%chk=000105023.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000105023

0 1
 O   -2.027800     -0.1747000       2.268000    
 O   -1.814300      -1.546800     -0.4256000    
 O   -1.723300       2.887400     -0.8666000    
 O   -2.589000      8.8900000E-02  -2.557800    
 O    2.198800       1.170300      0.1892000    
 O    3.845800       1.532700      -1.389800    
 C  -0.7278000      0.9639000      0.3843000    
 C   -1.997800      0.3702000      0.9575000    
 C   0.2788000     -0.2473000      7.5400002E-02
 C   -2.618300     -0.3946000     -0.1547000    
 C   -1.328300       1.519800     -0.9799000    
 C   -2.844800      0.9880000       2.049200    
 C   -2.596900      0.6662000      -1.267000    
 C  -0.4513000      -1.309900     -0.8175000    
 C  -9.5299996E-02   2.061900       1.245500    
 C   0.7739000     -0.9598000       1.372300    
 C    1.544600      0.2695000     -0.6700000    
 C   0.2092000      -2.664200     -0.8453000    
 C    1.676800      -2.172400       1.106400    
 C    1.176200      -3.059100     -8.9999998E-04
 C    1.821900      -4.408700     -0.1100000    
 C    3.352400       1.743100     -0.2902000    
 C    3.936500       2.675500      0.7273000    
 H   -3.636400     -0.7379000      5.2600000E-02
 H  -0.6182000       1.477900      -1.807100    
 H   -2.543100       1.897000       2.547700    
 H   -3.917500      0.8400000       2.018100    
 H   -3.494200       1.293100      -1.185700    
 H  -0.4564000     -0.9603000      -1.856400    
 H   0.3814000       1.673900       2.148800    
 H   0.6131000       2.677200      0.6858000    
 H  -0.8497000       2.777700       1.589700    
 H  -7.7699997E-02  -1.339200       1.943300    
 H    1.305600     -0.2764000       2.042300    
 H    1.285500      0.7756000      -1.604400    
 H    2.225500     -0.5454000     -0.9377000    
 H  -0.1317000      -3.345900      -1.621500    
 H    1.745500      -2.752600       2.035300    
 H    2.695800      -1.842400      0.8723000    
 H   -2.111600       3.149300      -1.718800    
 H   -2.504900      0.8136000      -3.200600    
 H    2.900300      -4.301000     -0.2649000    
 H    1.422000      -4.992300     -0.9459000    
 H    1.657600      -4.984000      0.8068000    
 H    4.153000       2.128600       1.648400    
 H    3.239500       3.494600      0.9208000    
 H    4.871200       3.093500      0.3430000    


%chk=000105023-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000105023

0 1
O -2.164277 -0.138366 2.411433
O -1.801526 -1.643755 -0.379449
O -1.896686 2.892965 -0.861096
O -2.698261 -0.094117 -2.578472
O 2.424075 0.998841 0.274290
O 3.702803 1.656498 -1.561358
C -0.860219 1.004085 0.390914
C -2.127964 0.356853 1.002201
C 0.209827 -0.156321 0.107550
C -2.686331 -0.506837 -0.127093
C -1.474737 1.486634 -0.986553
C -3.027713 1.029691 1.987448
C -2.709525 0.552175 -1.265594
C -0.433664 -1.244445 -0.830430
C -0.286796 2.142590 1.251717
C 0.652189 -0.867342 1.418756
C 1.440188 0.384208 -0.668689
C 0.352424 -2.532351 -0.898888
C 1.690784 -1.979347 1.152588
C 1.315356 -2.890128 -0.006130
C 2.075182 -4.195432 -0.117768
C 3.533854 1.609507 -0.321644
C 4.451033 2.184751 0.736161
H -3.671848 -0.953624 0.073473
H -0.750575 1.385613 -1.819003
H -2.739575 1.993757 2.419447
H -4.104431 0.815335 1.964833
H -3.620408 1.172998 -1.129050
H -0.548216 -0.832480 -1.857406
H -0.168438 1.801617 2.296053
H 0.700514 2.467985 0.891068
H -0.959980 3.013717 1.230199
H -0.239308 -1.315617 1.888140
H 1.070825 -0.134510 2.128165
H 1.174257 1.150175 -1.418405
H 1.957480 -0.435704 -1.197406
H 0.076248 -3.211572 -1.715094
H 1.810158 -2.591874 2.069147
H 2.691338 -1.537504 0.959826
H -2.007474 3.281445 -1.764274
H -3.058231 0.532191 -3.254830
H 3.168587 -4.019234 -0.162082
H 1.782482 -4.769098 -1.013845
H 1.893891 -4.830578 0.771860
H 4.759792 1.396965 1.444591
H 3.920436 2.958366 1.318727
H 5.337060 2.625769 0.257671


