%chk=000295045.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295045

0 1
O 3.760766 -1.872982 0.621744
N 2.255018 -1.892748 -1.136557
N 3.781596 -0.085918 -0.883085
C -4.405059 -0.751806 0.442890
C -3.226545 -1.166222 -0.448615
C -5.592038 -0.253193 -0.392376
C -2.040955 -1.665814 0.387832
C -6.769979 0.161717 0.499605
C -0.860588 -2.079151 -0.502151
C -7.957579 0.660016 -0.335022
C 0.319538 -2.583420 0.336331
C -9.134962 1.075080 0.557244
C -10.324005 1.573696 -0.276163
C 1.513682 -3.026819 -0.520584
C -11.498761 1.988231 0.607136
C 3.301996 -1.315747 -0.360309
C 4.907188 0.642049 -0.374610
C 5.379712 1.758455 -1.119203
C 5.514818 0.294360 0.838413
C 6.590843 1.045929 1.333098
C 6.451809 2.493049 -0.603113
C 7.057355 2.149928 0.608328
C 4.768827 2.163970 -2.423307
C 7.223677 0.656036 2.629361
H -4.083840 0.038237 1.148973
H -4.720661 -1.606716 1.071703
H -3.549348 -1.955780 -1.154473
H -2.911933 -0.310412 -1.076305
H -5.277482 0.601885 -1.021208
H -5.914714 -1.043302 -1.097535
H -1.720975 -0.877170 1.096400
H -2.357785 -2.521503 1.015289
H -7.085110 -0.692867 1.128964
H -6.448204 0.952119 1.204904
H -1.183195 -2.867175 -1.210571
H -0.547565 -1.220915 -1.126110
H -8.280157 -0.130422 -1.039816
H -7.642978 1.514750 -0.964314
H -0.005021 -3.437693 0.964505
H 0.641701 -1.804119 1.056441
H -8.814318 1.865577 1.262650
H -9.450940 0.221596 1.187335
H -10.009921 2.429265 -0.905525
H -10.647537 0.782817 -0.980855
H 1.186272 -3.689765 -1.352487
H 2.226411 -3.619637 0.105025
H -12.342156 2.342372 0.004000
H -11.222655 2.797761 1.292318
H -11.859789 1.152392 1.217121
H 1.666313 -1.276071 -1.694933
H 3.420898 0.231313 -1.784249
H 5.157286 -0.572688 1.405950
H 6.827065 3.353261 -1.157851
H 7.889249 2.740514 0.981861
H 4.817497 1.354250 -3.164417
H 3.720596 2.469378 -2.301448
H 5.290691 3.021922 -2.871204
H 6.497913 0.704256 3.454453
H 7.597765 -0.378029 2.592323
H 8.069975 1.298204 2.901801


%chk=000295045-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000295045

0 1
O 3.682890 -1.905890 0.833260
N 2.325454 -2.024324 -1.061217
N 3.878067 -0.279177 -0.882116
C -4.386699 -0.912058 0.399606
C -3.135478 -1.199337 -0.460381
C -5.508849 -0.182657 -0.373112
C -2.016058 -1.930541 0.314458
C -6.754505 0.114815 0.491480
C -0.756225 -2.204974 -0.537418
C -7.878305 0.842333 -0.280893
C 0.357341 -2.931841 0.248187
C -9.121698 1.145141 0.585203
C -10.245654 1.871586 -0.188726
C 1.626659 -3.230604 -0.584683
C -11.484350 2.171114 0.683005
C 3.324291 -1.428021 -0.285829
C 4.868419 0.598916 -0.356755
C 5.249907 1.713700 -1.172369
C 5.464047 0.403081 0.914235
C 6.441876 1.303687 1.402583
C 6.227530 2.597647 -0.667605
C 6.821643 2.405921 0.600502
C 4.627211 1.945874 -2.540070
C 7.064613 1.075427 2.770022
H -4.092666 -0.302523 1.279724
H -4.781852 -1.867937 0.803013
H -3.428699 -1.806639 -1.342604
H -2.739204 -0.242046 -0.859948
H -5.111710 0.769963 -0.782616
H -5.808896 -0.795527 -1.249091
H -1.730015 -1.328159 1.201698
H -2.409361 -2.891766 0.706495
H -7.150713 -0.836990 0.903529
H -6.454347 0.729586 1.365954
H -1.039661 -2.810265 -1.425314
H -0.367520 -1.238804 -0.922379
H -8.181441 0.225868 -1.153314
H -7.481119 1.792531 -0.696003
H -0.034169 -3.895747 0.633827
H 0.651886 -2.332534 1.131312
H -8.820577 1.763353 1.456990
H -9.520056 0.196019 1.001505
H -9.846613 2.819338 -0.604957
H -10.546183 1.253092 -1.059366
H 1.369378 -3.851842 -1.464735
H 2.347278 -3.791865 0.034709
H -12.271930 2.688940 0.104924
H -11.218248 2.814491 1.542993
H -11.920055 1.237412 1.086344
H 1.977402 -1.565797 -1.903756
H 3.550551 -0.045764 -1.820495
H 5.155770 -0.460317 1.508602
H 6.529196 3.454856 -1.282055
H 7.578108 3.111660 0.962482
H 4.818354 1.105445 -3.239450
H 3.529160 2.096752 -2.483581
H 5.049615 2.850767 -3.007478
H 6.299096 1.103295 3.568209
H 7.553305 0.084863 2.827505
H 7.823511 1.842775 3.001560


