%chk=000068586.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068586

0 1
 O    4.749600     -0.7602000     -0.4973000    
 O   -6.297200      6.5600000E-02  0.2243000    
 C    2.312000     -0.2878000     -0.3826000    
 C    1.577700       1.036000     -7.5199999E-02
 C   9.3000002E-02  0.9915000     -0.4488000    
 C  -0.5941000     -9.5399998E-02  0.4373000    
 C    1.625000      -1.426200      0.4033000    
 C   7.7399999E-02  -1.496500      0.2432000    
 C    3.762700      9.8899998E-02  5.5900000E-02
 C    2.482400       2.093500     -0.6991000    
 C    3.911600       1.551300     -0.4776000    
 C  -0.5996000       2.340000     -0.2414000    
 C    2.333300     -0.6535000      -1.895300    
 C   -2.117900     -5.5399999E-02  0.3498000    
 C  -0.3616000      -2.214000      -1.040100    
 C   -2.040600       2.255600     -0.7338000    
 C   -2.786100       1.067400     -0.1817000    
 C    3.956300      9.0899996E-02   1.520200    
 C   -2.895100      -1.094300      0.8934000    
 C   0.1172000      -3.650000      -1.053700    
 C   -4.190800       1.086800     -0.2344000    
 C   -4.290000      -1.057600      0.8481000    
 C   -4.938300      2.8800000E-02  0.2753000    
 C    4.113100      8.4600002E-02   2.710300    
 H    1.609500       1.219800       1.010700    
 H  -2.7799999E-02  0.7320000      -1.506100    
 H  -0.3917000      0.1855000       1.484100    
 H    1.792000      -1.269600       1.476600    
 H    2.106400      -2.385400      0.1895000    
 H  -0.2623000      -2.127600       1.077000    
 H    2.354200       3.073300     -0.2279000    
 H    2.282200       2.209800      -1.770300    
 H    4.469000       1.576300      -1.421600    
 H    4.457800       2.196000      0.2218000    
 H  -8.5699998E-02   3.135200     -0.7929000    
 H  -0.5786000       2.617900      0.8202000    
 H    1.398100     -0.4506000      -2.413100    
 H    3.086500     -7.9499997E-02  -2.447000    
 H    2.589000      -1.708900      -2.040500    
 H  -5.9900001E-02  -1.706700      -1.953500    
 H   -1.454800      -2.251600      -1.089700    
 H   -2.051700       2.188500      -1.828900    
 H   -2.557000       3.182200     -0.4549000    
 H    4.524300      -1.673800     -0.2510000    
 H   -2.426700      -1.953100       1.365900    
 H    1.194800      -3.725200      -1.221400    
 H  -0.1310000      -4.170000     -0.1229000    
 H  -0.3672000      -4.193200      -1.872600    
 H   -4.697700       1.945300     -0.6707000    
 H   -4.862100      -1.881600       1.265700    
 H    4.251200      7.9099998E-02   3.766100    
 H   -6.574900      0.8935000     -0.2039000    


%chk=000068586-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000068586

0 1
O 4.854176 -0.740948 -0.437252
O -6.380535 0.018429 0.459163
C 2.312278 -0.309759 -0.371660
C 1.582631 1.046812 -0.124415
C 0.089544 0.998014 -0.499121
C -0.585022 -0.070539 0.419076
C 1.592365 -1.427146 0.424569
C 0.041152 -1.496579 0.211024
C 3.767143 0.090392 0.134070
C 2.529138 2.094898 -0.762224
C 3.958666 1.540106 -0.448929
C -0.627053 2.355721 -0.345994
C 2.442343 -0.665080 -1.878534
C -2.120821 -0.029581 0.367241
C -0.442558 -2.196707 -1.092198
C -2.081761 2.241712 -0.843547
C -2.822693 1.069278 -0.206331
C 3.885599 0.079223 1.609485
C -2.886029 -1.062728 0.973842
C 0.093171 -3.634549 -1.269405
C -4.239934 1.091623 -0.181438
C -4.291896 -1.045661 1.002382
C -4.972354 0.041155 0.410578
C 4.038368 0.052644 2.833311
H 1.616839 1.221753 0.976015
H -0.020029 0.692917 -1.561859
H -0.302902 0.221239 1.459027
H 1.762520 -1.241152 1.504342
H 2.037890 -2.416484 0.201385
H -0.326600 -2.139137 1.040862
H 2.377554 3.103104 -0.339107
H 2.359531 2.166018 -1.853210
H 4.584530 1.453160 -1.353591
H 4.501996 2.177186 0.267690
H -0.096019 3.137273 -0.922153
H -0.611907 2.666342 0.719250
H 1.477958 -0.575165 -2.403214
H 3.171176 -0.020088 -2.395424
H 2.798618 -1.702743 -1.998628
H -0.188464 -1.600149 -1.986802
H -1.548256 -2.233094 -1.060961
H -2.072479 2.113470 -1.946733
H -2.634949 3.180364 -0.646688
H 4.876148 -1.608161 0.044103
H -2.369863 -1.907240 1.443886
H 1.182739 -3.652263 -1.452467
H -0.106934 -4.246672 -0.368674
H -0.394544 -4.132427 -2.127675
H -4.768314 1.948935 -0.623482
H -4.868432 -1.847939 1.471809
H 4.169882 0.038336 3.899567
H -6.757709 0.819487 0.017838


