%chk=000181538.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181538

0 1
O -4.538829 -1.285621 0.477226
O -5.946448 0.621925 0.362968
O 5.047053 -1.336670 0.783793
O 5.979257 0.638216 -0.142825
O -0.823375 -4.096960 -0.583228
N -0.144973 -0.895825 0.744352
C -1.488551 -1.253552 0.180046
C -2.410453 -0.059750 0.102148
C 0.405880 0.328700 0.195192
C -1.878819 1.247409 -0.126008
C -0.417443 1.358416 -0.272432
C -1.282966 -1.846927 -1.230105
C 1.834994 0.423521 0.093038
C -3.776686 -0.147919 0.249674
C -0.144336 -0.891947 2.239582
C 2.398574 1.595967 -0.486326
C 0.173925 2.501061 -0.877608
C -2.719029 2.363369 -0.178276
C -4.621561 0.999201 0.182703
C 1.538903 2.622046 -0.974002
C -4.120297 2.263720 -0.027869
C 2.687895 -0.650564 0.548149
C -0.428485 -3.101394 -1.147386
C 3.829533 1.758155 -0.601900
C 4.026445 -0.466645 0.423079
C 4.598136 0.736454 -0.145995
C -5.931296 -0.830530 0.556351
C 0.913303 -3.027407 -1.810812
C 6.302086 -0.666573 0.443054
H -1.945185 -2.049290 0.835054
H -0.843119 -1.091056 -1.908076
H -2.272520 -2.107300 -1.661054
H -0.312776 -1.924290 2.591294
H -0.911093 -0.236773 2.682010
H 0.839579 -0.568615 2.617190
H -0.475137 3.287795 -1.266007
H -2.292334 3.355257 -0.334356
H 1.984157 3.505843 -1.429984
H -4.760423 3.140230 -0.074107
H 2.254778 -1.563330 0.959340
H 4.246752 2.661828 -1.036140
H -6.296673 -1.040815 1.570057
H -6.481852 -1.288246 -0.276009
H 1.526574 -2.233117 -1.353305
H 1.466536 -3.971386 -1.704300
H 0.837839 -2.804057 -2.881021
H 6.806513 -1.264569 -0.327565
H 6.854748 -0.488184 1.375097


%chk=000181538-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000181538

0 1
O -4.515860 -1.295867 0.429190
O -5.995029 0.574429 0.197557
O 5.138429 -1.255670 0.779511
O 6.093830 0.822009 0.064718
O -0.440887 -3.826571 0.015184
N -0.136504 -0.748710 0.748879
C -1.439091 -1.169032 0.176134
C -2.390087 0.013112 0.069436
C 0.442317 0.431169 0.205171
C -1.864144 1.320520 -0.208033
C -0.393751 1.461654 -0.312128
C -1.219228 -1.852503 -1.196589
C 1.882721 0.559258 0.152755
C -3.771294 -0.099771 0.214182
C 0.060084 -1.083451 2.179258
C 2.465641 1.793880 -0.341847
C 0.217292 2.638844 -0.855085
C -2.756748 2.422307 -0.332725
C -4.643659 0.997546 0.076105
C 1.597772 2.816813 -0.846113
C -4.162121 2.279292 -0.202313
C 2.744213 -0.530470 0.543756
C -0.450120 -3.172990 -1.062443
C 3.896742 1.962522 -0.377635
C 4.108750 -0.323181 0.490662
C 4.679443 0.909239 0.053641
C -5.902631 -0.825350 0.688457
C 0.293606 -3.654562 -2.299333
C 6.401491 -0.479634 0.712450
H -1.859481 -1.933984 0.852730
H -0.692038 -1.173045 -1.892446
H -2.201753 -2.079678 -1.662006
H 0.074173 -2.180659 2.305970
H -0.749592 -0.659633 2.811944
H 1.014746 -0.669202 2.538271
H -0.417284 3.423022 -1.280779
H -2.357315 3.425586 -0.505364
H 2.039235 3.735483 -1.248269
H -4.837356 3.131953 -0.306885
H 2.323021 -1.495752 0.830683
H 4.336640 2.891440 -0.750134
H -6.089157 -0.838091 1.779926
H -6.606111 -1.452274 0.121296
H 1.201300 -3.033961 -2.436338
H 0.596552 -4.707069 -2.185756
H -0.320637 -3.529684 -3.210052
H 7.125439 -1.026704 0.089442
H 6.767243 -0.292779 1.739667


