%chk=000262452.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000262452

0 1
O -2.219661 -1.475990 0.361688
O 2.902612 1.968753 0.513559
O 2.819458 0.476711 -1.189702
N 0.705456 0.000261 2.622329
C -0.018665 0.082012 -0.823734
C -1.448370 0.558185 -0.787056
C 0.079136 -1.390650 -0.520820
C 0.822978 0.933420 0.186477
C -2.448735 -0.215224 -0.178758
C -0.992444 -2.076717 0.070201
C -1.826585 1.790887 -1.342803
C 1.240696 -2.125148 -0.806154
C 2.276044 1.046276 -0.274880
C -3.781621 0.215720 -0.069876
C -0.933409 -3.435017 0.414912
C -3.145560 2.235264 -1.254746
C 1.321991 -3.479150 -0.479440
C 0.762980 0.405034 1.542756
C -4.117522 1.453375 -0.610468
C 0.242780 -4.128786 0.137918
C 4.321289 2.253047 0.263365
C 4.463636 3.132801 -0.958532
H 0.403158 0.262472 -1.852201
H 0.400361 1.985250 0.208407
H -1.081915 2.405582 -1.848553
H 2.090024 -1.623777 -1.283513
H -4.515623 -0.417516 0.425197
H -1.789140 -3.913929 0.885940
H -3.425899 3.193808 -1.687283
H 2.231186 -4.035061 -0.701401
H -5.143771 1.815055 -0.538784
H 0.321714 -5.184282 0.399296
H 4.589900 2.762586 1.208072
H 4.856407 1.292015 0.166640
H 5.497314 3.480089 -1.082217
H 4.188901 2.591519 -1.876764
H 3.821301 4.020826 -0.897772


%chk=000262452-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000262452

0 1
O -1.985075 -1.305492 0.680032
O 2.917099 1.247695 0.356162
O 2.439429 1.393279 -1.923063
N 0.128519 1.344635 2.306231
C -0.229510 0.258996 -1.095723
C -1.720843 0.531040 -0.960070
C 0.127661 -1.138431 -0.608183
C 0.588971 1.391851 -0.316051
C -2.507937 -0.216995 -0.051802
C -0.729277 -1.823275 0.288428
C -2.353764 1.571015 -1.683597
C 1.328577 -1.784071 -0.994994
C 2.070947 1.349042 -0.724976
C -3.871327 0.074289 0.165981
C -0.391042 -3.081100 0.829909
C -3.717451 1.872702 -1.489403
C 1.679794 -3.047104 -0.474332
C 0.360753 1.358218 1.137188
C -4.473355 1.126470 -0.551005
C 0.822186 -3.689166 0.452589
C 4.391159 1.207877 0.069259
C 4.954646 2.626488 -0.033055
H 0.085646 0.385910 -2.148942
H 0.198899 2.356911 -0.699299
H -1.765311 2.147969 -2.408877
H 1.987747 -1.287872 -1.717436
H -4.432515 -0.529124 0.885276
H -1.085719 -3.560851 1.525458
H -4.188349 2.680345 -2.058956
H 2.612243 -3.528367 -0.786737
H -5.530711 1.359176 -0.386239
H 1.091106 -4.665820 0.868783
H 4.797355 0.656167 0.930851
H 4.547630 0.638193 -0.863480
H 6.053337 2.578939 -0.147428
H 4.540993 3.153811 -0.908881
H 4.727891 3.206349 0.877686


