%chk=000081591.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081591

0 1
 O  -0.7185000     -0.2427000      3.6200002E-02
 O   -1.835100      -2.232400      0.3420000    
 C    4.142300      0.5001000     -4.6100002E-02
 C    3.027500     -0.5412000      7.4299999E-02
 C    5.548400     -0.1020000      2.9700000E-02
 C    1.649000      0.1097000     -3.1099999E-02
 C    6.662000      0.9279000     -0.1643000    
 C   0.5317000     -0.9115000      0.1292000    
 C    8.033600      0.2699000     -0.1522000    
 C   -1.826600      -1.024800      0.1605000    
 C   -3.062400     -0.2100000      4.4100001E-02
 C   -4.200200     -0.7947000     -0.4734000    
 C   -3.034900       1.106300      0.4574000    
 C   -5.361300     -2.9400000E-02 -0.5826000    
 C   -4.196200       1.871300      0.3482000    
 C   -5.359300       1.303400     -0.1718000    
 H    4.033600       1.032600     -0.9992000    
 H    4.030300       1.248000      0.7486000    
 H    3.140500      -1.294000     -0.7149000    
 H    3.119100      -1.062400       1.034800    
 H    5.675700     -0.5981000      0.9998000    
 H    5.642000     -0.8805000     -0.7378000    
 H    1.541600      0.6189000     -0.9970000    
 H    1.538000      0.8894000      0.7328000    
 H    6.612100       1.681700      0.6296000    
 H    6.523200       1.450200      -1.117900    
 H   0.6004000      -1.669400     -0.6600000    
 H   0.6099000      -1.403100       1.106100    
 H    8.215500     -0.2398000      0.7993000    
 H    8.815900       1.022900     -0.2894000    
 H    8.124000     -0.4646000     -0.9589000    
 H   -4.213300      -1.830400     -0.7996000    
 H   -2.146600       1.567900      0.8779000    
 H   -6.266900     -0.4713000     -0.9880000    
 H   -4.196000       2.908400      0.6708000    
 H   -6.263500       1.899000     -0.2561000    


%chk=000081591-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000081591

0 1
O -0.732276 -0.180558 -0.044359
O -1.829596 -2.236477 -0.034403
C 4.227038 0.513517 0.018040
C 3.080622 -0.520360 -0.049336
C 5.630680 -0.130311 -0.035605
C 1.679541 0.134472 -0.016542
C 6.779424 0.901125 0.041630
C 0.567796 -0.913407 -0.052530
C 8.178414 0.250691 -0.018401
C -1.879524 -0.980034 -0.038478
C -3.132879 -0.169901 -0.038079
C -4.372353 -0.861189 -0.021855
C -3.113917 1.249182 -0.055404
C -5.583161 -0.139097 -0.022732
C -4.328367 1.967425 -0.056827
C -5.563491 1.276379 -0.040474
H 4.121976 1.233492 -0.820346
H 4.130778 1.106685 0.951337
H 3.186742 -1.123332 -0.975165
H 3.179732 -1.230433 0.798122
H 5.735068 -0.856254 0.797964
H 5.730440 -0.717499 -0.972587
H 1.564328 0.818308 -0.879601
H 1.572018 0.748087 0.898744
H 6.681847 1.485458 0.979452
H 6.672589 1.628100 -0.789498
H 0.609728 -1.538706 -0.964132
H 0.596292 -1.586471 0.824639
H 8.324133 -0.455218 0.821055
H 8.980994 1.009182 0.035192
H 8.311731 -0.316383 -0.959135
H -4.360719 -1.956141 -0.009077
H -2.152153 1.769319 -0.068142
H -6.538744 -0.674331 -0.009974
H -4.314265 3.062700 -0.070796
H -6.504967 1.837282 -0.041699


