%chk=000229959.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229959

0 1
I 3.878799 -0.775422 0.030665
O -3.117131 -0.951046 -0.018221
O -2.875138 1.197212 0.042223
N -2.435824 0.059469 0.007266
N 2.053280 2.023738 -0.128843
C -0.951871 -0.107245 -0.002634
C 1.260481 0.883337 -0.026700
C -0.153029 1.029926 -0.014289
C -0.414759 -1.400701 0.002303
C 1.802772 -0.423523 -0.005684
C 0.974857 -1.543965 0.000641
H -0.611520 2.022904 -0.025250
H -1.072612 -2.273480 0.007841
H 1.406534 -2.550548 0.007702
H 1.649844 2.920206 0.090620
H 3.050918 1.945037 0.031860


%chk=000229959-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000229959

0 1
I 3.935210 -0.725609 -0.000861
O -3.172842 -0.995587 0.001157
O -2.896387 1.267481 -0.001366
N -2.431312 0.061425 0.000474
N 2.072417 2.025273 -0.000763
C -0.958483 -0.120453 0.000240
C 1.269650 0.897855 -0.000908
C -0.149653 1.027845 -0.000655
C -0.432927 -1.430549 0.000233
C 1.803887 -0.432176 -0.000622
C 0.969084 -1.567873 -0.000266
H -0.623426 2.013893 -0.002007
H -1.100413 -2.293917 0.001269
H 1.415245 -2.565913 0.000111
H 1.658650 2.952953 0.004718
H 3.086900 1.941251 -0.001251


