%chk=000298389.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298389

0 1
O 5.473989 -1.157201 1.114780
N 4.553355 0.575069 -0.050520
C 0.299022 0.185012 -0.731115
C -3.612347 0.096510 -0.350575
C -1.132983 -0.385880 -0.729956
C -2.177474 0.661811 -0.324799
C 1.256244 -0.787160 -1.453297
C 0.798303 0.445612 0.704719
C 3.175290 0.010637 -0.020386
C 2.692737 -0.251764 -1.462484
C 2.231326 0.989857 0.708268
C -3.843618 -0.899349 0.804384
C -4.637209 1.248192 -0.267858
C -5.279478 -1.440937 0.789387
C -6.074816 0.710525 -0.283642
C -6.305503 -0.300485 0.848378
C 5.628528 -0.089236 0.546721
C 6.955846 0.611038 0.429781
H 0.298727 1.153987 -1.287005
H -3.769079 -0.441520 -1.316991
H -1.191589 -1.259939 -0.052851
H -1.376687 -0.775717 -1.737632
H -2.110802 1.530580 -1.008142
H -1.946575 1.057846 0.682595
H 0.915790 -0.952494 -2.492363
H 1.228203 -1.779467 -0.963040
H 0.748333 -0.488060 1.297580
H 0.125537 1.161468 1.213460
H 3.211537 -0.963157 0.544129
H 3.364921 -0.979897 -1.955357
H 2.747726 0.672693 -2.066259
H 2.258786 1.986536 0.230886
H 2.577250 1.139112 1.748863
H -3.124822 -1.736134 0.730769
H -3.639714 -0.405824 1.773039
H -4.468563 1.836176 0.653692
H -4.490512 1.947642 -1.110731
H -5.430501 -2.128349 1.642167
H -5.443283 -2.044651 -0.123636
H -6.285365 0.232965 -1.259723
H -6.790059 1.548711 -0.191913
H -7.330355 -0.710047 0.786558
H -6.237249 0.212493 1.826711
H 4.677421 1.461152 -0.523534
H 7.735634 0.011974 0.928954
H 7.269828 0.740166 -0.613119
H 6.952149 1.596604 0.911008


%chk=000298389-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298389

0 1
O 5.583312 -1.030944 1.306821
N 4.642857 0.565602 -0.107995
C 0.316463 0.133239 -0.683712
C -3.656394 0.131128 -0.316847
C -1.126745 -0.423139 -0.589505
C -2.191837 0.619410 -0.174390
C 1.278133 -0.924473 -1.285004
C 0.859098 0.614880 0.687174
C 3.257857 0.065143 -0.011901
C 2.732498 -0.409590 -1.389230
C 2.313873 1.133051 0.593541
C -3.982185 -1.056982 0.626862
C -4.653183 1.294217 -0.068700
C -5.456114 -1.513723 0.505343
C -6.127615 0.843555 -0.195059
C -6.435567 -0.341661 0.750342
C 5.713990 -0.015422 0.557091
C 7.062360 0.667402 0.313469
H 0.303008 1.010083 -1.371063
H -3.800495 -0.220349 -1.364239
H -1.131779 -1.275212 0.120950
H -1.410045 -0.841019 -1.579243
H -2.059225 1.528666 -0.799439
H -2.025892 0.935850 0.876196
H 0.917515 -1.233598 -2.286134
H 1.257104 -1.832692 -0.646205
H 0.817017 -0.232398 1.404356
H 0.212122 1.412393 1.098928
H 3.309154 -0.802565 0.673041
H 3.398226 -1.200898 -1.782495
H 2.771346 0.438463 -2.106999
H 2.337912 2.043415 -0.044216
H 2.685900 1.426376 1.593385
H -3.310236 -1.911029 0.415045
H -3.780164 -0.743849 1.674107
H -4.482516 1.699038 0.952145
H -4.445861 2.121547 -0.777216
H -5.657716 -2.337832 1.217518
H -5.627246 -1.922132 -0.512776
H -6.326905 0.534575 -1.242575
H -6.805149 1.692899 0.021175
H -7.481554 -0.679875 0.615208
H -6.340776 -0.001596 1.802836
H 4.813067 1.382703 -0.698894
H 7.837098 0.130630 0.879815
H 7.330578 0.652493 -0.759226
H 7.042610 1.721319 0.647616


