
 H   -4.902300      -1.788600       1.650400    
 H   -4.770800       1.208300       1.155900    
 H   -3.679100      0.2525000       2.162100    
 H   -6.532600     -1.3100000E-02 -0.2390000    
 H   -6.872500      -1.709600      0.1194000    
 H   -5.564300      -1.405500      -1.989200    
 H   -4.720400      -2.414000     -0.8088000    
 H  -0.5806000       3.705700     -0.2648000    
 H    1.619400     -0.5864000      -1.095100    
 H    3.640000      3.4000000E-03   1.971000    
 H    3.702000     -0.4609000      -2.318800    
 H    5.923800      0.9102000       1.900700    
 H    6.005300      0.4354000      -2.369100    
 H    7.119600       1.123500     -0.2621000    
 H    2.103100      -3.950900      -1.051200    


%chk=000030796-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000030796

0 1
I -1.276343 -2.340414 1.269386
I -2.589778 3.497929 -0.255306
I 2.452721 2.254369 2.943283
O -1.570465 -0.209769 -1.983047
O 1.455347 -0.739666 2.261788
O 3.378249 -3.573454 1.761788
O 4.149404 -1.638521 2.792827
N -2.825603 0.186812 -0.065038
C -5.189672 -0.652396 0.067271
C -4.082854 0.175297 0.741077
C -5.285533 -0.290591 -1.427945
C -3.964749 -0.674298 -2.124715
C -2.699119 -0.210977 -1.404209
C -1.635928 0.653495 0.596804
C -0.724310 -0.265619 1.183347
C -1.327441 2.035244 0.682301
C 0.504480 0.155878 1.760204
C -0.177196 2.490087 1.359345
C 0.731507 1.553505 1.891992
C 2.216774 -1.555147 1.221012
C 2.699168 -0.726845 0.042536
C 3.343368 -2.198266 2.025824
C 3.898203 0.030532 0.091016
C 1.890332 -0.683218 -1.123516
C 4.285437 0.808849 -1.020514
C 2.273055 0.108741 -2.227099
C 3.475524 0.850684 -2.180537
H -6.141834 -0.453196 0.592294
H -4.970118 -1.732649 0.174133
H -4.424645 1.219733 0.885856
H -3.839633 -0.242638 1.735963
H -5.472831 0.795695 -1.536983
H -6.131249 -0.815862 -1.907980
H -3.904242 -0.275732 -3.152647
H -3.887535 -1.776692 -2.214446
H 0.025371 3.559068 1.448037
H 1.545578 -2.355254 0.868917
H 4.514070 0.016195 0.996172
H 0.950323 -1.244437 -1.172670
H 5.214189 1.388693 -0.979481
H 1.625075 0.148473 -3.108437
H 3.777209 1.462010 -3.038661
H 4.144596 -3.983649 2.248457


