%chk=000231498.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231498

0 1
O -2.804101 -1.226279 -0.608631
N -1.861928 0.301962 0.873406
N -3.728337 0.876812 -0.522835
C 0.524045 -0.180624 0.172393
C 1.143562 1.167007 0.591192
C 1.585330 -1.297941 0.224083
C 2.349605 1.515344 -0.292790
C 2.793020 -0.950105 -0.656852
C 3.404353 0.400677 -0.260077
C -0.667720 -0.560191 1.080036
C -2.783583 -0.106020 -0.124334
H 0.156890 -0.095198 -0.880830
H 1.459833 1.123739 1.650825
H 0.391416 1.973321 0.525146
H 1.142541 -2.254884 -0.112237
H 1.917528 -1.459188 1.266816
H 2.797813 2.469143 0.041979
H 2.014866 1.682504 -1.334872
H 2.485194 -0.924344 -1.720271
H 3.555395 -1.747491 -0.579121
H 4.239935 0.651245 -0.939475
H 3.843157 0.329700 0.753506
H -0.392542 -0.486255 2.154984
H -0.962089 -1.622910 0.895749
H -1.671412 1.299939 0.968520
H -3.980389 1.621098 0.108512
H -4.515382 0.524536 -1.058124


%chk=000231498-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231498

0 1
O -2.791229 -1.054224 -0.893193
N -1.851208 0.265322 0.798037
N -3.857049 0.920956 -0.255243
C 0.540059 -0.245051 0.115363
C 1.095376 1.160186 0.459976
C 1.649682 -1.315645 0.273112
C 2.345165 1.508820 -0.383444
C 2.902603 -0.974357 -0.567787
C 3.446599 0.433572 -0.225177
C -0.690845 -0.620615 0.978042
C -2.824636 -0.018565 -0.158889
H 0.209652 -0.242417 -0.944665
H 1.365892 1.185879 1.538772
H 0.310927 1.927553 0.301891
H 1.255265 -2.309233 -0.018587
H 1.937960 -1.385376 1.344588
H 2.735579 2.504033 -0.093424
H 2.053875 1.576668 -1.452002
H 2.637512 -1.009502 -1.644657
H 3.688247 -1.738159 -0.406370
H 4.315067 0.676218 -0.868112
H 3.811566 0.438195 0.823415
H -0.409564 -0.618611 2.050618
H -1.022451 -1.639887 0.710848
H -1.880311 1.143274 1.315711
H -3.953714 1.726920 0.358194
H -4.583020 0.729641 -0.940321


