%chk=000088687.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088687

0 1
 O   0.9785000     -0.3396000      0.5151000    
 O  -0.3405000      0.9816000     -0.8844000    
 O    4.424500       1.435700     -0.8414000    
 O    4.564600      -1.081900      0.5720000    
 O    1.949300       1.589600      -2.432000    
 O   0.9206000      -2.558500       2.136600    
 C    3.377000      0.4645000     -0.8449000    
 C    3.401200     -0.2618000      0.5001000    
 C    2.036300       1.162800      -1.072800    
 C    2.155500      -1.134900      0.6682000    
 C   0.8646000      0.2227000     -0.7901000    
 C    2.099200      -1.778400       2.050200    
 C   -1.508300      0.3074000     -0.6548000    
 C   -2.356700      0.6919000      0.3799000    
 C   -2.016100       1.847400       1.262300    
 C   -1.837600     -0.7715000      -1.471000    
 C   -3.543400     -7.6000001E-03  0.6001000    
 C   -3.024200      -1.470800      -1.250900    
 C   -1.838100       1.429900       2.733700    
 C   -3.047000       2.986700       1.162100    
 C   -3.877200      -1.088800     -0.2152000    
 C   -3.382200      -2.626500      -2.122900    
 H    3.597500     -0.2256000      -1.668600    
 H    3.468200      0.4744000       1.310600    
 H    1.967100       2.064200     -0.4522000    
 H    2.132700      -1.938400     -8.0799997E-02
 H   0.8501000     -0.5785000      -1.540500    
 H    2.058400      -1.023300       2.842300    
 H    2.958400      -2.431100       2.228700    
 H    5.259200      0.9629000     -0.6811000    
 H    4.510200      -1.743100     -0.1390000    
 H    2.010300      0.8027000      -3.000000    
 H   -1.057000       2.282500      0.9556000    
 H   -1.190200      -1.062400      -2.293900    
 H   0.1648000      -1.969000       1.971500    
 H   -4.223800      0.2713000       1.400000    
 H   -1.089800      0.6343000       2.823800    
 H   -2.772100       1.063900       3.173200    
 H   -1.498300       2.279900       3.335300    
 H   -4.030900       2.684900       1.537000    
 H   -3.168500       3.310800      0.1225000    
 H   -2.719900       3.852700       1.747700    
 H   -4.805400      -1.624400     -3.4800000E-02
 H   -2.486200      -3.166300      -2.447700    
 H   -4.013400      -3.345700      -1.589900    
 H   -3.922300      -2.276100      -3.008000    


%chk=000088687-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000088687

0 1
O 1.355411 0.058756 0.975184
O -0.390700 0.818865 -0.345853
O 4.081040 0.735874 -2.130696
O 5.010364 -0.676564 0.273969
O 1.271922 0.443093 -2.724569
O 1.931519 -1.280246 3.401086
C 3.182658 -0.005272 -1.242309
C 3.690977 -0.011551 0.208882
C 1.802753 0.659461 -1.378451
C 2.638145 -0.673484 1.120935
C 0.798368 0.027807 -0.400304
C 2.959548 -0.598667 2.617190
C -1.645889 0.136378 -0.448455
C -2.571416 0.294982 0.617113
C -2.210012 1.146485 1.835864
C -1.935810 -0.595571 -1.616311
C -3.824711 -0.343399 0.450262
C -3.194121 -1.232509 -1.761202
C -3.015920 0.786499 3.104309
C -2.366033 2.656549 1.494605
C -4.130845 -1.095921 -0.707389
C -3.525514 -2.014954 -3.020602
H 3.096343 -1.063867 -1.588285
H 3.896722 1.019079 0.546021
H 1.897040 1.739822 -1.146376
H 2.487505 -1.739624 0.826032
H 0.575896 -1.023092 -0.688805
H 3.054661 0.468076 2.911097
H 3.906554 -1.117543 2.834532
H 5.010358 0.447618 -1.934466
H 4.891110 -1.648262 0.104981
H 1.931236 0.811681 -3.367040
H -1.134633 0.975876 2.041597
H -1.186780 -0.632865 -2.416916
H 1.057967 -0.885734 3.141742
H -4.574321 -0.264149 1.244596
H -2.949353 -0.291522 3.340604
H -4.085431 1.049105 2.997226
H -2.627040 1.352640 3.970410
H -3.417911 2.893933 1.247651
H -1.735220 2.928720 0.631121
H -2.064102 3.280914 2.356369
H -5.111764 -1.578329 -0.794295
H -2.774649 -2.802843 -3.217136
H -4.513586 -2.500526 -2.943579
H -3.543236 -1.355221 -3.908736


