%chk=000128687.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128687

0 1
 O    4.174900       2.058500     -0.9330000    
 O   -6.677100      -1.988900       1.040300    
 O    5.705700      -2.033900      0.8045000    
 C   3.1700000E-02   1.628100      0.4976000    
 C    1.172300      0.8960000     -0.2413000    
 C   -1.350600       1.328500     -9.1700003E-02
 C   -1.614100     -0.2074000     -6.0000003E-04
 C   -3.036200     -0.6180000     -0.5463000    
 C   0.9401000     -0.6124000     -8.1600003E-02
 C    2.378700       1.452700      0.5466000    
 C  -0.4450000      -1.032400     -0.6057000    
 C   0.5168000       3.072800      0.5530000    
 C   -2.453300       2.096200      0.6481000    
 C    2.035900       2.941200      0.7651000    
 C   -4.106000      0.2844000      8.2099997E-02
 C    1.277300       1.254300      -1.746800    
 C   -3.828100       1.769200      7.9400003E-02
 C   -3.298300      -2.102700     -0.1592000    
 C   -3.128400     -0.4776000      -2.082600    
 C    3.700500       1.265000     -0.1310000    
 C   -4.755700      -2.517700     -0.2857000    
 C   -5.259900     -0.1678000      0.6009000    
 C   -5.634600      -1.598000      0.5190000    
 C    4.428900      6.5700002E-02  0.2091000    
 C    5.034700     -0.9313000      0.4918000    
 C    6.717300      -2.286200     -0.1620000    
 C    7.472400      -3.538300      0.2298000    
 H   1.1800000E-02   1.274300       1.542400    
 H   -1.372900       1.647200      -1.139300    
 H   -1.614500     -0.4471000       1.075600    
 H    1.013400     -0.8957000      0.9764000    
 H    1.714700      -1.182000     -0.6086000    
 H    2.431500      0.9803000       1.538300    
 H  -0.4504000     -0.9547000      -1.697300    
 H  -0.5775000      -2.094700     -0.3727000    
 H   5.0099999E-02   3.634100       1.368700    
 H   0.3031000       3.604600     -0.3807000    
 H   -2.285500       3.176000      0.5615000    
 H   -2.429200       1.855300       1.718800    
 H    2.566100       3.622100      9.0999998E-02
 H    2.304500       3.236800       1.786200    
 H    1.507200       2.311800      -1.911100    
 H    2.068800      0.6702000      -2.230400    
 H   0.3569000       1.042900      -2.297200    
 H   -3.897200       2.141800     -0.9501000    
 H   -4.584400       2.317100      0.6548000    
 H   -2.988300      -2.269100      0.8821000    
 H   -2.691200      -2.777200     -0.7748000    
 H   -2.818200      0.5134000      -2.428300    
 H   -2.500400      -1.214800      -2.593500    
 H   -4.153500     -0.6308000      -2.439800    
 H   -4.873300      -3.536500      9.9900000E-02
 H   -5.093700      -2.506700      -1.326600    
 H   -5.987600      0.5005000       1.048900    
 H    6.265800      -2.429100      -1.151900    
 H    7.416000      -1.441100     -0.2078000    
 H    8.260400      -3.762700     -0.4945000    
 H    7.925600      -3.421700       1.219900    
 H    6.793500      -4.395500      0.2897000    


%chk=000128687-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000128687

0 1
O 4.307536 2.270553 -0.831917
O -6.684110 -2.183454 1.113570
O 5.529122 -2.155416 0.504054
C 0.009516 1.724905 0.465367
C 1.186607 0.977709 -0.242126
C -1.378458 1.379130 -0.113953
C -1.602436 -0.164086 0.000476
C -3.016606 -0.643254 -0.532907
C 0.964381 -0.541050 -0.057061
C 2.399609 1.595529 0.566862
C -0.420811 -0.970981 -0.611711
C 0.472895 3.200473 0.509370
C -2.503731 2.135194 0.626504
C 2.018029 3.101622 0.745957
C -4.112207 0.224389 0.114269
C 1.320595 1.339322 -1.745876
C -3.900358 1.726699 0.100030
C -3.218963 -2.138615 -0.133370
C -3.130365 -0.491820 -2.084382
C 3.758853 1.383846 -0.103231
C -4.680025 -2.624698 -0.227513
C -5.258695 -0.306130 0.651853
C -5.622413 -1.734506 0.580350
C 4.385012 0.098339 0.106918
C 4.963271 -0.983506 0.281767
C 6.873936 -2.402964 -0.172944
C 7.306647 -3.802135 0.233856
H 0.008621 1.356077 1.518516
H -1.408411 1.681009 -1.182414
H -1.606393 -0.383128 1.094587
H 1.018367 -0.787877 1.024426
H 1.760417 -1.124205 -0.559105
H 2.422604 1.080524 1.548407
H -0.418680 -0.859551 -1.712658
H -0.558721 -2.048723 -0.406114
H -0.029133 3.776154 1.306927
H 0.250545 3.708289 -0.448892
H -2.372960 3.227540 0.508958
H -2.438102 1.915041 1.712182
H 2.586240 3.714803 0.025648
H 2.294779 3.447666 1.757784
H 1.587327 2.400010 -1.891665
H 2.121072 0.737834 -2.214592
H 0.388932 1.144270 -2.303939
H -3.993705 2.088647 -0.946513
H -4.699348 2.225911 0.678118
H -2.872064 -2.271743 0.911689
H -2.581688 -2.780840 -0.768603
H -2.935922 0.542786 -2.417508
H -2.409862 -1.153669 -2.596565
H -4.143132 -0.764380 -2.431235
H -4.784301 -3.665336 0.127463
H -5.028691 -2.614534 -1.280884
H -5.999451 0.347087 1.131962
H 6.713156 -2.299192 -1.260948
H 7.564214 -1.616694 0.181233
H 8.281462 -4.038054 -0.230358
H 7.415575 -3.877783 1.328620
H 6.571924 -4.554034 -0.099339


