%chk=000013108.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013108

0 1
 O   -2.349000      0.2751000      -1.816000    
 O    6.203300      0.2864000      0.2821000    
 C   -2.253000      0.3655000      0.6526000    
 C   -1.387600     -0.9243000      0.7384000    
 C  -4.3900002E-02 -0.8970000     -3.6800001E-02
 C   -3.118000      0.1161000     -0.6224000    
 C   0.7514000      0.4047000      0.2117000    
 C   -1.412400       1.657800      0.6286000    
 C   -2.316200      -2.042400      0.2094000    
 C  -0.1151000       1.611800     -0.1690000    
 C   -3.481300      -1.370000     -0.5240000    
 C    2.115000      0.4122000     -0.5532000    
 C   -3.152200      0.4445000       1.918900    
 C   0.8245000      -2.109800      0.3553000    
 C   -4.368000      0.9844000     -0.7699000    
 C    2.113500      -2.150200     -0.4532000    
 C    2.895700     -0.8713000     -0.3159000    
 C    2.940600       1.659600     -0.1702000    
 C   -2.304700      0.5772000       3.157100    
 C   -5.165100      0.5982000      -1.999900    
 C    4.388700       1.567000     -0.6190000    
 C    4.208700     -0.9151000     -3.9900001E-02
 C    5.025100      0.3197000     -6.4900003E-02
 H   -1.133700      -1.196900       1.765000    
 H  -0.2520000     -0.9713000      -1.112700    
 H   0.9666000      0.4681000       1.289000    
 H   -1.106800       1.969200       1.631000    
 H   -2.025600       2.486800      0.2535000    
 H   -2.705200      -2.640000       1.042600    
 H   -1.804700      -2.736500     -0.4647000    
 H  -0.3265000       1.600200      -1.243800    
 H   0.4188000       2.548400      2.3700001E-02
 H   -3.629000      -1.849000      -1.498500    
 H   -4.398400      -1.523200      5.7700001E-02
 H    1.906800      0.4608000      -1.631700    
 H   -3.776900     -0.4503000       2.015400    
 H   -3.831000       1.303600       1.872300    
 H   0.2840000      -3.047900      0.1902000    
 H    1.062900      -2.069700       1.426500    
 H   -4.085200       2.039400     -0.8609000    
 H   -5.028500      0.8926000      9.8099999E-02
 H    1.875700      -2.303300      -1.513500    
 H    2.705000      -3.017600     -0.1362000    
 H    2.916000       1.798500      0.9192000    
 H    2.500100       2.557700     -0.6168000    
 H   -2.767000     -0.2173000      -2.541200    
 H   -1.307100      0.1386000       3.140300    
 H   -2.185900       1.633000       3.429600    
 H   -2.834500      0.1236000       4.003700    
 H   -4.608300      0.7645000      -2.926800    
 H   -5.502100     -0.4418000      -1.973300    
 H   -6.064600       1.221600      -2.058800    
 H    4.941000       2.438200     -0.2504000    
 H    4.467200       1.544800      -1.711200    
 H    4.731200      -1.848400      0.1390000    


%chk=000013108-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000013108

0 1
O -2.292184 0.223463 -1.793907
O 6.396615 0.319137 0.058713
C -2.248212 0.349515 0.651189
C -1.362799 -0.946465 0.755390
C -0.008700 -0.917817 -0.017045
C -3.169770 0.053072 -0.596717
C 0.766460 0.409319 0.193581
C -1.434670 1.670978 0.525839
C -2.288533 -2.109747 0.251539
C -0.114018 1.591990 -0.269486
C -3.517433 -1.453350 -0.446477
C 2.155787 0.422621 -0.540161
C -3.181360 0.478554 1.915596
C 0.865864 -2.117178 0.413933
C -4.407678 0.972633 -0.752650
C 2.183147 -2.165607 -0.393201
C 2.952939 -0.861936 -0.313792
C 2.984189 1.675976 -0.148325
C -2.491458 0.435919 3.298387
C -5.216197 0.733273 -2.048833
C 4.441344 1.618141 -0.652299
C 4.308018 -0.861090 -0.093102
C 5.149593 0.347872 -0.181884
H -1.098322 -1.109463 1.818602
H -0.234582 -1.003948 -1.100042
H 0.967890 0.516417 1.285395
H -1.192548 2.027379 1.547132
H -2.082507 2.450308 0.077090
H -2.613730 -2.758567 1.085234
H -1.736178 -2.754439 -0.455630
H -0.336343 1.469497 -1.344656
H 0.422417 2.551304 -0.140061
H -3.730793 -1.914858 -1.428828
H -4.431404 -1.574505 0.164084
H 1.931120 0.472725 -1.632751
H -3.954811 -0.314474 1.898799
H -3.723925 1.441468 1.832487
H 0.319160 -3.070018 0.277776
H 1.097130 -2.031177 1.496191
H -4.072672 2.028215 -0.728775
H -5.079499 0.827586 0.113274
H 1.925056 -2.353367 -1.458759
H 2.822418 -3.006726 -0.067222
H 2.987477 1.760434 0.957664
H 2.499270 2.588138 -0.539373
H -2.807383 -0.074433 -2.586611
H -2.099673 -0.567953 3.541176
H -1.650845 1.150022 3.370300
H -3.217699 0.701896 4.088899
H -4.629239 0.981515 -2.953836
H -5.558702 -0.315007 -2.130270
H -6.113716 1.377197 -2.067051
H 5.026268 2.494816 -0.322646
H 4.456977 1.617779 -1.762886
H 4.840740 -1.800533 0.105108


