%chk=000040306.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040306

0 1
 O  -0.2231000       1.955700     -0.2946000    
 O  -0.6657000      -4.392200     -4.1499998E-02
 C   -4.771400       1.319500     -0.1152000    
 C    4.788100       1.404500      0.1910000    
 C   -1.201800     -0.2242000     -0.3757000    
 C    1.142200      2.9899999E-02  8.7399997E-02
 C  -9.9500000E-02  0.5985000     -0.1962000    
 C   -3.428900      0.7285000      0.2404000    
 C    3.593300      0.5071000     -2.1000000E-02
 C   -2.524600      0.3482000     -0.6761000    
 C    2.324400      0.8591000      0.2825000    
 C   -1.089500      -1.603900     -0.2775000    
 C    1.268000      -1.355600      0.1886000    
 C   0.1521000      -2.172500      6.2000002E-03
 C   -5.895700      0.4305000      0.4149000    
 C   -4.891900       2.734100      0.4507000    
 C    5.766800      0.7564000       1.169700    
 C    5.474400       1.694000      -1.143500    
 C   0.2829000      -3.617500      0.1100000    
 H   -4.875200       1.381900      -1.206100    
 H    4.464100       2.361400      0.6198000    
 H   -3.198100      0.6165000       1.297900    
 H    3.803100     -0.4636000     -0.4648000    
 H   -2.743000      0.4553000      -1.735800    
 H    2.149500       1.847200      0.7022000    
 H   -1.964700      -2.233600     -0.4221000    
 H    2.221800      -1.820300      0.4284000    
 H   -5.827100     -0.5798000     -3.7000000E-03
 H   -6.874200      0.8392000      0.1405000    
 H   -5.861400      0.3452000       1.507000    
 H   -4.099900       3.381800      5.8600001E-02
 H   -5.853900       3.180100      0.1759000    
 H   -4.819500       2.738400       1.544300    
 H    6.146500     -0.1981000      0.7878000    
 H    6.625700       1.412100       1.348900    
 H    5.286300      0.5652000       2.135700    
 H    5.843900      0.7760000      -1.614700    
 H    6.327900       2.365600      -1.001700    
 H    4.783000       2.176700      -1.843300    
 H    1.289400      -4.009400      0.3349000    
 H   -1.125100       2.209900     -0.5447000    


%chk=000040306-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000040306

0 1
O -0.413051 1.676440 -0.178084
O -0.398348 -4.769446 -1.088202
C -4.747483 1.360625 0.135188
C 4.619951 1.511125 0.374645
C -1.356343 -0.575392 -0.511988
C 1.107970 -0.188567 -0.212914
C -0.236161 0.294435 -0.290070
C -3.307442 0.893741 0.229476
C 3.533156 0.484658 0.123422
C -2.748223 -0.063977 -0.570996
C 2.203519 0.771760 0.026852
C -1.098540 -1.945258 -0.719945
C 1.302328 -1.581027 -0.383600
C 0.222295 -2.457983 -0.647074
C -5.509022 1.031150 1.447558
C -4.811568 2.882339 -0.167664
C 5.372611 1.198216 1.696883
C 5.613740 1.557976 -0.818447
C 0.483809 -3.899551 -0.844105
H -5.237395 0.817864 -0.698375
H 4.144318 2.507913 0.471531
H -2.730919 1.326693 1.064960
H 3.892176 -0.552761 0.018776
H -3.395810 -0.547489 -1.317709
H 1.887205 1.816492 0.133804
H -1.918597 -2.644739 -0.918672
H 2.316547 -1.994619 -0.324449
H -5.497601 -0.053420 1.655364
H -6.561917 1.361163 1.377811
H -5.048504 1.548989 2.310508
H -4.319004 3.123164 -1.127186
H -5.861688 3.223413 -0.225488
H -4.312859 3.464339 0.631140
H 5.860784 0.205976 1.645074
H 6.159600 1.952360 1.884617
H 4.681383 1.194035 2.558389
H 6.104378 0.575623 -0.958961
H 6.406200 2.308009 -0.636731
H 5.096441 1.818567 -1.758890
H 1.562454 -4.192710 -0.760919
H -1.361189 1.907673 -0.380430


