%chk=000031283.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031283

0 1
 O    6.377800      0.6722000     -0.3573000    
 O    5.187400      4.9699999E-02   1.517000    
 C   -2.374800     -7.7999998E-03 -0.2373000    
 C   -1.264300      -1.018700      5.7700001E-02
 C   -3.747600     -0.5662000      0.1442000    
 C   0.1123000     -0.4509000     -0.2925000    
 C   -4.895100      0.4177000     -0.1017000    
 C    1.219400      -1.474200     -2.8200001E-02
 C   -6.274900     -0.1657000      0.2104000    
 C    2.591200     -0.9171000     -0.4099000    
 C   -7.386300      0.8327000     -0.1211000    
 C    3.756300      -1.878600     -0.1439000    
 C   -8.763900      0.2650000      0.2200000    
 C    5.133200      -1.313000     -0.4950000    
 C   -9.868400       1.266700     -7.6499999E-02
 C    5.537400     -0.1315000      0.3588000    
 C    6.875100       1.819200      0.3392000    
 C    7.785200       2.600700     -0.5841000    
 H   -2.366700      0.2511000      -1.302800    
 H   -2.189400      0.9169000      0.3222000    
 H   -1.287300      -1.292900       1.119400    
 H   -1.442400      -1.935600     -0.5173000    
 H   -3.932900      -1.483400     -0.4287000    
 H   -3.744300     -0.8505000       1.203800    
 H   0.2984000      0.4546000      0.2977000    
 H   0.1292000     -0.1576000      -1.349300    
 H   -4.734200       1.317200      0.5053000    
 H   -4.869300      0.7359000      -1.151400    
 H    1.025200      -2.388200     -0.6023000    
 H    1.218500      -1.751700       1.032700    
 H   -6.424500      -1.085400     -0.3679000    
 H   -6.323300     -0.4387000       1.271400    
 H    2.588600     -0.6519000      -1.474600    
 H    2.756700      1.5200000E-02  0.1433000    
 H   -7.223500       1.761100      0.4401000    
 H   -7.347100       1.088400      -1.187000    
 H    3.742500      -2.171400      0.9134000    
 H    3.597500      -2.794700     -0.7258000    
 H   -8.802600     -7.1000000E-03   1.281300    
 H   -8.942300     -0.6503000     -0.3563000    
 H    5.897000      -2.087700     -0.3667000    
 H    5.130900      -1.009900      -1.548600    
 H   -9.737200       2.181000      0.5110000    
 H   -9.877700       1.537700      -1.137000    
 H   -10.84460      0.8396000      0.1735000    
 H    7.435000       1.495100       1.223500    
 H    6.034900       2.449500      0.6512000    
 H    8.621000       1.977700     -0.9193000    
 H    7.244000       2.916300      -1.482200    
 H    8.184000       3.486700     -8.2400002E-02


%chk=000031283-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000031283

0 1
O 6.638609 0.649105 -0.324280
O 5.211236 0.197590 1.459845
C -2.473953 -0.021215 -0.319760
C -1.300779 -0.966489 0.023810
C -3.849433 -0.564613 0.128405
C 0.076945 -0.419857 -0.413060
C -5.024591 0.377662 -0.216669
C 1.246733 -1.371648 -0.076176
C -6.398737 -0.165402 0.236474
C 2.626659 -0.815680 -0.492011
C -7.575362 0.775497 -0.107718
C 3.784919 -1.784898 -0.165092
C -8.948694 0.231070 0.347561
C 5.172737 -1.240737 -0.563559
C -10.118776 1.177623 0.002284
C 5.630659 -0.082888 0.312672
C 7.218699 1.786464 0.456311
C 8.248920 2.459153 -0.444904
H -2.490393 0.159376 -1.415220
H -2.298477 0.967143 0.154732
H -1.289311 -1.152708 1.118247
H -1.473116 -1.952727 -0.456538
H -4.023574 -1.554555 -0.343467
H -3.832724 -0.742587 1.224230
H 0.252980 0.561675 0.074789
H 0.064614 -0.225607 -1.506278
H -4.849502 1.368354 0.253135
H -5.043544 0.553622 -1.312816
H 1.077100 -2.349955 -0.573953
H 1.251280 -1.573987 1.015086
H -6.573548 -1.156510 -0.232762
H -6.379286 -0.340941 1.332713
H 2.622321 -0.598210 -1.581080
H 2.801299 0.147959 0.026690
H -7.402058 1.767039 0.361042
H -7.597354 0.950792 -1.203963
H 3.783088 -2.000736 0.920567
H 3.617762 -2.747077 -0.688883
H -8.925035 0.054124 1.442461
H -9.121408 -0.758851 -0.122592
H 5.939934 -2.036326 -0.470575
H 5.196708 -0.914399 -1.619503
H -9.988172 2.162892 0.488704
H -10.180167 1.349334 -1.089133
H -11.088546 0.762877 0.334214
H 7.665620 1.379294 1.381742
H 6.395932 2.465505 0.744532
H 9.045572 1.751057 -0.730420
H 7.776621 2.840739 -1.366213
H 8.713691 3.309856 0.086379


