%chk=000088748.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088748

0 1
 O   -1.085600       2.090400      0.3403000    
 O   -1.200000      -2.070500     -0.3385000    
 O   -2.231200       3.020300      -1.435200    
 O   -2.363200      -2.969300       1.439100    
 O    5.031200       2.275900      0.3492000    
 O    4.910300      -2.413200     -0.3529000    
 C   -3.441800      0.4760000      0.6456000    
 C   -3.459600     -0.3491000     -0.6472000    
 C   -3.438800       1.978500      0.3762000    
 C   -3.534200      -1.852200     -0.3768000    
 C    1.296600       2.021400      0.6458000    
 C    1.183000      -2.063200     -0.6464000    
 C   0.1574000       2.471400     -0.2576000    
 C   3.3500001E-02  -2.482900      0.2586000    
 C    2.656600       2.383200      5.9400000E-02
 C    2.533900      -2.459200     -6.0899999E-02
 C   -2.203400       2.430700     -0.3625000    
 C   -2.327800      -2.381800      0.3667000    
 C    3.797100       1.895500      0.9418000    
 C    3.685700      -2.001900     -0.9447000    
 H   -4.330000      0.2315000       1.241000    
 H   -2.570700      0.2038000       1.252700    
 H   -4.332000     -6.0899999E-02  -1.246200    
 H   -2.573500     -0.1225000      -1.251100    
 H   -3.496200       2.538100       1.316400    
 H   -4.317100       2.256100     -0.2179000    
 H   -3.620700      -2.406400      -1.318200    
 H   -4.427600      -2.083100      0.2149000    
 H    1.176900       2.478200       1.636200    
 H    1.226400      0.9388000      0.8071000    
 H    1.050600      -2.517700      -1.636200    
 H    1.140200     -0.9793000     -0.8088000    
 H   0.1814000       3.560400     -0.3812000    
 H   0.2453000       1.993300      -1.240300    
 H   2.9600000E-02  -3.572000      0.3831000    
 H   0.1346000      -2.006100       1.240700    
 H    2.765600       1.949500     -0.9426000    
 H    2.736300       3.469300     -7.3500000E-02
 H    2.655000      -2.027400      0.9406000    
 H    2.585800      -3.546900      7.3100001E-02
 H    3.777800      0.8054000       1.039100    
 H    3.737700       2.343100       1.939000    
 H    3.694200     -0.9117000      -1.043100    
 H    3.613900      -2.448800      -1.941400    
 H    5.739100       1.950500      0.9310000    
 H    5.625700      -2.106500     -0.9357000    


%chk=000088748-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000088748

0 1
O -1.129187 2.215382 0.411902
O -1.135343 -2.091762 -0.391641
O -2.103871 2.750283 -1.636247
O -2.154777 -2.674691 1.620406
O 5.031459 1.219044 0.721453
O 4.990601 -1.306448 -0.506009
C -3.583051 0.514138 0.614839
C -3.576144 -0.387422 -0.640447
C -3.518354 2.029096 0.269895
C -3.529397 -1.902866 -0.295886
C 1.252234 2.013465 0.864087
C 1.249234 -1.973677 -0.814506
C 0.222212 2.406948 -0.195664
C 0.195666 -2.314444 0.241639
C 2.674830 1.911135 0.266460
C 2.668979 -1.951918 -0.201871
C -2.224292 2.386704 -0.443146
C -2.252212 -2.278427 0.436512
C 3.737247 1.522717 1.320767
C 3.743777 -1.623896 -1.243140
H -4.502007 0.323881 1.202680
H -2.727068 0.266930 1.269776
H -4.484178 -0.190372 -1.242786
H -2.708662 -0.145280 -1.281725
H -3.586550 2.616241 1.203828
H -4.354715 2.316242 -0.390229
H -3.588798 -2.488706 -1.231603
H -4.378429 -2.184496 0.350251
H 1.232017 2.744687 1.694556
H 0.957707 1.035239 1.294537
H 1.188523 -2.703843 -1.644226
H 1.011124 -0.979949 -1.241811
H 0.321943 3.460241 -0.515942
H 0.290384 1.768357 -1.097289
H 0.259723 -3.364118 0.582711
H 0.274709 -1.660679 1.131121
H 2.677020 1.150380 -0.541549
H 2.974193 2.867255 -0.205116
H 2.711435 -1.186431 0.596796
H 2.908252 -2.921349 0.274908
H 3.363370 0.669084 1.933230
H 3.916395 2.369334 2.007724
H 3.442330 -0.748746 -1.856346
H 3.912033 -2.486587 -1.918228
H 5.006153 0.299921 0.314864
H 5.771484 -1.361901 -1.110835


