%chk=000089292.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089292

0 1
 O   -1.870100      -1.672100      0.9213000    
 O   -4.427500     -0.7168000      0.4745000    
 C    1.644900      0.8380000      1.3100000E-02
 C    3.008200      0.3490000      0.6268000    
 C    2.066800      -1.005000      -1.170500    
 C    3.251700     -0.9803000     -0.1682000    
 C    1.831500      0.4721000      -1.468500    
 C   0.4617000     -9.4400004E-02  0.4117000    
 C   0.7706000      -1.367000     -0.4181000    
 C    2.950100      7.7600002E-02   2.140300    
 C    4.084800       1.437500      0.4190000    
 C    4.593800      -1.098700     -0.8876000    
 C  -0.9542000      0.4066000      0.1731000    
 C   -2.052300     -0.4090000      0.4404000    
 C   -1.143700       1.697500     -0.3171000    
 C   -3.344000      6.7900002E-02  0.2167000    
 C   -2.435200       2.174300     -0.5411000    
 C   -3.535400       1.359400     -0.2741000    
 C   -4.901900      -1.536800     -0.5916000    
 H    1.489300       1.899300      0.2146000    
 H    2.237400      -1.634900      -2.046900    
 H    3.175000      -1.849000      0.4987000    
 H    2.681400      0.9592000      -1.952200    
 H   0.9416000      0.6465000      -2.082000    
 H   0.5102000     -0.3057000       1.483900    
 H   0.9061000      -2.248000      0.2184000    
 H  -1.6700000E-02  -1.593900      -1.147000    
 H    3.950800     -0.1338000       2.535400    
 H    2.552400      0.9446000       2.679000    
 H    2.333700     -0.7908000       2.391800    
 H    5.058900       1.113200      0.8014000    
 H    4.217700       1.715100     -0.6300000    
 H    3.813600       2.352800      0.9585000    
 H    4.661400      -2.064200      -1.401200    
 H    4.734100     -0.3203000      -1.643400    
 H    5.423300      -1.048100     -0.1754000    
 H  -0.3302000       2.372300     -0.5526000    
 H   -2.585100       3.179100     -0.9253000    
 H   -4.538700       1.737700     -0.4504000    
 H   -1.006900      -1.751100       1.355600    
 H   -5.225400     -0.9190000      -1.435400    
 H   -5.759800      -2.109100     -0.2282000    
 H   -4.125300      -2.237300     -0.9147000    


%chk=000089292-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000089292

0 1
O -2.007188 -1.539717 0.824594
O -4.608687 -0.416552 0.356858
C 1.642273 0.853514 0.025320
C 2.963597 0.279196 0.677749
C 2.096485 -0.946781 -1.286778
C 3.257984 -0.999523 -0.240153
C 1.890398 0.580337 -1.487558
C 0.418570 -0.071175 0.309582
C 0.761531 -1.343055 -0.589278
C 2.819558 -0.122667 2.167783
C 4.060444 1.376507 0.605828
C 4.650685 -1.070491 -0.900571
C -0.952912 0.537097 -0.009513
C -2.112409 -0.242781 0.270166
C -1.136374 1.845875 -0.518214
C -3.420949 0.265548 0.036057
C -2.430398 2.368284 -0.735221
C -3.566431 1.579870 -0.462166
C -4.754576 -1.816719 -0.089452
H 1.472597 1.902560 0.320234
H 2.301517 -1.536067 -2.197300
H 3.143628 -1.911087 0.382016
H 2.775711 1.094347 -1.897835
H 1.019237 0.818931 -2.121790
H 0.413108 -0.346062 1.383844
H 0.884035 -2.273228 0.002496
H -0.034275 -1.516161 -1.336871
H 3.805043 -0.414913 2.577981
H 2.440266 0.719288 2.778344
H 2.143224 -0.984175 2.315496
H 5.042914 0.986926 0.927789
H 4.182238 1.792465 -0.409460
H 3.796909 2.212964 1.280968
H 4.747521 -2.006617 -1.482187
H 4.827891 -0.227737 -1.593374
H 5.461903 -1.062302 -0.149644
H -0.264235 2.466848 -0.741648
H -2.553653 3.384758 -1.123387
H -4.582272 1.953803 -0.622492
H -1.055957 -1.803789 0.892251
H -4.645328 -1.885418 -1.189672
H -5.778843 -2.097254 0.200797
H -4.016180 -2.470447 0.401107


