%chk=000299450.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299450

0 1
O 4.258690 0.652859 -1.843750
O 1.999353 3.014704 0.885741
O -4.634429 0.420368 1.382622
O -1.605020 2.583581 -0.396908
C 3.085824 0.865753 0.317492
C -3.104686 0.712958 -0.426878
C 2.163918 0.099314 1.297936
C -2.072340 0.005509 -1.340465
C 1.086633 -0.728557 0.650612
C -1.015103 -0.777052 -0.613008
C 0.053149 -0.080500 -0.036276
C 3.409305 -0.024659 -0.907619
C 2.389232 2.152711 -0.193319
C -3.775845 -0.333513 0.498254
C -2.432694 1.779099 0.473507
C 4.388005 1.242540 1.045636
C -4.168750 1.390840 -1.301864
C 1.060067 -2.134705 0.743854
C -1.041426 -2.183217 -0.514235
C -0.002646 -2.839902 0.159960
C 2.132975 -2.912822 1.439349
C -2.144134 -3.003092 -1.106883
H 2.783330 -0.541473 1.962978
H 1.684876 0.845704 1.973769
H -2.605335 -0.644832 -2.065033
H -1.581836 0.796329 -1.956981
H 0.080068 1.015607 -0.135353
H 3.876073 -0.977000 -0.606214
H 2.506383 -0.240256 -1.513664
H 3.031345 2.705555 -0.900566
H 1.413796 1.928613 -0.679035
H -4.388735 -1.047263 -0.075885
H -3.034876 -0.881096 1.107334
H -3.189718 2.428363 0.949350
H -1.797633 1.321856 1.251273
H 4.183612 1.818059 1.955994
H 5.042341 1.851747 0.411984
H 4.953891 0.355035 1.349171
H -4.594829 0.713132 -2.045049
H -4.995942 1.763661 -0.681698
H -3.739233 2.251831 -1.831774
H -0.020064 -3.926273 0.231662
H 1.709970 -3.613671 2.171910
H 2.717970 -3.503392 0.720642
H 2.838464 -2.265165 1.982382
H -2.760926 -2.426747 -1.813416
H -1.751537 -3.868179 -1.658896
H -2.811793 -3.389804 -0.325394
H 5.138350 0.816726 -1.451681
H 2.787263 3.355223 1.351519
H -5.108460 -0.186774 1.978886
H -1.095991 3.226168 0.136429


%chk=000299450-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000299450

0 1
O 4.889553 0.705401 -1.406393
O 1.318448 2.683131 0.186156
O -4.582498 0.835425 1.711728
O -1.466322 2.710353 -0.533357
C 3.068042 0.850758 0.347800
C -3.116252 0.864802 -0.250012
C 2.162653 -0.064550 1.252853
C -2.241536 -0.036927 -1.193974
C 1.088275 -0.908580 0.570037
C -1.133850 -0.886486 -0.575024
C -0.039296 -0.240345 0.041624
C 3.929081 -0.049732 -0.583063
C 2.250370 1.803745 -0.564270
C -3.768615 -0.023872 0.829588
C -2.284421 1.985082 0.448309
C 3.986939 1.678862 1.284778
C -4.207066 1.539622 -1.121907
C 1.123839 -2.331225 0.491685
C -1.105490 -2.312619 -0.641355
C 0.020254 -2.991424 -0.107826
C 2.281608 -3.150876 1.041798
C -2.232789 -3.115859 -1.272405
H 2.841635 -0.705168 1.847565
H 1.659863 0.612327 1.970957
H -2.935397 -0.680136 -1.765232
H -1.783164 0.663829 -1.918142
H -0.059853 0.846085 0.112109
H 4.452435 -0.813396 0.031848
H 3.286686 -0.568659 -1.314846
H 2.943315 2.411103 -1.177645
H 1.605311 1.228578 -1.245436
H -4.408339 -0.788971 0.334917
H -2.979765 -0.543800 1.414356
H -2.990004 2.695289 0.916427
H -1.662211 1.548437 1.255549
H 3.390486 2.230344 2.034970
H 4.590360 2.418319 0.723670
H 4.679129 1.022559 1.846121
H -4.769812 0.791080 -1.712790
H -4.923527 2.082830 -0.482067
H -3.738435 2.256993 -1.818739
H 0.039086 -4.088121 -0.162021
H 2.114736 -4.228131 0.870615
H 3.242996 -2.883706 0.563141
H 2.410451 -3.004199 2.131643
H -2.347011 -2.887868 -2.349380
H -2.043370 -4.199161 -1.179830
H -3.207996 -2.903285 -0.794454
H 5.638759 1.007824 -0.834732
H 1.806207 3.454873 0.561432
H -4.979527 0.284175 2.430555
H -0.513069 2.779172 -0.238929


