%chk=000122775.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122775

0 1
 O    1.111400       1.905700      -1.752100    
 O    3.834000     -0.7478000       1.160300    
 O    3.352800       1.646700     -0.1453000    
 O   -2.396100       1.847300       1.746900    
 O   -4.664300       1.869000      0.1402000    
 C  -0.2158000      -2.683800     -0.7556000    
 C   -1.345300      -2.692400      0.2934000    
 C   0.7382000      -1.525800     -0.5922000    
 C   -2.219900      -1.485100      0.2548000    
 C    1.854300      -1.673800      0.2161000    
 C   0.4808000     -0.3349000      -1.252800    
 C    1.362300      0.7356000      -1.101400    
 C    2.735600     -0.6032000      0.3677000    
 C    2.489600      0.6014000     -0.2911000    
 C   -1.900600     -0.3674000       1.025800    
 C   -3.358100      -1.473900     -0.5517000    
 C   -2.719100      0.7614000      0.9903000    
 C   -4.176700     -0.3452000     -0.5872000    
 C   -3.857200      0.7725000      0.1838000    
 C   0.3233000       2.874400      -1.063200    
 C    5.024200      -1.227100      0.5375000    
 C    3.546600       2.146300       1.175900    
 H  -0.6440000      -2.662400      -1.766500    
 H   0.3407000      -3.627800     -0.6914000    
 H  -0.9146000      -2.799200       1.298100    
 H   -1.956500      -3.592400      0.1450000    
 H    2.046600      -2.610400      0.7327000    
 H  -0.3909000     -0.2275000      -1.892900    
 H   -1.020100     -0.3693000       1.664000    
 H   -3.616400      -2.337600      -1.158700    
 H   -5.059800     -0.3497000      -1.220500    
 H   0.7707000       3.126900     -9.6699998E-02
 H  -0.6953000       2.501400     -0.9194000    
 H   0.2805000       3.779300      -1.675400    
 H    5.343600     -0.5478000     -0.2592000    
 H    4.867100      -2.232400      0.1339000    
 H    5.812000      -1.273000       1.294200    
 H    4.446300       1.706400       1.615000    
 H    2.679100       1.963800       1.819900    
 H    3.697900       3.227600       1.107600    
 H   -3.067700       2.535300       1.596800    
 H   -5.401400       1.695700     -0.4704000    


%chk=000122775-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122775

0 1
O 1.194031 1.872493 -2.071079
O 3.595605 -0.823559 1.364798
O 3.398854 1.646503 -0.065146
O -2.703657 1.595697 2.034558
O -5.034194 1.596767 0.676416
C -0.373349 -2.660291 -1.005015
C -1.387324 -2.843116 0.175221
C 0.624682 -1.534674 -0.778827
C -2.379977 -1.697284 0.306797
C 1.666004 -1.684918 0.173765
C 0.527212 -0.322378 -1.490042
C 1.420495 0.755985 -1.255738
C 2.569989 -0.633682 0.401610
C 2.454679 0.610583 -0.287336
C -2.090963 -0.578088 1.129527
C -3.598672 -1.718302 -0.418312
C -2.996586 0.493950 1.220751
C -4.516882 -0.644423 -0.331468
C -4.211772 0.456553 0.487812
C 1.646834 3.213266 -1.664386
C 4.960793 -0.883609 0.793638
C 3.355187 2.234231 1.295901
H -0.941887 -2.482306 -1.936638
H 0.169587 -3.618083 -1.132758
H -0.815140 -2.962806 1.114431
H -1.934772 -3.791036 0.007863
H 1.799334 -2.616015 0.735065
H -0.263713 -0.167207 -2.230520
H -1.158282 -0.524755 1.699978
H -3.838481 -2.580481 -1.051250
H -5.459746 -0.674124 -0.892645
H 2.744950 3.290934 -1.686849
H 1.277540 3.465170 -0.651703
H 1.189687 3.890356 -2.403104
H 5.198935 0.046014 0.245913
H 5.051282 -1.754191 0.116030
H 5.635127 -1.008270 1.655036
H 3.515230 1.453120 2.059487
H 2.381705 2.733667 1.466590
H 4.169250 2.975300 1.322804
H -3.456677 2.241114 1.973929
H -5.867117 1.538695 0.151097


