%chk=000111282.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000111282

0 1
 O   -2.807400      3.9999999E-04 -0.8851000    
 O    2.793300       0.000000      0.8890000    
 O   -2.145000     -3.4000000E-03   1.358600    
 O    2.165900     -2.9000000E-03  -1.365600    
 C   -4.107000      8.9999998E-04 -0.4805000    
 C    4.127600      6.9999998E-04  0.4741000    
 C   -4.771800       1.209000     -0.2711000    
 C    4.757800       1.209000      0.2759000    
 C   -4.774000      -1.206800     -0.2753000    
 C    4.760200      -1.206900      0.2795000    
 C   -6.103600       1.209600      0.1434000    
 C    6.089700       1.209700     -0.1383000    
 C   -6.105800      -1.206300      0.1392000    
 C    6.092200      -1.206200     -0.1347000    
 C   -6.770700      1.9000000E-03  0.3485000    
 C    6.757000      2.0999999E-03 -0.3436000    
 C   -1.882200     -2.4000001E-03  0.1659000    
 C    1.902900     -2.6000000E-03 -0.1729000    
 C  -0.5189000     -2.7000001E-03 -0.4126000    
 C   0.5396000     -3.1000001E-03  0.4055000    
 H   -4.258300       2.153600     -0.4296000    
 H    4.238800       2.148700      0.4364000    
 H   -4.262300      -2.151700     -0.4371000    
 H    4.243100      -2.147300      0.4429000    
 H   -6.621200       2.150400      0.3063000    
 H    6.607300       2.150600     -0.3009000    
 H   -6.625300      -2.146600      0.2989000    
 H    6.611600      -2.146400     -0.2944000    
 H   -7.807800      2.3000001E-03  0.6712000    
 H    7.794100      2.7000001E-03 -0.6661000    
 H  -0.4229000     -2.0999999E-03  -1.492800    
 H   0.4402000     -3.4000000E-03   1.485700    


%chk=000111282-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000111282

0 1
O -2.900145 0.001188 -0.734496
O 2.896734 0.000773 0.736769
O -2.155097 0.001018 1.500948
O 2.150001 0.001256 -1.497925
C -4.285262 0.000556 -0.342831
C 4.281548 0.000360 0.344145
C -4.950528 1.232483 -0.197141
C 4.946742 1.232317 0.198410
C -4.949112 -1.231974 -0.195768
C 4.945540 -1.232005 0.196346
C -6.330664 1.224552 0.106864
C 6.326622 1.224641 -0.106423
C -6.329255 -1.225290 0.108239
C 6.325424 -1.225158 -0.108482
C -7.020647 -0.000680 0.260165
C 7.016689 -0.000467 -0.260356
C -1.907912 0.001819 0.277351
C 1.903864 0.001567 -0.273901
C -0.571737 0.001648 -0.370213
C 0.567890 0.001450 0.374090
H -4.398858 2.169197 -0.321975
H 4.394852 2.168899 0.323610
H -4.396368 -2.168194 -0.319551
H 4.392737 -2.168260 0.319965
H -6.863483 2.174305 0.223401
H 6.859173 2.174524 -0.223052
H -6.860978 -2.175525 0.225841
H 6.857052 -2.175361 -0.226709
H -8.090229 -0.001162 0.495252
H 8.086138 -0.000792 -0.496065
H -0.534034 0.001800 -1.464635
H 0.530402 0.001314 1.468529


