%chk=000051145.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051145

0 1
 O  -0.8141000      -2.894200      0.2200000    
 O   -1.359200      -5.477900       1.141600    
 C  -6.4300001E-02  -1.969300     -0.5692000    
 C   -1.006800     -0.8895000      -1.121100    
 C    1.122100      -1.462200      0.2607000    
 C   -1.643900      9.8999999E-03 -5.4600000E-02
 C    2.071300     -0.5549000     -0.5225000    
 C   -2.631400      0.9956000     -0.6863000    
 C    3.219900     -6.1000001E-02  0.3599000    
 C   -3.326500       1.899900      0.3359000    
 C    4.153900      0.8716000     -0.4132000    
 C   -4.262100       2.965100     -0.2455000    
 C    5.320100       1.339400      0.4590000    
 C   -1.490600      -3.836800     -0.5962000    
 C   -4.912000       3.903000      0.7743000    
 C    6.271300       2.244500     -0.3236000    
 C   -2.268000      -4.791000      0.2898000    
 C   -5.793400       4.968800      0.1420000    
 C    7.413800       2.739100      0.5490000    
 H   0.3664000      -2.504900      -1.427000    
 H   -1.810700      -1.349800      -1.704800    
 H  -0.4564000     -0.2596000      -1.830400    
 H   0.7565000     -0.9495000       1.158700    
 H    1.679200      -2.330500      0.6374000    
 H  -0.8687000      0.5720000      0.4776000    
 H   -2.169200     -0.6052000      0.6852000    
 H    2.473100      -1.098500      -1.385700    
 H    1.528400      0.3146000     -0.9086000    
 H   -3.396100      0.4423000      -1.245300    
 H   -2.098900       1.621600      -1.413000    
 H    2.814700      0.4676000       1.231500    
 H    3.786600     -0.9208000      0.7374000    
 H   -3.896900       1.273500       1.033200    
 H   -2.557800       2.406000      0.9340000    
 H    3.591200       1.741300     -0.7733000    
 H    4.543300      0.3500000      -1.296100    
 H   -5.051200       2.462800     -0.8191000    
 H   -3.694900       3.569200     -0.9650000    
 H    5.870900      0.4693000      0.8367000    
 H    4.931300       1.879000       1.331100    
 H   -5.512900       3.312700       1.476100    
 H   -4.128800       4.395400       1.362800    
 H    5.723100       3.107500     -0.7192000    
 H    6.682200       1.699900      -1.181500    
 H  -0.7529000      -4.404600      -1.175600    
 H   -2.189400      -3.348700      -1.280400    
 H   -2.972200      -4.242600      0.9234000    
 H   -2.811700      -5.525100     -0.3119000    
 H   -5.213700       5.602600     -0.5366000    
 H   -6.231600       5.607900      0.9148000    
 H   -6.609600       4.512700     -0.4270000    
 H    8.001900       1.901400      0.9370000    
 H    7.036900       3.317400       1.398500    
 H    8.081900       3.383500     -3.0900000E-02
 H   -1.886500      -6.078800       1.695200    


%chk=000051145-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000051145

0 1
O -0.876264 -2.829574 0.253515
O -1.019593 -5.539784 0.941745
C -0.106850 -1.911883 -0.624921
C -1.015370 -0.808075 -1.217887
C 1.053035 -1.402033 0.249946
C -1.680746 0.109972 -0.169403
C 2.043217 -0.479773 -0.497550
C -2.753016 1.041788 -0.778518
C 3.286853 -0.132566 0.351293
C -3.374187 2.004868 0.258094
C 4.267075 0.824829 -0.363610
C -4.469990 2.922092 -0.330960
C 5.519706 1.156327 0.478036
C -1.857843 -3.678233 -0.440771
C -5.068839 3.899620 0.706110
C 6.494043 2.126275 -0.229259
C -2.212944 -4.783460 0.557709
C -6.172099 4.804499 0.115743
C 7.747055 2.443939 0.614987
H 0.310467 -2.513516 -1.467211
H -1.802157 -1.288785 -1.834920
H -0.411673 -0.201284 -1.922630
H 0.638365 -0.878896 1.132566
H 1.596170 -2.287109 0.636094
H -0.909171 0.730584 0.329784
H -2.136780 -0.516704 0.622636
H 2.370552 -0.968950 -1.439336
H 1.535625 0.460594 -0.793935
H -3.556982 0.427455 -1.236288
H -2.306140 1.632812 -1.605717
H 2.960701 0.324785 1.308865
H 3.818562 -1.068880 0.620699
H -3.801575 1.414624 1.095512
H -2.570917 2.631405 0.699769
H 3.738087 1.766750 -0.620191
H 4.582821 0.374037 -1.328034
H -5.283760 2.297705 -0.756059
H -4.048736 3.502087 -1.178814
H 6.055868 0.216093 0.725273
H 5.205311 1.597548 1.447259
H -5.480170 3.319229 1.557211
H -4.256246 4.528754 1.123728
H 5.959254 3.068011 -0.469552
H 6.802231 1.688202 -1.200772
H -1.397529 -4.113351 -1.354232
H -2.761948 -3.100534 -0.727984
H -2.698492 -4.331019 1.448382
H -2.905782 -5.510537 0.101207
H -5.779420 5.413561 -0.720466
H -6.580029 5.496524 0.875454
H -7.012033 4.200320 -0.276492
H 8.316418 1.522466 0.840743
H 7.467379 2.908703 1.579462
H 8.425754 3.140137 0.088602
H -0.329666 -4.859946 1.164287


