%chk=000185209.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185209

0 1
O -3.065636 0.628651 1.834593
O -1.230463 -1.860993 -0.128012
O 3.567556 1.793935 -0.061653
C -3.660172 0.236329 -0.470024
C -2.670684 0.437834 0.706492
C -2.970577 0.387188 -1.829515
C -4.767032 1.291161 -0.321828
C -4.232086 -1.179847 -0.309369
C -1.197066 0.428469 0.419030
C -0.503426 -0.704491 0.036171
C 0.917794 -0.691261 -0.194534
C 1.594010 0.536630 -0.019814
C -0.476975 1.644240 0.599139
C 0.877598 1.702654 0.380055
C 3.022828 0.546804 -0.257577
C 1.639276 -1.862837 -0.587308
C 3.708978 -0.585750 -0.636190
C 2.992958 -1.805011 -0.799423
C 4.997107 1.943336 -0.248814
H -2.438489 1.340731 -1.914738
H -3.699860 0.343740 -2.645985
H -2.242901 -0.415815 -2.002727
H -4.390721 2.304140 -0.495707
H -5.198184 1.270946 0.689597
H -5.581905 1.113925 -1.030729
H -4.756889 -1.293486 0.647511
H -4.942991 -1.414070 -1.107390
H -3.434973 -1.936630 -0.340341
H -1.029008 2.527757 0.925687
H 1.435460 2.631347 0.513218
H 1.090155 -2.795254 -0.711436
H 4.778966 -0.581744 -0.813937
H 3.550016 -2.693389 -1.097968
H -0.642017 -2.639217 -0.330719
H 5.269604 1.721213 -1.284453
H 5.541094 1.315472 0.462807
H 5.139655 3.008597 -0.023007


%chk=000185209-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000185209

0 1
O -3.025308 1.113946 1.668715
O -1.219492 -1.804695 -0.368324
O 3.726757 1.804867 0.158909
C -3.744569 0.186519 -0.471754
C -2.664564 0.595911 0.570353
C -3.195788 0.072904 -1.915526
C -4.857229 1.275561 -0.434727
C -4.360154 -1.171179 -0.009947
C -1.176146 0.508432 0.302299
C -0.481048 -0.627337 -0.145459
C 0.950765 -0.619802 -0.335005
C 1.675087 0.586075 -0.008602
C -0.413163 1.677871 0.638382
C 0.969295 1.727358 0.485198
C 3.108535 0.597180 -0.183952
C 1.667484 -1.757811 -0.839752
C 3.789351 -0.530119 -0.662453
C 3.053040 -1.706633 -0.993458
C 5.181975 1.892068 0.013310
H -2.696113 1.007453 -2.231691
H -4.038961 -0.108670 -2.608178
H -2.484701 -0.761603 -2.020011
H -4.479359 2.247370 -0.803790
H -5.227904 1.419679 0.593285
H -5.697803 0.964200 -1.081836
H -4.792453 -1.072116 1.001737
H -5.166380 -1.462065 -0.709483
H -3.597880 -1.967257 0.001813
H -0.961082 2.535941 1.039722
H 1.533782 2.626581 0.741095
H 1.147679 -2.675161 -1.144545
H 4.874669 -0.524587 -0.794152
H 3.591147 -2.576189 -1.385300
H -0.621010 -2.585264 -0.470378
H 5.487906 1.740901 -1.039923
H 5.693369 1.153674 0.660485
H 5.441264 2.911301 0.334044


