%chk=000021205.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021205

0 1
 O    8.800800      0.7144000      1.7999999E-02
 O    7.813400      -1.351300      0.2992000    
 C   -2.433500     -0.4670000     -1.9099999E-02
 C   -3.754700      0.2623000     -0.2845000    
 C   -1.161100      0.3506000     -0.2616000    
 C   -5.026900     -0.5375000      1.1400000E-02
 C   0.1258000     -0.4529000     -5.7799999E-02
 C   -6.312600      0.2694000     -0.1893000    
 C    1.362600      0.4342000     -0.2240000    
 C   -7.551200     -0.5900000      8.5299999E-02
 C   -8.878500      0.1482000     -0.1696000    
 C    2.681500     -0.3124000     -3.8000001E-03
 C    3.919000      0.5683000     -0.1947000    
 C    5.206800     -0.2330000      2.5400000E-02
 C   -9.032700       1.392000      0.7068000    
 C   -10.05460     -0.8015000      7.0600003E-02
 C    6.462000      0.6275000     -0.1204000    
 C    7.744200     -0.1490000      8.3600000E-02
 C    10.08980      0.1277000      0.2244000    
 H   -2.402400      -1.364700     -0.6495000    
 H   -2.429900     -0.8197000       1.020000    
 H   -3.774600      0.5843000      -1.333300    
 H   -3.769100       1.178500      0.3197000    
 H   -1.164600       1.215200      0.4136000    
 H   -1.179700      0.7476000      -1.284000    
 H   -4.987800     -0.9005000       1.045900    
 H   -5.045200      -1.424000     -0.6345000    
 H   0.1629000      -1.279700     -0.7769000    
 H   0.1270000     -0.8952000      0.9456000    
 H   -6.349800      0.6520000      -1.216000    
 H   -6.290800       1.134000      0.4827000    
 H    1.306400       1.271700      0.4825000    
 H    1.360900      0.8693000      -1.231200    
 H   -7.513500      -1.482200     -0.5528000    
 H   -7.520800     -0.9450000       1.123500    
 H   -8.908400      0.4636000      -1.220200    
 H    2.688900     -0.7335000       1.009200    
 H    2.731400      -1.159800     -0.6990000    
 H    3.882300       1.408000      0.5095000    
 H    3.917900      0.9919000      -1.206000    
 H    5.247900      -1.063300     -0.6910000    
 H    5.192100     -0.6850000       1.025200    
 H   -8.918000       1.147000       1.768100    
 H   -8.294200       2.157000      0.4492000    
 H   -10.02180       1.842800      0.5697000    
 H   -10.08340      -1.144400       1.110500    
 H   -11.00630     -0.3064000     -0.1496000    
 H   -9.981300      -1.682800     -0.5755000    
 H    6.490600       1.067100      -1.123900    
 H    6.433500       1.436100      0.6190000    
 H    10.84000      0.9191000      0.1468000    
 H    10.29140     -0.6239000     -0.5447000    
 H    10.14870     -0.3152000       1.223200    


%chk=000021205-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000021205

0 1
O 8.904558 0.680622 0.193753
O 7.972294 -1.392531 -0.310888
C -2.453915 -0.431378 0.082601
C -3.769351 0.336736 -0.177252
C -1.187241 0.408916 -0.195378
C -5.035722 -0.505142 0.097264
C 0.127575 -0.359116 0.067637
C -6.351485 0.264921 -0.157789
C 1.394619 0.480332 -0.210993
C -7.612612 -0.584456 0.120643
C -8.958734 0.109035 -0.222793
C 2.708286 -0.289825 0.051073
C 3.975399 0.550949 -0.222674
C 5.282581 -0.231785 0.027732
C -9.210207 1.360752 0.653174
C -10.132843 -0.889677 -0.086090
C 6.538129 0.630136 -0.222258
C 7.830710 -0.162497 -0.124493
C 10.233076 0.024853 0.268525
H -2.432978 -1.344970 -0.548118
H -2.437043 -0.781914 1.136018
H -3.785590 0.689948 -1.229829
H -3.791415 1.248724 0.455852
H -1.209096 1.323503 0.433928
H -1.203145 0.757568 -1.249455
H -5.018278 -0.861006 1.148973
H -5.015186 -1.415807 -0.537754
H 0.148813 -1.273982 -0.561096
H 0.143431 -0.707294 1.121812
H -6.372183 0.614442 -1.211860
H -6.360767 1.176343 0.473553
H 1.373821 1.394677 0.418730
H 1.378231 0.829143 -1.265002
H -7.541254 -1.526134 -0.463822
H -7.627100 -0.883428 1.190844
H -8.907650 0.436971 -1.283873
H 2.722629 -0.641941 1.103780
H 2.730737 -1.201926 -0.581132
H 3.955712 1.459309 0.415740
H 3.956252 0.908912 -1.273815
H 5.321696 -1.124757 -0.624277
H 5.296750 -0.608738 1.069588
H -9.229799 1.084742 1.725895
H -8.426278 2.126711 0.514178
H -10.182932 1.826398 0.407159
H -10.218993 -1.249716 0.957780
H -11.095516 -0.418691 -0.360175
H -9.987369 -1.772546 -0.736723
H 6.495296 1.064332 -1.242917
H 6.592807 1.486705 0.473304
H 10.930619 0.832652 0.530612
H 10.493380 -0.425880 -0.704151
H 10.227678 -0.763295 1.040158


