%chk=000231221.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231221

0 1
O -1.401063 -1.823325 1.176729
O -2.286213 2.319568 -0.708859
O 1.233297 -2.115420 -1.454261
N -0.449731 0.867198 -0.971174
N -2.188420 0.226411 0.388272
C 0.006685 -0.383944 -0.295385
C 1.203423 -0.192711 0.642263
C 2.460368 0.317724 -0.072780
C -1.242331 -0.820834 0.534082
C 3.597192 0.574503 0.926804
C -1.711328 1.293017 -0.453082
C 0.249303 -1.426828 -1.423107
C -3.541464 0.217773 0.976175
C 4.856572 1.074042 0.223844
H 1.428637 -1.173728 1.121728
H 0.929944 0.492953 1.469200
H 2.788842 -0.432481 -0.824866
H 2.246160 1.244153 -0.637181
H 0.258451 1.570301 -1.185111
H 3.826080 -0.357009 1.482837
H 3.276660 1.311747 1.688722
H -0.551757 -1.461875 -2.176512
H -3.549957 -0.400813 1.892413
H -4.275240 -0.199387 0.263740
H -3.850240 1.247789 1.233073
H 4.682462 2.018663 -0.303428
H 5.222731 0.349258 -0.513411
H 5.667836 1.245056 0.941277


%chk=000231221-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000231221

0 1
O -1.357626 -1.766594 1.313665
O -2.453925 2.270586 -0.849072
O 1.068986 -2.237586 -1.400905
N -0.473629 0.944406 -0.835189
N -2.248876 0.199729 0.335625
C -0.000770 -0.319722 -0.246312
C 1.244666 -0.205099 0.664718
C 2.483328 0.403119 -0.030249
C -1.261188 -0.757638 0.577435
C 3.704223 0.457507 0.917573
C -1.784936 1.268564 -0.507449
C 0.181513 -1.363035 -1.383654
C -3.588218 0.182851 0.929970
C 4.952238 1.069353 0.246980
H 1.476716 -1.227002 1.017211
H 0.979039 0.398714 1.553818
H 2.747141 -0.196727 -0.922714
H 2.261135 1.434415 -0.378080
H 0.106545 1.571767 -1.388389
H 3.934817 -0.568861 1.266199
H 3.441419 1.043898 1.821446
H -0.571839 -1.252817 -2.204684
H -3.526304 0.263898 2.028557
H -4.105502 -0.756745 0.674201
H -4.145054 1.042612 0.524692
H 4.758715 2.106716 -0.085819
H 5.253872 0.481795 -0.640276
H 5.810411 1.093699 0.942705


