%chk=000228532.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228532

0 1
O -2.123386 2.194404 1.257057
O 3.994399 -1.479022 -1.205656
N 3.866500 0.078938 0.493533
C -0.292206 0.825897 0.664393
C 2.458448 0.305854 0.515343
C -1.741596 1.149585 0.767457
C -2.721352 0.140730 0.248244
C 0.209780 -0.068695 -0.292985
C 0.599701 1.474181 1.537362
C 1.574539 -0.333530 -0.373236
C 1.965290 1.217675 1.477249
C -2.609137 -1.213338 0.591818
C -3.783773 0.577656 -0.554838
C -3.552697 -2.129838 0.120445
C -4.719577 -0.344306 -1.032423
C -4.604151 -1.696724 -0.695117
C 4.562002 -0.804676 -0.374047
C 6.047862 -0.813962 -0.152341
H -0.471596 -0.560873 -0.992324
H 0.204399 2.189024 2.266595
H 1.954904 -1.033873 -1.125763
H 2.638309 1.723452 2.164479
H -1.791651 -1.549497 1.230473
H -3.878776 1.637855 -0.796599
H 4.410783 0.615234 1.173865
H -3.469536 -3.181665 0.389012
H -5.541820 -0.006869 -1.661436
H -5.336079 -2.413924 -1.064749
H 6.508740 0.167078 -0.330468
H 6.524422 -1.519810 -0.855563
H 6.323854 -1.142061 0.858820


%chk=000228532-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000228532

0 1
O -2.079917 2.265681 1.001801
O 4.246215 -1.600878 -1.143420
N 3.947277 0.062806 0.489026
C -0.263605 0.762988 0.542911
C 2.542158 0.262667 0.464342
C -1.719401 1.115777 0.587671
C -2.763958 0.124478 0.150801
C 0.287173 -0.181353 -0.365075
C 0.623718 1.471504 1.399706
C 1.671811 -0.433976 -0.417688
C 2.001565 1.220465 1.371186
C -2.602036 -1.279725 0.300922
C -3.994049 0.629106 -0.351308
C -3.647300 -2.159452 -0.057110
C -5.029397 -0.250365 -0.724362
C -4.858303 -1.648926 -0.579075
C 4.726590 -0.817610 -0.276346
C 6.220377 -0.741244 0.038247
H -0.368358 -0.704180 -1.068869
H 0.201903 2.221253 2.076681
H 2.090263 -1.151386 -1.125024
H 2.669676 1.767192 2.049495
H -1.677712 -1.681009 0.729296
H -4.115612 1.714415 -0.431642
H 4.458036 0.643501 1.159451
H -3.519530 -3.239403 0.075769
H -5.969075 0.148177 -1.122255
H -5.665479 -2.333677 -0.862689
H 6.621927 0.269552 -0.161748
H 6.749717 -1.463346 -0.599296
H 6.421925 -0.988130 1.097202


