%chk=000233554.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233554

0 1
O -1.029473 1.583643 1.403469
O -0.956628 2.526800 -0.710631
O 1.815919 -0.290354 -2.123007
N 1.046843 0.427633 -0.109353
C -0.363851 0.167847 -0.524846
C -1.258476 1.337444 0.005205
C 1.242051 0.660102 1.343360
C 0.339797 1.825983 1.776516
C -0.800682 -1.214106 -0.086616
C -2.748691 1.127577 -0.166889
C 2.083041 0.040897 -0.980311
C -0.586699 -2.286599 -0.967571
C -1.371587 -1.451138 1.170278
C -3.271423 1.010439 -1.462916
C -3.599715 1.069902 0.944365
C 3.481771 0.137847 -0.451707
C -0.957708 -3.580719 -0.596558
C -1.742626 -2.748078 1.536745
C -4.642969 0.811120 -1.641478
C -4.970470 0.870056 0.758641
C -1.538463 -3.813543 0.654993
C -5.491897 0.736530 -0.532212
C 4.051899 -0.965449 0.195839
C 4.223589 1.306915 -0.658712
C 5.372591 -0.891038 0.647246
C 5.543576 1.373887 -0.202703
C 6.116627 0.277475 0.450222
H -0.395948 0.221717 -1.657086
H 2.306350 0.895389 1.564133
H 0.984305 -0.261274 1.917251
H 0.269213 1.914409 2.876598
H 0.657579 2.790991 1.344084
H 0.006702 2.691274 -0.778337
H -0.120424 -2.108068 -1.939597
H -1.535787 -0.618691 1.859303
H -2.611864 1.089732 -2.327089
H -3.189230 1.190923 1.949107
H -0.794851 -4.409028 -1.284216
H -2.194974 -2.926372 2.510586
H -5.049953 0.717191 -2.646724
H -5.632299 0.821946 1.621270
H -1.831503 -4.821915 0.940279
H -6.559644 0.578710 -0.674318
H 3.472748 -1.878349 0.337458
H 3.778756 2.153797 -1.180986
H 5.823911 -1.746807 1.147957
H 6.127513 2.279480 -0.362887
H 7.146755 0.331473 0.801445


%chk=000233554-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000233554

0 1
O -1.071773 1.377051 1.624764
O -0.624212 2.395570 -0.490117
O 1.579690 1.237795 -1.821401
N 1.060211 0.158638 0.177351
C -0.358666 -0.032561 -0.291409
C -1.191020 1.221715 0.163647
C 1.185065 0.315397 1.648266
C 0.322679 1.528335 2.072450
C -0.863816 -1.416112 0.119583
C -2.680721 1.134632 -0.162109
C 1.978460 0.694533 -0.724104
C -0.585554 -2.499473 -0.754086
C -1.560834 -1.677356 1.326891
C -3.068666 1.095871 -1.524076
C -3.675152 1.115873 0.842447
C 3.439561 0.571878 -0.421014
C -0.987853 -3.813772 -0.433602
C -1.968732 -2.991703 1.646781
C -4.432752 1.022593 -1.876683
C -5.041981 1.052581 0.489402
C -1.683168 -4.064548 0.772139
C -5.426023 0.998956 -0.869467
C 3.972164 -0.543878 0.278456
C 4.317776 1.562628 -0.930588
C 5.364521 -0.654802 0.478480
C 5.708060 1.454849 -0.719965
C 6.234367 0.347945 -0.012181
H -0.311139 0.002222 -1.394667
H 2.237581 0.493587 1.918863
H 0.838712 -0.606866 2.146042
H 0.263562 1.607652 3.170487
H 0.740327 2.460944 1.647661
H 0.089642 2.125465 -1.149411
H -0.051336 -2.309015 -1.693604
H -1.787274 -0.850851 2.006692
H -2.307882 1.151875 -2.311291
H -3.372379 1.172619 1.891230
H -0.768079 -4.636360 -1.123275
H -2.514750 -3.176403 2.578822
H -4.721473 0.994231 -2.933412
H -5.806021 1.046695 1.275158
H -2.003345 -5.082171 1.022692
H -6.486197 0.947235 -1.142423
H 3.300271 -1.336135 0.627642
H 3.894064 2.397791 -1.497672
H 5.771944 -1.524674 1.004944
H 6.380716 2.225977 -1.110498
H 7.315123 0.261148 0.145765


