%chk=000213668.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213668

0 1
O 1.581200 -0.404015 2.029301
N 0.481204 -0.106505 0.048658
N 5.317202 0.588385 -1.258850
C -0.868795 -0.283701 0.650349
C -1.645710 -1.405579 -0.020100
C -1.571593 1.063754 0.584219
C -3.046158 -1.424877 0.085437
C -1.638487 1.857857 1.737272
C -0.992426 -2.454102 -0.681732
C -2.116013 1.534743 -0.619402
C 1.628604 -0.149935 0.839011
C -3.780593 -2.468509 -0.481289
C -2.253793 3.112182 1.686670
C -1.732035 -3.496255 -1.250391
C -2.728549 2.789570 -0.665427
C 2.906015 0.112716 0.087537
C -3.125905 -3.505419 -1.154600
C -2.798935 3.579672 0.486924
C 3.145011 1.358827 -0.500658
C 3.873988 -0.893182 0.009406
C 4.368646 1.555431 -1.163798
C 5.068514 -0.612899 -0.676702
H -0.724667 -0.589184 1.734811
H 0.513197 0.138051 -0.936167
H -3.566632 -0.623648 0.611257
H -1.206675 1.502796 2.673790
H 0.094344 -2.474737 -0.749492
H -2.072789 0.916669 -1.515463
H -4.866313 -2.474955 -0.396375
H -2.306058 3.726020 2.584916
H -1.216434 -4.305523 -1.765313
H -3.153371 3.151987 -1.600217
H -3.699655 -4.317275 -1.597083
H -3.277538 4.556633 0.449532
H 2.413762 2.162617 -0.436613
H 3.713816 -1.862444 0.480731
H 4.609449 2.514577 -1.638520
H 5.861175 -1.365944 -0.767730


%chk=000213668-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213668

0 1
O 1.563852 -0.447475 1.993579
N 0.442605 -0.175504 -0.028462
N 5.429861 0.574981 -1.186948
C -0.907760 -0.329192 0.563381
C -1.721873 -1.413509 -0.160080
C -1.584737 1.048075 0.651793
C -3.134837 -1.451425 -0.032338
C -1.499222 1.786121 1.857993
C -1.078996 -2.446570 -0.887273
C -2.224346 1.635854 -0.469813
C 1.587986 -0.189816 0.747822
C -3.884856 -2.489118 -0.626806
C -2.044476 3.086867 1.945911
C -1.829210 -3.482698 -1.488562
C -2.765604 2.937413 -0.385775
C 2.889223 0.091251 0.031380
C -3.236198 -3.508001 -1.362557
C -2.677962 3.667470 0.823105
C 2.988207 0.778847 -1.205071
C 4.090224 -0.331578 0.652063
C 4.267078 0.995386 -1.767280
C 5.321529 -0.077180 0.011507
H -0.711164 -0.677645 1.596801
H 0.501492 0.037497 -1.025748
H -3.648551 -0.667007 0.534218
H -0.994148 1.342016 2.724212
H 0.013549 -2.448940 -0.969498
H -2.314335 1.068994 -1.404737
H -4.974962 -2.502664 -0.515775
H -1.974238 3.645012 2.886068
H -1.313992 -4.272034 -2.047580
H -3.258382 3.380829 -1.258461
H -3.818772 -4.311760 -1.826222
H -3.100714 4.676222 0.888965
H 2.109309 1.180905 -1.721994
H 4.040119 -0.839417 1.619591
H 4.375482 1.531149 -2.717021
H 6.265822 -0.399558 0.463511


