%chk=000003687.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003687

0 1
 I   -2.624400       3.089700      0.8957000    
 O    1.511000      0.2842000     -0.8182000    
 O    3.495900     -0.7237000       1.997200    
 O    3.550700       2.134300      -1.397600    
 O   -1.378600      -2.661100     -0.8595000    
 O   -4.499600      0.5437000      0.1820000    
 N  -0.6036000     -0.5470000     -0.2444000    
 N   -2.919400      -1.046000     -0.3344000    
 C    2.845300     -0.8674000      0.7521000    
 C   0.7856000     -0.8752000     -0.3784000    
 C    1.417400      -1.326700      0.9257000    
 C    2.646700      0.4634000      4.4599999E-02
 C    3.847700      0.8956000     -0.7776000    
 C   -1.608100      -1.502700     -0.5053000    
 C  -0.9448000      0.7413000      0.1501000    
 C   -2.201600       1.172900      0.3116000    
 C   -3.320300      0.2246000      5.6499999E-02
 H    3.398000      -1.583000      0.1316000    
 H   0.9125000      -1.647600      -1.146200    
 H    1.329100      -2.405700       1.088100    
 H   0.9628000     -0.8406000       1.798700    
 H    2.391800       1.258600      0.7570000    
 H    4.074900      0.1731000      -1.568400    
 H    4.735000       1.025200     -0.1515000    
 H    4.378300     -0.3532000       1.826200    
 H  -0.1218000       1.417800      0.3550000    
 H   -3.658900      -1.718700     -0.5171000    
 H    2.757800       2.005900      -1.946000    


%chk=000003687-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000003687

0 1
I -2.752982 2.966919 1.411691
O 1.540562 0.212447 -0.879259
O 3.444688 -0.518159 2.184480
O 3.586376 2.024349 -1.748255
O -1.344512 -2.530517 -1.252209
O -4.626290 0.508598 0.106727
N -0.644833 -0.538357 -0.197125
N -2.938052 -0.960279 -0.553748
C 2.902668 -0.784387 0.854224
C 0.780364 -0.929004 -0.323156
C 1.457416 -1.289250 1.017443
C 2.725855 0.493531 -0.007877
C 3.881419 0.837884 -0.948345
C -1.626947 -1.426476 -0.714149
C -0.984108 0.679740 0.386241
C -2.285424 1.098072 0.525116
C -3.395259 0.258274 0.043413
H 3.521745 -1.526142 0.304470
H 0.793139 -1.762103 -1.044853
H 1.397020 -2.366349 1.234564
H 0.997909 -0.736789 1.857082
H 2.492009 1.354987 0.650475
H 4.102456 -0.040707 -1.592781
H 4.785242 1.096944 -0.368010
H 4.420719 -0.362573 2.130190
H -0.139102 1.296185 0.699630
H -3.672147 -1.580652 -0.911857
H 2.739469 1.855514 -2.236622


