%chk=000198411.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198411

0 1
O 0.086267 -1.945772 -0.000077
C -1.245046 0.093371 -0.000026
C 1.246908 0.098497 -0.000209
C -2.551500 -0.673185 0.000132
C 2.549235 -0.679183 -0.000287
C 0.001265 -0.569641 -0.000126
C -1.225339 1.501787 -0.000006
C 1.221766 1.503231 -0.000183
C -0.004520 2.186085 -0.000090
C -2.687421 -1.530258 1.268698
C -2.687797 -1.530235 -1.268417
C 2.666815 -1.537320 -1.268239
C 2.666887 -1.537425 1.267585
C -2.489419 2.305435 0.000126
C 2.483193 2.309660 -0.000259
H -3.407329 0.050260 0.000254
H 3.410207 0.036835 -0.000284
H -0.003971 3.273282 -0.000070
H -2.578464 -0.912720 2.168683
H -3.663841 -2.022072 1.316536
H -1.917579 -2.311636 1.324963
H -1.918061 -2.311713 -1.324857
H -3.664283 -2.021939 -1.316038
H -2.578974 -0.912705 -2.168424
H 1.871642 -2.295404 -1.303301
H 3.625249 -2.061587 -1.307121
H 2.573997 -0.925549 -2.170493
H 2.574150 -0.925726 2.169897
H 3.625308 -2.061724 1.306354
H 1.871691 -2.295485 1.302643
H -3.100194 2.088887 -0.887861
H -3.099745 2.089252 0.888512
H -2.300137 3.387025 -0.000147
H 3.095458 2.090584 0.886708
H 3.094986 2.091102 -0.887679
H 2.293899 3.390705 0.000110
H -0.816301 -2.379220 -0.000106


%chk=000198411-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000198411

0 1
O 0.081474 -2.011416 -0.000121
C -1.246540 0.071372 0.000027
C 1.267542 0.079559 -0.000190
C -2.576946 -0.701681 0.000121
C 2.594478 -0.690173 -0.000343
C 0.013946 -0.594547 -0.000090
C -1.239520 1.497483 0.000046
C 1.242733 1.504167 -0.000147
C -0.001527 2.180048 -0.000033
C -2.812063 -1.537855 1.293443
C -2.812172 -1.537979 -1.293101
C 2.787340 -1.545165 -1.283867
C 2.787590 -1.545251 1.283083
C -2.524642 2.315852 0.000161
C 2.520507 2.332812 -0.000229
H -3.377332 0.058402 0.000123
H 3.405128 0.061926 -0.000400
H -0.004592 3.276801 -0.000007
H -2.685794 -0.906038 2.190472
H -3.838790 -1.948870 1.299630
H -2.119680 -2.394405 1.407015
H -2.119796 -2.394540 -1.406644
H -3.838899 -1.948997 -1.299161
H -2.685978 -0.906250 -2.190203
H 2.030276 -2.344000 -1.339209
H 3.790957 -2.011779 -1.281259
H 2.701503 -0.921193 -2.192870
H 2.701928 -0.921343 2.192147
H 3.791208 -2.011864 1.280248
H 2.030538 -2.344091 1.338516
H -3.150026 2.113754 -0.890573
H -3.149867 2.113753 0.891009
H -2.290681 3.393945 0.000141
H 3.146470 2.130358 0.889319
H 3.146287 2.130462 -0.889931
H 2.280246 3.409760 -0.000141
H -0.826302 -2.397517 -0.000082


