%chk=000062931.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062931

0 1
 O   -3.299700      0.7525000       1.335800    
 O    4.350700      -1.008000      -1.205800    
 O   -6.219400     -0.4938000      0.5552000    
 C   -2.824900      0.8809000     -1.2500000E-02
 C  -0.6621000     -0.3877000     -0.1361000    
 C   6.7400001E-02  0.9516000     -0.3943000    
 C   -2.147500     -0.3397000     -0.5891000    
 C    1.511900      0.9291000      0.1773000    
 C    2.265200     -0.4319000      1.5600000E-02
 C   -4.299700      0.8357000      0.3054000    
 C   -2.154500       2.188900     -0.2928000    
 C  -0.7111000       2.146600      0.1974000    
 C   8.7499999E-02  -1.554200     -0.8101000    
 C    1.572600      -1.290100      -1.072100    
 C    3.712100     -1.4400000E-02 -0.4154000    
 C    2.394500       1.995700     -0.5120000    
 C   -2.911200      -1.631800     -0.2398000    
 C    3.469100       1.228800      -1.270500    
 C    2.273200      -1.239300       1.334600    
 C   -5.068200     -0.4150000      0.1430000    
 C   -4.387000      -1.527600     -0.6144000    
 C    3.052700      -2.514900       1.160100    
 C    4.602500      0.3295000      0.7121000    
 C    5.325800      0.6092000       1.628500    
 H  -0.6579000     -0.5564000      0.9500000    
 H   0.1161000       1.098100      -1.483400    
 H   -2.169100     -0.2284000      -1.682700    
 H    1.463500       1.181900       1.245600    
 H   -4.864000       1.757800      0.2297000    
 H   -2.679900       3.018300      0.1955000    
 H   -2.178400       2.386200      -1.371000    
 H  -0.2188000       3.090500     -6.1999999E-02
 H  -0.7081000       2.077100       1.293100    
 H  -0.3754000      -1.806100      -1.772800    
 H  -1.8600000E-02  -2.449600     -0.1847000    
 H    2.083100      -2.238000      -1.268100    
 H    1.632700     -0.7565000      -2.030700    
 H    2.858800       2.630400      0.2530000    
 H    1.843100       2.660400      -1.184100    
 H   -2.820800      -1.842200      0.8338000    
 H   -2.476800      -2.486200     -0.7703000    
 H    3.111400      0.9568000      -2.271000    
 H    4.370000       1.835400      -1.419000    
 H    1.257800      -1.486800       1.659800    
 H    2.696600     -0.6544000       2.159000    
 H   -4.890200      -2.469300     -0.3697000    
 H   -4.509300      -1.342600      -1.686900    
 H    2.568400      -3.227800      0.4883000    
 H    4.086800      -2.373800      0.8420000    
 H    3.107800      -3.023200       2.131000    
 H    5.160400     -0.6229000      -1.582900    
 H    5.966700      0.8570000       2.442000    


%chk=000062931-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000062931

0 1
O -3.445481 0.717552 1.384030
O 4.285693 -1.033254 -1.378040
O -6.408182 -0.288605 -0.349478
C -2.871044 0.886560 -0.011973
C -0.656891 -0.380098 -0.092792
C 0.067423 0.971030 -0.347841
C -2.151882 -0.359446 -0.539967
C 1.521045 0.951460 0.219843
C 2.282895 -0.420881 -0.008558
C -4.365756 0.855626 0.177154
C -2.175799 2.214069 -0.258427
C -0.723652 2.154035 0.262816
C 0.109473 -1.556233 -0.779472
C 1.575903 -1.213913 -1.141711
C 3.723557 0.029714 -0.507766
C 2.413776 2.078266 -0.405016
C -2.898757 -1.642185 -0.095959
C 3.446246 1.345842 -1.289918
C 2.331603 -1.245539 1.311868
C -5.155774 -0.366176 -0.211491
C -4.383835 -1.648269 -0.520784
C 3.016504 -2.627426 1.225112
C 4.673697 0.304334 0.594942
C 5.519824 0.562699 1.454656
H -0.658215 -0.538788 1.007841
H 0.123871 1.129498 -1.448854
H -2.173763 -0.294288 -1.652240
H 1.437838 1.116775 1.313766
H -4.937170 1.793188 0.166175
H -2.734191 3.026589 0.241674
H -2.181392 2.425618 -1.347432
H -0.209416 3.109554 0.044824
H -0.745235 2.044111 1.366150
H -0.416907 -1.842239 -1.712855
H 0.084566 -2.448385 -0.126024
H 2.138159 -2.135062 -1.367048
H 1.594369 -0.619253 -2.074334
H 2.935220 2.645334 0.387253
H 1.818454 2.804642 -0.987495
H -2.830229 -1.717224 1.004862
H -2.399366 -2.530787 -0.521587
H 3.016765 1.072407 -2.271018
H 4.363428 1.934808 -1.465909
H 1.296126 -1.377140 1.681005
H 2.848871 -0.634364 2.077431
H -4.930897 -2.497101 -0.070561
H -4.466333 -1.787586 -1.620046
H 2.465005 -3.318702 0.562318
H 4.044780 -2.542209 0.834630
H 3.064457 -3.092682 2.227094
H 5.230031 -0.803354 -1.575095
H 6.246389 0.773277 2.217850


