%chk=000102046.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102046

0 1
 O   -5.078000      0.4202000     -0.4193000    
 O   -4.528700      -2.419000     -3.0099999E-02
 O    5.863200      0.6591000     -0.5702000    
 O   -5.501900       2.360200      0.7615000    
 O    5.996800     -0.3449000       1.540100    
 C   -2.001300     -5.7799999E-02  0.1159000    
 C   -2.302500      -1.543400      0.4080000    
 C  -0.5170000      0.2528000      0.3054000    
 C   0.2947000     -0.5893000     -0.7274000    
 C   -1.577000      -2.381900     -0.6390000    
 C   -3.049200      0.7057000      0.9242000    
 C  -6.2500000E-02  -2.098200     -0.6329000    
 C  -0.1891000       1.733200      0.1058000    
 C   -3.815100      -1.481500      0.3012000    
 C   -4.335200     -9.7099997E-02  0.6616000    
 C   -1.981000      -2.033700       1.831500    
 C    1.785300     -0.2710000     -0.6513000    
 C    1.277800       1.988700      0.4395000    
 C    2.227900      0.9677000     -0.1376000    
 C    2.746400      -1.157700      -1.168700    
 C    3.602500       1.261900     -0.1061000    
 C    4.108100     -0.8491000      -1.139100    
 C    4.537000      0.3585000     -0.6038000    
 C   -5.615300       1.671000     -0.2432000    
 C   -6.372900       2.089400      -1.466800    
 C    6.518000      0.2400000      0.6000000    
 C    7.968900      0.6161000      0.5404000    
 H   -2.237000      0.1495000     -0.9424000    
 H  -0.2120000     -1.8800000E-02   1.324400    
 H  -1.2600000E-02 -0.2646000      -1.733800    
 H   -1.978500      -2.167300      -1.638200    
 H   -1.751800      -3.451400     -0.4696000    
 H   -3.101600       1.746900      0.5965000    
 H   -2.796800      0.6985000       1.990300    
 H   0.3893000      -2.526900      0.2701000    
 H   0.3704000      -2.643400      -1.479600    
 H  -0.8102000       2.368500      0.7467000    
 H  -0.3937000       2.027800     -0.9315000    
 H   -4.954400     -0.1673000       1.562800    
 H   -2.278500      -3.083300       1.945800    
 H  -0.9164000      -1.970800       2.072000    
 H   -2.525300      -1.474900       2.600100    
 H    1.401600       1.982900       1.530200    
 H    1.548100       2.990300      8.3600000E-02
 H    2.455800      -2.105000      -1.612800    
 H    3.942900       2.208100      0.3100000    
 H    4.826500      -1.558300      -1.541600    
 H   -7.191600       1.389600      -1.652100    
 H   -5.696900       2.127600      -2.324600    
 H   -6.794500       3.086300      -1.309800    
 H    8.441400      0.1287000     -0.3159000    
 H    8.468600      0.2802000       1.453400    
 H    8.065600       1.702200      0.4679000    


%chk=000102046-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000102046

0 1
O -5.046797 1.014107 -0.462735
O -4.692140 -1.878167 -0.642205
O 6.151855 -0.081749 -0.225585
O -7.002231 0.851697 0.812309
O 6.492385 1.980064 0.867259
C -1.905718 0.158673 0.102195
C -2.401168 -1.320929 0.201526
C -0.407636 0.286372 0.421022
C 0.379820 -0.580631 -0.614555
C -1.650619 -2.183162 -0.832296
C -2.961239 0.972114 0.900353
C -0.114053 -2.058940 -0.636511
C 0.116263 1.737703 0.372769
C -3.903533 -1.120055 -0.037530
C -4.298792 0.261744 0.577077
C -2.277043 -1.935306 1.633163
C 1.899926 -0.429969 -0.439488
C 1.582076 1.787048 0.846460
C 2.458526 0.707793 0.212983
C 2.794476 -1.391851 -0.980923
C 3.864899 0.865018 0.310909
C 4.190010 -1.246396 -0.889109
C 4.719441 -0.110232 -0.241494
C -6.427556 1.193371 -0.242823
C -7.065815 1.829812 -1.455040
C 6.940851 0.952079 0.319236
C 8.400916 0.602106 0.130326
H -2.031443 0.452669 -0.965846
H -0.212819 -0.106915 1.442288
H 0.125971 -0.152912 -1.613490
H -1.922736 -1.843694 -1.851640
H -1.958087 -3.242961 -0.758361
H -3.006505 2.031545 0.599022
H -2.761215 0.940513 1.987308
H 0.201681 -2.563602 0.297693
H 0.376056 -2.606682 -1.462683
H -0.501082 2.397452 1.011699
H 0.035752 2.121069 -0.665187
H -4.972653 0.127484 1.444939
H -2.754506 -2.931688 1.645389
H -1.221546 -2.062336 1.925100
H -2.766126 -1.317558 2.407380
H 1.607740 1.658760 1.949065
H 2.020918 2.782863 0.646162
H 2.400745 -2.275841 -1.491805
H 4.281079 1.743526 0.807140
H 4.873136 -1.989407 -1.310877
H -7.262982 1.046127 -2.209120
H -6.392309 2.572234 -1.911369
H -8.021745 2.294671 -1.172327
H 8.639567 -0.330928 0.670175
H 9.027573 1.421135 0.511085
H 8.616732 0.427161 -0.937539


