%chk=000130631.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130631

0 1
 O    5.869800     -8.1400000E-02 -3.8600001E-02
 O   -3.949100       1.761000     -0.7512000    
 O   -1.493200       2.831700     -0.2809000    
 O  -1.6899999E-02  -2.522000       1.712700    
 C    3.594000     -0.5250000     -0.8058000    
 C    2.256400     -0.4820000     -3.4600001E-02
 C    1.925800      0.8438000      0.5198000    
 C    4.680800      0.2377000     -1.6300000E-02
 C    4.129500      -1.950100      -1.078100    
 C    3.425600      0.1721000      -2.172700    
 C  -0.5968000      0.6690000      0.3062000    
 C  -0.8350000     -0.6986000      0.4753000    
 C    1.513500      -1.582800      0.1839000    
 C   0.6722000       1.325500      0.6451000    
 C   -3.153400     -0.4130000     -0.1716000    
 C   -4.499500      -1.008300     -0.4218000    
 C    3.007300       1.730900      0.9440000    
 C   0.2175000      -1.638400      0.8969000    
 C    4.297400       1.457100      0.7349000    
 C   -2.109900      -1.237000      0.2435000    
 C   -1.665900       1.485700     -0.1011000    
 C   -2.931100      0.9486000     -0.3466000    
 C   -5.110500      -1.632400      0.8464000    
 C   -4.480600      -2.046000      -1.559300    
 C   -4.747900       2.353800      0.2698000    
 H    4.290700      -2.501100     -0.1438000    
 H    3.446700      -2.528100      -1.711100    
 H    5.092800      -1.922900      -1.602200    
 H    4.370200      0.1783000      -2.729900    
 H    2.676300     -0.3394000      -2.788000    
 H    3.114600       1.218200      -2.072400    
 H    1.844000      -2.561300     -0.1491000    
 H   0.5502000       2.317000       1.082800    
 H   -5.205200     -0.2354000     -0.7473000    
 H    2.755100       2.641300       1.482000    
 H   -2.275100      -2.303500      0.3777000    
 H    5.084000       2.109800       1.094600    
 H   -5.148900     -0.9020000       1.661900    
 H   -6.133600      -1.972300      0.6517000    
 H   -4.535600      -2.496300       1.197000    
 H   -3.877600      -2.924200      -1.305000    
 H   -5.496100      -2.393300      -1.779000    
 H   -4.069000      -1.610100      -2.476500    
 H  -0.5691000       3.021300     -0.5107000    
 H   -5.152800       1.597400      0.9489000    
 H   -5.582100       2.874700     -0.2081000    
 H   -4.160100       3.083300      0.8355000    


%chk=000130631-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000130631

0 1
O 6.036082 0.231059 0.248138
O -4.355992 1.550991 -0.331037
O -1.779248 2.750575 -0.432377
O -0.076879 -3.050568 0.728441
C 3.841664 -0.547412 -0.568326
C 2.374693 -0.443885 -0.087174
C 1.870067 0.902353 0.235069
C 4.791778 0.457212 0.152056
C 4.449586 -1.966354 -0.484635
C 3.856506 -0.087579 -2.077691
C -0.704838 0.572032 0.080766
C -0.884075 -0.848045 0.219583
C 1.620225 -1.593782 0.000629
C 0.533312 1.299876 0.271990
C -3.352205 -0.592940 0.065751
C -4.757365 -1.189585 0.020747
C 2.850821 1.929329 0.595550
C 0.214140 -1.853830 0.371596
C 4.207486 1.725882 0.608436
C -2.196198 -1.381578 0.211523
C -1.883319 1.368686 -0.149882
C -3.186209 0.818320 -0.110206
C -4.877856 -2.551986 0.738660
C -5.232131 -1.300942 -1.459091
C -4.511306 2.898747 0.261083
H 4.338071 -2.399799 0.524950
H 3.988316 -2.650216 -1.218161
H 5.528120 -1.899704 -0.701163
H 4.890963 -0.125083 -2.462395
H 3.227531 -0.771802 -2.673961
H 3.472167 0.940153 -2.201999
H 2.135808 -2.546071 -0.163462
H 0.393114 2.357750 0.545935
H -5.432218 -0.465505 0.517213
H 2.451741 2.902474 0.912254
H -2.276500 -2.462598 0.352367
H 4.904595 2.496556 0.953708
H -4.507451 -2.502881 1.778574
H -5.937560 -2.864940 0.765383
H -4.315027 -3.344785 0.212267
H -4.580109 -1.991907 -2.025196
H -6.265134 -1.692884 -1.497635
H -5.216347 -0.314913 -1.953712
H -0.916259 2.945112 -0.876046
H -4.260843 2.877352 1.337969
H -5.577663 3.135239 0.125898
H -3.874654 3.633177 -0.253487


