%chk=000198889.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198889

1 1
O -3.628594 1.225911 0.731756
O -4.960662 -0.606236 0.476079
N 2.010485 0.000139 0.167973
N -1.682263 0.393393 -0.077769
N -2.353325 1.599252 0.267606
C 2.664827 -1.297303 0.546013
C 2.896796 1.179177 0.449582
C 3.967160 -1.461381 -0.254872
C 4.200906 1.037748 -0.352352
C 4.913290 -0.278416 -0.023788
C 0.663958 0.153230 0.783601
C -0.240705 0.452831 -0.444263
C -2.535165 -0.617405 -0.180988
C -3.888990 -0.140197 0.328977
C -2.309864 -1.965179 -0.691233
H 1.970654 -2.127668 0.298210
H 2.883681 -1.359015 1.634918
H 3.131424 1.283580 1.531934
H 2.366436 2.102388 0.134119
H 3.736466 -1.549232 -1.335837
H 4.458990 -2.411026 0.033158
H 4.861898 1.899582 -0.135179
H 3.982489 1.083939 -1.438518
H 5.275805 -0.271460 1.022379
H 5.819021 -0.387637 -0.652884
H 0.326360 -0.768127 1.304226
H 0.599279 0.975254 1.526990
H 0.006773 1.454758 -0.881033
H -0.029313 -0.280512 -1.267128
H -1.911604 2.147530 1.040828
H -1.249929 -2.276611 -0.734595
H -2.714438 -2.085303 -1.724319
H -2.842848 -2.737706 -0.091792


%chk=000198889-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000198889

1 1
O -3.397835 1.436920 0.177989
O -4.793635 -0.493409 0.012937
N 2.094945 -0.033205 1.129990
N -1.408810 0.370148 -0.312028
N -1.998712 1.666484 -0.127222
C 2.736685 -1.346904 0.900523
C 2.991380 1.138839 1.012381
C 3.507206 -1.389679 -0.446392
C 3.767199 1.145525 -0.332158
C 4.495377 -0.202958 -0.544592
C 0.679127 0.109041 1.146495
C 0.042045 0.271820 -0.346129
C -2.345309 -0.600338 -0.350600
C -3.661867 -0.022408 -0.055175
C -2.115796 -2.028323 -0.714877
H 1.967971 -2.139152 0.953030
H 3.453853 -1.530026 1.727410
H 3.723015 1.097235 1.845788
H 2.399225 2.062826 1.142237
H 2.792511 -1.352817 -1.293924
H 4.045792 -2.352216 -0.518974
H 4.489800 1.981789 -0.322309
H 3.067987 1.331484 -1.172697
H 5.285812 -0.319311 0.223970
H 5.003685 -0.210857 -1.525076
H 0.200518 -0.775894 1.605035
H 0.387047 1.006886 1.726167
H 0.447280 1.182556 -0.815994
H 0.319522 -0.605797 -0.949490
H -1.576209 2.193914 0.665271
H -1.376219 -2.524600 -0.060938
H -1.765711 -2.125759 -1.760774
H -3.068882 -2.573518 -0.628072


