%chk=000270569.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270569

0 1
O -5.111846 -1.696503 0.098975
O -4.527389 0.474665 -0.149675
C 0.728991 -0.306829 -0.089583
C 2.068901 -0.941836 -0.119217
C 0.727238 1.168835 0.050945
C 3.010294 -0.639064 0.878084
C 1.339228 1.962981 -0.931615
C 2.402107 -1.844983 -1.141237
C 0.125745 1.773757 1.165524
C -0.391720 -1.051398 -0.179253
C 4.268885 -1.244229 0.856181
C 1.337417 3.353982 -0.802497
C 3.665461 -2.441914 -1.160422
C 0.132414 3.165548 1.290314
C 4.598569 -2.145312 -0.161982
C 0.735159 3.956669 0.307079
C -1.743854 -0.502826 -0.182012
C -2.835806 -1.271553 -0.032572
C -4.182617 -0.681601 -0.043120
C -6.507165 -1.297290 0.109705
H 2.756282 0.068186 1.667594
H 1.813016 1.492891 -1.792673
H 1.678989 -2.075478 -1.922385
H -0.344954 1.158668 1.931625
H -0.318685 -2.141889 -0.256086
H 4.995613 -1.011714 1.633340
H 1.806804 3.969948 -1.568282
H 3.922521 -3.140331 -1.955483
H -0.337322 3.634146 2.154214
H 5.581038 -2.613910 -0.177509
H 0.734727 5.041003 0.404550
H -1.839940 0.585457 -0.318706
H -2.798412 -2.354174 0.105621
H -7.028297 -2.252364 0.230052
H -6.756897 -0.809530 -0.837815
H -6.689294 -0.620910 0.950724


%chk=000270569-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270569

0 1
O -5.168587 -1.802701 0.004728
O -4.535201 0.443280 -0.179485
C 0.774517 -0.255759 0.004336
C 2.097268 -0.929030 -0.138408
C 0.753734 1.229343 0.164067
C 3.255745 -0.406432 0.506262
C 1.551684 2.055750 -0.677988
C 2.240162 -2.118706 -0.911025
C -0.046654 1.854372 1.161207
C -0.387583 -1.017196 -0.002494
C 4.501388 -1.059995 0.401810
C 1.526758 3.459722 -0.546083
C 3.486276 -2.769394 -1.018351
C -0.062418 3.258898 1.300483
C 4.623881 -2.245929 -0.359175
C 0.718909 4.068197 0.443949
C -1.744998 -0.517015 -0.040523
C -2.854924 -1.329258 0.015086
C -4.212246 -0.769076 -0.065427
C -6.577682 -1.360905 -0.069314
H 3.169633 0.505906 1.106065
H 2.177788 1.590535 -1.447335
H 1.376476 -2.513553 -1.457593
H -0.633265 1.231945 1.845513
H -0.279641 -2.110687 -0.002373
H 5.375752 -0.646215 0.916364
H 2.135020 4.079172 -1.214497
H 3.574711 -3.676955 -1.625941
H -0.681979 3.719529 2.077669
H 5.592556 -2.750634 -0.444497
H 0.702969 5.158621 0.549406
H -1.913494 0.562449 -0.149571
H -2.774185 -2.416390 0.123833
H -7.168067 -2.285336 0.003105
H -6.768470 -0.841231 -1.023972
H -6.810629 -0.674227 0.762572


