%chk=000160521.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000160521

0 1
 O  -0.2713000       3.644800       1.775200    
 O    3.160600       4.169600      -1.151700    
 O    3.915700      -3.011300      1.5799999E-02
 O    1.759800      -3.476000       1.706000    
 O   -3.570000      -1.082300      -2.088600    
 O   -5.315400      -1.191100      7.2099999E-02
 C   5.0200000E-02   2.259300     -0.1448000    
 C    1.545300       2.623200     -0.3106000    
 C  -0.1133000      0.9663000      0.7222000    
 C    2.266800       1.467000      -1.017300    
 C   0.9761000     -8.5100003E-02  0.5179000    
 C    2.094600      0.1594000     -0.2959000    
 C  -0.7546000       3.417700      0.4678000    
 C    1.770900       3.912800      -1.106200    
 C   -1.515900      0.3841000      0.5433000    
 C   0.8985000      -1.313800       1.202500    
 C    3.065000     -0.8418000     -0.4682000    
 C   -1.908300     -8.8100001E-02 -0.7026000    
 C   -2.380700      0.3340000       1.628900    
 C    1.876300      -2.295000       1.037500    
 C    2.956000      -2.062200      0.1946000    
 C   -3.187600     -0.6197000     -0.8657000    
 C   -3.660100     -0.1973000       1.465700    
 C   -4.063500     -0.6742000      0.2185000    
 C    3.715600      -3.944600      -1.044400    
 C   -3.310800      -2.455900      -2.372100    
 H  -0.3517000       2.090100      -1.153100    
 H    2.001800       2.750400      0.6818000    
 H   7.4999998E-03   1.254100       1.776400    
 H    3.338500       1.690700      -1.086300    
 H    1.890300       1.347900      -2.041500    
 H   -1.817400       3.162500      0.5317000    
 H  -0.6852000       4.337900     -0.1169000    
 H    1.306100       4.775800     -0.6244000    
 H    1.388100       3.826200      -2.128400    
 H   6.6000000E-02  -1.514600       1.873400    
 H    3.918900     -0.6614000      -1.118100    
 H   -1.231500     -5.7100002E-02  -1.552600    
 H   -2.079700      0.7024000       2.605400    
 H  -0.7985000       4.367800       2.155400    
 H    3.286100       4.985000      -1.666400    
 H   -4.332400     -0.2336000       2.318700    
 H    2.539200      -4.022600       1.506500    
 H    3.706400      -3.428600      -2.009800    
 H    2.780600      -4.496400     -0.9052000    
 H    4.546000      -4.655900      -1.035800    
 H   -5.777800      -1.148000      0.9267000    
 H   -3.836400      -3.102100      -1.661900    
 H   -2.235400      -2.657600      -2.339100    
 H   -3.676600      -2.672900      -3.379400    


%chk=000160521-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000160521

0 1
O -0.295552 3.726468 1.533873
O 3.336140 4.048858 -1.097378
O 3.729718 -3.416188 -0.116397
O 1.500497 -3.803743 1.327986
O -3.711640 -1.211992 -1.998748
O -5.545808 -0.984079 0.208117
C 0.127341 2.129821 -0.254987
C 1.633196 2.511041 -0.312621
C -0.071690 0.869424 0.651726
C 2.407775 1.380054 -1.021891
C 0.969027 -0.229502 0.368362
C 2.139134 0.018767 -0.396811
C -0.780356 3.279656 0.210578
C 1.874487 3.857183 -1.009698
C -1.510671 0.351601 0.563072
C 0.773138 -1.514670 0.942533
C 3.086915 -1.024262 -0.583069
C -1.994320 -0.249366 -0.625745
C -2.397968 0.473153 1.658330
C 1.708568 -2.539836 0.756045
C 2.877364 -2.291159 -0.016898
C -3.322545 -0.707202 -0.745543
C -3.732590 0.019295 1.559567
C -4.208382 -0.558224 0.362617
C 4.966881 -3.258580 -0.878850
C -4.401459 -2.519684 -2.025720
H -0.201029 1.873447 -1.286424
H 2.006720 2.609655 0.725195
H 0.087744 1.218521 1.692710
H 3.487241 1.610213 -0.999749
H 2.116530 1.369747 -2.095696
H -1.827053 2.921596 0.279349
H -0.742998 4.119192 -0.515094
H 1.418733 4.674719 -0.416436
H 1.427217 3.849132 -2.030221
H -0.122225 -1.729895 1.534094
H 3.989192 -0.818278 -1.169461
H -1.334808 -0.395259 -1.488139
H -2.044859 0.923307 2.593002
H -0.941823 4.368453 1.919255
H 3.524780 4.966014 -1.416755
H -4.412459 0.123817 2.416485
H 2.269626 -4.382897 1.081523
H 5.612419 -2.478854 -0.430425
H 4.752034 -3.000900 -1.933943
H 5.471590 -4.234755 -0.828766
H -6.059751 -0.798572 1.032832
H -5.365350 -2.471334 -1.493605
H -3.758310 -3.301250 -1.576933
H -4.557560 -2.732853 -3.094244


