%chk=000056368.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056368

0 1
 I   0.4686000      -1.686900      -1.529400    
 I   -1.179000       3.878500      0.3092000    
 I    4.522800       2.181200      0.8504000    
 O   -1.333500      0.8870000     -0.9003000    
 O    3.235600     -0.4749000     -0.4633000    
 O    4.795800      -3.164900       1.321300    
 O    5.186000      -2.350900     -0.7699000    
 C   -4.525700     -0.5392000      0.4753000    
 C   -5.912400     -0.8255000     -0.1077000    
 C   -3.555800      7.1000002E-02 -0.5354000    
 C   -6.890400      -1.413200      0.9104000    
 C   -2.182900      0.3071000      8.0200002E-02
 C   -8.227500      -1.746500      0.2658000    
 C  -4.3499999E-02   1.153800     -0.5212000    
 C   0.9465000      0.1892000     -0.6899000    
 C   0.2690000       2.392800      3.2400001E-02
 C    2.257700      0.4653000     -0.3024000    
 C    1.580200       2.669100      0.4197000    
 C    2.574500       1.705300      0.2524000    
 C    3.449300      -1.374200      0.6206000    
 C    4.564600      -2.323900      0.2818000    
 H   -4.630400      0.1403000       1.330400    
 H   -4.103200      -1.474100      0.8641000    
 H   -5.805700      -1.519500     -0.9508000    
 H   -6.330500      0.1037000     -0.5146000    
 H   -3.954400       1.019200     -0.9167000    
 H   -3.455400     -0.5863000      -1.407900    
 H   -6.466400      -2.323700       1.349300    
 H   -7.047400     -0.7006000       1.728100    
 H   -2.276400      0.9712000      0.9465000    
 H   -1.768800     -0.6419000      0.4380000    
 H   -8.913300      -2.162900       1.010300    
 H   -8.691300     -0.8512000     -0.1603000    
 H   -8.105100      -2.484400     -0.5334000    
 H    1.827200       3.636400      0.8523000    
 H    3.730700     -0.8240000       1.524000    
 H    2.547400      -1.961200      0.8190000    
 H    5.520800      -3.796600       1.126700    


%chk=000056368-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000056368

0 1
I 0.515052 -1.753742 -1.433131
I -1.203961 3.913104 0.243017
I 4.676651 2.244571 0.698579
O -1.350033 0.837064 -0.841718
O 3.362234 -0.477304 -0.496429
O 5.048193 -3.166647 1.291966
O 5.426956 -2.307149 -0.843631
C -4.639459 -0.564298 0.537296
C -6.008655 -0.837477 -0.125928
C -3.605100 0.019333 -0.453609
C -7.056745 -1.408688 0.856285
C -2.250974 0.259362 0.209485
C -8.419528 -1.686233 0.185720
C -0.044804 1.118906 -0.436329
C 0.988939 0.153848 -0.589553
C 0.307110 2.405563 0.054227
C 2.336756 0.453159 -0.257070
C 1.640904 2.726712 0.381737
C 2.646172 1.748516 0.233240
C 3.626065 -1.398756 0.616686
C 4.787212 -2.295861 0.218998
H -4.779760 0.136460 1.386628
H -4.250873 -1.509658 0.970699
H -5.872703 -1.545742 -0.969417
H -6.396574 0.103259 -0.568831
H -3.973310 0.977697 -0.867059
H -3.465828 -0.669970 -1.308316
H -6.665345 -2.345619 1.302891
H -7.194505 -0.697473 1.696276
H -2.327059 0.982894 1.045346
H -1.803952 -0.685248 0.579044
H -9.152057 -2.089635 0.908723
H -8.844938 -0.760499 -0.245717
H -8.315283 -2.420644 -0.635091
H 1.894757 3.725951 0.741660
H 3.896454 -0.844798 1.536908
H 2.740137 -2.029603 0.827081
H 5.805552 -3.766753 1.054339


