%chk=000188316.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188316

0 1
O 0.379681 0.252156 0.173938
O -1.549649 2.173163 0.561226
O -4.341006 1.317467 0.387684
O -3.090474 -3.096157 -0.281247
O -0.544535 -3.701181 -0.413158
C -1.290082 -1.501397 -0.070892
C -0.945574 -0.155384 0.134254
C -1.901211 0.862187 0.276071
C 1.383642 -0.704258 -0.017061
C -2.676355 -1.834073 -0.101102
C -0.256573 -2.515766 -0.246209
C -3.276923 0.489806 0.241164
C 1.116695 -2.010006 -0.218769
C -3.658272 -0.848903 0.054309
C 2.686277 -0.020119 0.032230
C 3.852008 -0.744929 0.331284
C 2.765615 1.361668 -0.219748
C 5.086225 -0.090975 0.364174
C 4.001828 2.007158 -0.184934
C 5.163030 1.281227 0.104826
C -0.774067 2.816617 -0.488358
C -4.111556 2.732779 0.638983
H 1.902390 -2.749168 -0.380334
H -4.714217 -1.119056 0.034652
H 3.796666 -1.813811 0.542824
H 1.847601 1.925273 -0.434224
H 5.990851 -0.653622 0.594721
H 4.063378 3.077018 -0.381360
H -2.284770 -3.765620 -0.385802
H 6.128512 1.786921 0.130760
H -1.271954 2.725198 -1.455217
H 0.236332 2.378133 -0.514283
H -0.742750 3.855394 -0.143790
H -3.467889 2.863181 1.517508
H -5.132206 3.089694 0.820603
H -3.664967 3.194788 -0.245225


%chk=000188316-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188316

0 1
O 0.394347 0.312623 0.091818
O -1.551480 2.290902 0.181348
O -4.388351 1.394247 0.177792
O -3.032124 -3.167967 -0.085167
O -0.522096 -3.753066 -0.105421
C -1.284597 -1.473015 0.004685
C -0.954345 -0.096057 0.080106
C -1.926513 0.928972 0.114551
C 1.420769 -0.645106 0.061638
C -2.675227 -1.841372 -0.014762
C -0.234492 -2.484827 -0.039515
C -3.300938 0.527574 0.130928
C 1.133718 -1.994292 0.002399
C -3.659963 -0.843358 0.056824
C 2.758354 -0.020217 0.110837
C 3.924563 -0.772652 -0.201291
C 2.897432 1.348074 0.476263
C 5.197638 -0.172918 -0.140517
C 4.174024 1.943497 0.534186
C 5.329141 1.187291 0.228214
C -0.984432 2.832225 -1.076647
C -4.268423 2.753504 0.745908
H 1.936837 -2.733071 0.006489
H -4.717746 -1.113915 0.066436
H 3.840029 -1.819897 -0.509184
H 2.003166 1.926996 0.724403
H 6.086910 -0.762736 -0.386874
H 4.268665 2.995674 0.823341
H -2.152300 -3.717571 -0.111769
H 6.320351 1.651224 0.274178
H -1.708223 2.729700 -1.907861
H -0.041239 2.317832 -1.333094
H -0.788130 3.896409 -0.873878
H -3.683154 2.743083 1.680517
H -5.309827 3.052489 0.942639
H -3.796642 3.445123 0.029976


