%chk=000267940.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267940

0 1
O 1.913739 2.221369 -0.742325
N 1.342814 2.363870 1.437535
C 2.521708 -1.614513 -0.108810
C 1.662806 -0.809127 -1.111776
C 0.310424 -0.409985 -0.596030
C 0.075948 0.839926 0.001819
C -0.771336 -1.298958 -0.735210
C 2.823178 -0.802729 1.155250
C 1.874018 -2.957009 0.248991
C -2.056339 -0.963061 -0.303116
C -2.286244 0.304683 0.285747
C -1.215971 1.188901 0.428068
C -3.175951 -1.938257 -0.473024
C 1.177088 1.836196 0.152020
C -3.651506 0.703886 0.745270
H 3.495557 -1.826745 -0.623002
H 1.547874 -1.399965 -2.043758
H 2.232125 0.098122 -1.427422
H -0.597070 -2.269960 -1.198033
H 1.910663 -0.582516 1.719708
H 3.299910 0.153527 0.908674
H 3.499565 -1.345417 1.823503
H 2.528381 -3.551625 0.895201
H 0.927676 -2.817403 0.784689
H 1.663133 -3.552603 -0.644519
H -1.386831 2.174514 0.863538
H -2.850077 -2.885088 -0.923052
H -3.643370 -2.182986 0.491545
H -3.963738 -1.528046 -1.122090
H -4.370169 0.691636 -0.087047
H -4.030215 0.018696 1.516618
H -3.675287 1.714951 1.171753
H 0.833737 2.031288 2.234718
H 2.080860 3.026429 1.614367


%chk=000267940-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000267940

0 1
O 2.070615 2.163317 -0.704134
N 1.176795 2.600305 1.382954
C 2.558896 -1.683365 -0.112479
C 1.706180 -0.842317 -1.125713
C 0.341267 -0.391799 -0.617960
C 0.111052 0.863396 0.023581
C -0.770789 -1.261160 -0.759028
C 2.891222 -0.898085 1.178034
C 1.917287 -3.049460 0.226837
C -2.072886 -0.948239 -0.305190
C -2.294164 0.311371 0.327914
C -1.196848 1.186852 0.477770
C -3.212837 -1.929687 -0.505777
C 1.197334 1.901155 0.180762
C -3.675683 0.714458 0.810624
H 3.516474 -1.884169 -0.638698
H 1.554404 -1.465901 -2.028927
H 2.293496 0.040433 -1.427650
H -0.608763 -2.225203 -1.257116
H 1.975177 -0.696289 1.764298
H 3.369801 0.070050 0.945524
H 3.578955 -1.479763 1.820112
H 2.591105 -3.646153 0.869983
H 0.962895 -2.918699 0.769365
H 1.712413 -3.637597 -0.688004
H -1.377124 2.175018 0.919370
H -2.864860 -2.852016 -1.000189
H -3.678165 -2.215639 0.457227
H -4.018296 -1.494755 -1.128849
H -4.407693 0.731893 -0.019799
H -4.068724 0.004426 1.563727
H -3.663914 1.718496 1.267755
H 0.565051 2.333867 2.151735
H 1.867427 3.337258 1.521739


