%chk=000297106.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297106

0 1
O -2.452095 1.136614 -0.033041
O -0.094071 -2.274392 -2.022508
N -1.534760 -0.734654 -1.042015
N -0.128289 3.976714 0.005059
C -0.024462 1.093252 -0.611511
C 0.785639 -0.164382 -1.083884
C 0.462217 1.674624 0.723715
C 0.018436 2.186641 -1.698709
C -1.480346 0.577786 -0.479599
C -0.286960 2.963063 1.100437
C -0.733932 3.455467 -1.265142
C -0.261000 -1.224324 -1.457887
C 1.746742 -0.707152 -0.056369
C -2.772579 -1.555567 -1.088708
C -0.777473 5.264380 0.395554
C -2.791717 -2.626883 0.010200
C 3.108000 -0.379769 -0.152154
C 1.301160 -1.527553 0.991955
C -3.013554 -2.034012 1.406917
C 4.013284 -0.870172 0.792954
C 2.212384 -2.016536 1.931398
C 3.568596 -1.688839 1.835507
C -3.007886 -3.114459 2.484981
H 1.357202 0.082738 -2.016030
H 1.548887 1.893976 0.643702
H 0.356354 0.935469 1.540660
H -0.398290 1.815248 -2.652834
H 1.079234 2.450991 -1.895952
H -1.354548 2.728120 1.320358
H 0.154972 3.385906 2.027910
H -0.622418 4.235927 -2.047959
H -1.822500 3.238768 -1.168880
H -2.828148 -2.039031 -2.091508
H -3.646350 -0.869634 -0.990789
H -1.858661 5.199835 0.589178
H -0.610640 6.006610 -0.401306
H -0.285459 5.652099 1.302086
H -3.592406 -3.358289 -0.219108
H -1.848921 -3.210754 -0.014452
H 3.465005 0.255367 -0.961048
H 0.247276 -1.793153 1.076717
H -2.234076 -1.277841 1.625948
H -3.973529 -1.480064 1.433025
H 5.069259 -0.614424 0.714042
H 1.863413 -2.657603 2.740143
H 4.275981 -2.072246 2.568414
H -3.802495 -3.851933 2.323059
H -3.163517 -2.680650 3.479434
H -2.057357 -3.659177 2.509141


%chk=000297106-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000297106

0 1
O -2.433408 1.088007 0.280836
O -0.094910 -2.163032 -2.130352
N -1.505065 -0.714745 -0.915461
N -0.175866 4.105107 -0.116166
C -0.037111 1.145938 -0.514386
C 0.801472 -0.101394 -1.005709
C 0.529697 1.866456 0.738680
C -0.122643 2.190410 -1.683149
C -1.446926 0.557021 -0.290304
C -0.188325 3.193455 1.056481
C -0.852908 3.483688 -1.279315
C -0.261537 -1.126434 -1.444408
C 1.765857 -0.710718 0.014482
C -2.743308 -1.506591 -1.063560
C -0.740188 5.429613 0.211152
C -2.836193 -2.678727 -0.059699
C 3.160225 -0.509139 -0.133268
C 1.301693 -1.462840 1.124554
C -2.965747 -2.239044 1.415691
C 4.072741 -1.039743 0.806223
C 2.210143 -1.996214 2.063824
C 3.600193 -1.784619 1.910268
C -3.091141 -3.439751 2.377252
H 1.388738 0.175280 -1.899569
H 1.599061 2.078197 0.547609
H 0.481743 1.204742 1.622219
H -0.607471 1.736694 -2.570103
H 0.915917 2.455642 -1.961074
H -1.229467 2.983951 1.399277
H 0.346607 3.695014 1.885511
H -0.817400 4.196774 -2.124880
H -1.929255 3.267448 -1.066146
H -2.758367 -1.896797 -2.097277
H -3.585979 -0.806055 -0.922262
H -1.815210 5.388765 0.520778
H -0.661872 6.095590 -0.667304
H -0.164515 5.884272 1.037472
H -3.722698 -3.283347 -0.339209
H -1.955133 -3.336996 -0.190025
H 3.534713 0.058539 -0.993995
H 0.227621 -1.644933 1.253940
H -2.088606 -1.624774 1.701949
H -3.844986 -1.574077 1.524012
H 5.148137 -0.876796 0.673720
H 1.835506 -2.579378 2.912605
H 4.305484 -2.201096 2.637914
H -3.984965 -4.047025 2.139366
H -3.180080 -3.106444 3.427307
H -2.208665 -4.103794 2.305600


