%chk=000201863.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201863

0 1
O 0.017981 2.671238 0.871352
N 1.499715 0.275734 0.076824
N 4.203665 -0.746122 -0.296302
C 0.042020 0.470079 -0.262207
C 1.841365 -1.164266 0.332820
C 2.386158 0.776216 -1.030835
C 3.309507 -1.265830 0.790618
C 3.859107 0.685173 -0.585277
C -0.861521 -0.119241 0.846629
C -0.235039 1.992346 -0.363803
C 5.636930 -0.866580 0.104980
C -2.275093 -0.287994 0.364454
C -3.254587 0.659104 0.700423
C -2.624861 -1.395922 -0.423617
C -4.568690 0.496908 0.254225
C -3.940339 -1.552761 -0.867547
C -4.914818 -0.607965 -0.530201
H -0.221812 -0.006333 -1.242431
H 1.682145 -1.805981 -0.561678
H 1.178956 -1.551720 1.140513
H 2.137023 1.839469 -1.241094
H 2.247094 0.209762 -1.978016
H 3.439613 -0.728041 1.754902
H 3.564412 -2.332266 0.968347
H 4.513029 1.038443 -1.410962
H 4.029983 1.357022 0.283813
H -0.465052 -1.091758 1.210022
H -0.820474 0.551750 1.734931
H 0.375117 2.472618 -1.151609
H -1.307024 2.193299 -0.552420
H 5.874560 -1.930409 0.266830
H 5.916906 -0.307642 1.009875
H 6.271465 -0.520495 -0.726883
H -2.988542 1.522881 1.310122
H -1.872639 -2.135485 -0.687985
H 0.875018 2.358811 1.249582
H -5.325055 1.234077 0.519283
H -4.207289 -2.414273 -1.477219
H -5.938434 -0.732648 -0.875760


%chk=000201863-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201863

0 1
O 0.237362 2.386051 0.950455
N 1.509157 0.186274 -0.011745
N 4.296089 -0.647738 -0.112675
C 0.044885 0.311241 -0.352594
C 1.965825 -1.067470 0.646445
C 2.373238 0.473956 -1.193794
C 3.441853 -0.935448 1.060707
C 3.847418 0.595281 -0.779683
C -0.869923 -0.473919 0.631387
C -0.273621 1.835305 -0.303656
C 5.732297 -0.625142 0.222218
C -2.340231 -0.402004 0.243307
C -3.233377 0.472988 0.913335
C -2.847006 -1.211890 -0.806848
C -4.596339 0.539565 0.543393
C -4.207311 -1.146794 -1.182185
C -5.087996 -0.269130 -0.507190
H -0.153891 -0.072017 -1.381813
H 1.860128 -1.949940 -0.029755
H 1.367164 -1.249115 1.553716
H 2.046963 1.421549 -1.656808
H 2.276723 -0.336309 -1.955561
H 3.522634 -0.129571 1.836326
H 3.775810 -1.885060 1.519569
H 4.468182 0.761225 -1.680208
H 3.963604 1.488248 -0.111838
H -0.560096 -1.534904 0.645760
H -0.724707 -0.061439 1.647512
H 0.178391 2.355004 -1.175752
H -1.361063 2.009100 -0.326400
H 6.028393 -1.596534 0.657496
H 6.005071 0.179039 0.952184
H 6.325747 -0.468069 -0.696402
H -2.854256 1.103485 1.727014
H -2.172588 -1.904932 -1.326634
H 1.094549 1.871609 1.078756
H -5.272137 1.219688 1.074300
H -4.581916 -1.781355 -1.993681
H -6.144525 -0.219627 -0.793956


