%chk=000005675.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005675

0 1
 O    3.358400      1.5100000E-02  0.4504000    
 O  -0.7904000      -2.216700       1.245800    
 O  -0.5955000       2.562200       1.289800    
 O   -2.535600      0.2348000       2.733100    
 O   -6.006300      0.4265000      -2.492400    
 C    1.381200       1.289700      0.8700000    
 C    1.289700      -1.113400      0.8471000    
 C    2.022100      6.7000002E-02  0.7201000    
 C  -0.7106000      0.1735000       1.271700    
 C  -7.6600000E-02  -1.060100       1.122800    
 C   2.1700000E-02   1.353800       1.144700    
 C    2.173600       2.565800      0.7329000    
 C    1.969700      -2.435700      0.6872000    
 C   -2.139600      0.2291000       1.560600    
 C    2.199900       3.073400     -0.6813000    
 C    1.961500      -2.928800     -0.7374000    
 C   -3.168500      0.2811000      0.4819000    
 C    3.272800       3.259700      -1.473800    
 C    1.922800      -4.202100      -1.174700    
 C    4.242000     -3.0700000E-02   1.567800    
 C   -2.750900      0.2762000     -0.8297000    
 C   -4.497100      0.3322000      0.8390000    
 C    3.230400       3.772600      -2.885200    
 C    4.657400       2.958900     -0.9643000    
 C    1.891500      -5.343800     -0.1936000    
 C    1.917000      -4.624500      -2.616600    
 C   -3.713200      0.3253000      -1.838200    
 C   -5.459600      0.3811000     -0.1695000    
 C   -5.067600      0.3776000      -1.508300    
 H    1.728100       3.349400       1.360200    
 H    3.164800       2.436000       1.169100    
 H    1.533300      -3.158000       1.384900    
 H    3.014900      -2.368400       1.007400    
 H    1.224700       3.323600      -1.098500    
 H    2.012300      -2.152500      -1.501200    
 H  -0.3692000      -2.932600      0.7446000    
 H   -1.532200       2.449300       1.515700    
 H    4.868200     -0.9234000       1.483900    
 H    3.711100     -5.5500001E-02   2.526000    
 H    4.893500      0.8471000       1.541700    
 H   -1.708300      0.2364000      -1.125800    
 H   -4.826000      0.3362000       1.873500    
 H    3.679700       3.044900      -3.568600    
 H    3.777900       4.717000      -2.967200    
 H    2.202400       3.952100      -3.217000    
 H    5.385500       3.634300      -1.428600    
 H    4.941600       1.934400      -1.224100    
 H    4.774000       3.102800      0.1117000    
 H    2.192500      -5.071700      0.8205000    
 H   0.8862000      -5.775500     -0.1529000    
 H    2.585600      -6.129900     -0.5127000    
 H    1.021300      -5.213900      -2.837100    
 H    2.800500      -5.230100      -2.842300    
 H    1.922700      -3.760500      -3.289300    
 H   -3.402200      0.3226000      -2.879400    
 H   -6.511500      0.4220000      0.1006000    
 H   -6.888900      0.4589000      -2.084800    


%chk=000005675-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000005675

0 1
O 3.767292 0.097924 0.573256
O -0.732275 -1.769797 0.284935
O -0.052536 2.904511 1.463717
O -2.336041 1.950453 1.333946
O -5.972498 -1.749576 -2.338095
C 1.847018 1.551462 0.958466
C 1.529509 -0.862490 0.398378
C 2.355272 0.273139 0.646017
C -0.465176 0.602787 0.703957
C 0.126199 -0.675614 0.431570
C 0.434452 1.687535 1.044328
C 2.738238 2.765660 1.191516
C 2.144769 -2.240540 0.161540
C -1.911471 0.892860 0.695576
C 2.643828 3.775643 0.051299
C 1.516272 -3.013751 -0.991220
C -2.933127 0.128451 -0.069601
C 3.548837 3.964989 -0.951112
C 1.106272 -4.321099 -1.006530
C 4.394957 -0.270206 1.858549
C -2.661974 -0.467381 -1.331711
C -4.264858 0.111756 0.421228
C 3.319415 5.033715 -2.009564
C 4.830521 3.165549 -1.119945
C 1.162804 -5.258816 0.187432
C 0.559829 -4.946166 -2.279828
C -3.685460 -1.073738 -2.077395
C -5.294650 -0.518663 -0.300245
C -5.000372 -1.111649 -1.553765
H 2.408827 3.267666 2.120983
H 3.780632 2.438011 1.327770
H 2.102166 -2.840888 1.092077
H 3.216446 -2.081613 -0.064731
H 1.732152 4.388470 0.062057
H 1.446332 -2.444865 -1.931252
H -0.234106 -2.536371 -0.132960
H -1.084677 2.779254 1.579343
H 4.026762 -1.252466 2.214228
H 4.191348 0.494954 2.631840
H 5.475943 -0.325637 1.657725
H -1.648609 -0.430484 -1.740929
H -4.476754 0.604141 1.375179
H 3.251356 4.583283 -3.020424
H 4.164656 5.750750 -2.039585
H 2.392624 5.603756 -1.823558
H 5.719923 3.797628 -0.920519
H 4.923932 2.812256 -2.166105
H 4.872324 2.278605 -0.467571
H 1.445951 -4.758250 1.127173
H 0.184201 -5.752708 0.342204
H 1.897666 -6.067166 0.002219
H -0.468771 -5.327891 -2.127447
H 1.176588 -5.814654 -2.584722
H 0.542084 -4.228933 -3.117961
H -3.494681 -1.515474 -3.059555
H -6.316263 -0.541761 0.100606
H -6.860397 -1.711759 -1.902585


