%chk=000289932.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289932

0 1
O 1.726317 1.779503 -1.421964
O -0.796294 2.660648 -0.108511
N -0.820249 0.404459 0.440924
N 2.111511 1.920768 0.930168
N 2.756993 0.876508 1.676455
C 1.457713 -0.231307 -0.084052
C 1.288227 1.316969 -0.158994
C 2.603358 -0.438249 0.940339
C 0.086882 -0.776911 0.376318
C -0.227692 1.604336 0.053852
C 3.921664 -0.774529 0.271322
C -2.274853 0.229747 0.624577
C -2.986440 -0.108662 -0.699325
C 4.681891 -1.844226 0.766963
C 4.395493 -0.033062 -0.820742
C -4.460420 -0.286736 -0.462010
C 5.901893 -2.172558 0.168714
C 5.616103 -0.364923 -1.414109
C 6.370626 -1.435207 -0.922761
C -5.002148 -1.569990 -0.296141
C -5.301153 0.835545 -0.397548
C -6.372916 -1.727156 -0.071508
C -6.669942 0.672277 -0.171936
C -7.208932 -0.608340 -0.008650
H 1.728034 -0.637844 -1.084481
H 2.341161 -1.243911 1.670170
H -0.303476 -1.535017 -0.334771
H 0.138922 -1.258344 1.376067
H 2.854093 2.524020 0.522592
H 2.261617 0.822027 2.586128
H -2.455915 -0.565058 1.380630
H -2.686451 1.182429 1.041740
H 1.299628 2.646489 -1.649784
H -2.546238 -1.015094 -1.158412
H -2.808949 0.703462 -1.437762
H 4.332763 -2.418274 1.622638
H 3.813790 0.806577 -1.209659
H 6.489355 -3.002664 0.557243
H 5.980868 0.214820 -2.260789
H 7.321175 -1.690952 -1.386480
H -4.359172 -2.445611 -0.344466
H -4.886366 1.834829 -0.524676
H -6.790024 -2.725023 0.054266
H -7.318953 1.545635 -0.123782
H -8.275495 -0.732801 0.165807


%chk=000289932-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000289932

0 1
O 1.814272 1.829545 -1.339232
O -0.747672 2.557310 -0.344978
N -0.828007 0.295253 0.349542
N 2.070462 1.656228 1.063462
N 2.579921 0.516164 1.803357
C 1.448450 -0.380109 -0.123773
C 1.314627 1.175975 -0.144982
C 2.626857 -0.667467 0.854450
C 0.072903 -0.876325 0.427988
C -0.201639 1.451003 -0.050289
C 3.998591 -0.821151 0.203649
C -2.279319 0.208270 0.555443
C -3.044688 -0.210106 -0.735891
C 4.929846 -1.725521 0.775109
C 4.393051 -0.060879 -0.928611
C -4.543870 -0.277627 -0.489975
C 6.225816 -1.873347 0.235329
C 5.692407 -0.204959 -1.466742
C 6.612720 -1.109599 -0.890406
C -5.184697 -1.511036 -0.207523
C -5.325793 0.907356 -0.495554
C -6.571740 -1.562977 0.060757
C -6.712000 0.860092 -0.228206
C -7.340159 -0.376199 0.052063
H 1.624328 -0.757124 -1.142371
H 2.426667 -1.574701 1.455792
H -0.329606 -1.713524 -0.171854
H 0.156879 -1.220991 1.478847
H 2.851271 2.251242 0.747506
H 1.944847 0.330762 2.594432
H -2.488039 -0.511143 1.369453
H -2.631217 1.204254 0.877662
H 1.196761 2.592258 -1.526203
H -2.668284 -1.191642 -1.081883
H -2.810517 0.533761 -1.519298
H 4.638604 -2.313560 1.655075
H 3.694795 0.644108 -1.393126
H 6.930510 -2.579477 0.689087
H 5.984790 0.390183 -2.339507
H 7.617617 -1.220556 -1.313318
H -4.595656 -2.437265 -0.206804
H -4.845720 1.868256 -0.720108
H -7.052315 -2.525284 0.270996
H -7.302093 1.783424 -0.242346
H -8.415961 -0.414276 0.256584


