%chk=000225623.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225623

0 1
O 5.703145 -1.191344 0.679355
N 2.534499 1.549573 1.388174
N 5.578218 -1.036911 -1.572456
C -0.549121 -0.275855 0.432531
C -1.281377 -1.587036 0.251390
C -1.424378 0.819538 0.156528
C -2.666639 -1.147581 -0.165259
C -2.736153 0.281828 -0.215310
C 0.765952 -0.073046 0.803490
C 1.228882 1.263687 0.918367
C -0.962925 2.124463 0.270066
C -3.770860 -1.921323 -0.472514
C -3.916524 0.915474 -0.573581
C 0.366327 2.349177 0.644457
C 3.610797 0.547724 1.248081
C -4.965617 -1.269324 -0.835995
C -5.036217 0.121830 -0.885141
C 4.041769 0.329288 -0.216995
C 5.159747 -0.686040 -0.287237
H -1.302215 -2.175646 1.188806
H -0.802819 -2.226587 -0.513191
H 1.420115 -0.909755 1.027543
H -1.623204 2.966532 0.068343
H -3.728568 -3.006226 -0.436338
H -3.981635 1.999050 -0.613360
H 0.724639 3.369865 0.739848
H 2.850436 2.507794 1.233944
H 4.482989 0.883676 1.857391
H 3.288046 -0.421593 1.697053
H -5.842532 -1.865953 -1.079871
H -5.968884 0.607090 -1.167310
H 3.167955 -0.003885 -0.816931
H 4.367395 1.286890 -0.670593
H 5.163185 -0.680446 -2.411779
H 6.316474 -1.715027 -1.688306


%chk=000225623-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000225623

0 1
O 6.366134 -0.318197 0.675610
N 2.564240 1.639243 1.090593
N 5.597833 -1.549356 -1.133529
C -0.551537 -0.226739 0.202792
C -1.241577 -1.548445 -0.124871
C -1.506777 0.833250 0.186144
C -2.696079 -1.134056 -0.333732
C -2.829333 0.277844 -0.145485
C 0.801905 0.008242 0.488007
C 1.233700 1.340322 0.778269
C -1.083441 2.152679 0.469445
C -3.812662 -1.921591 -0.658924
C -4.091584 0.898471 -0.286352
C 0.269996 2.399314 0.761812
C 3.661133 0.674631 1.111391
C -5.079694 -1.297248 -0.799726
C -5.213632 0.101134 -0.614296
C 4.204894 0.320324 -0.303017
C 5.474792 -0.531984 -0.200214
H -1.136785 -2.282659 0.698323
H -0.815269 -2.024877 -1.029952
H 1.514829 -0.823023 0.499451
H -1.796294 2.985194 0.465938
H -3.714206 -3.004352 -0.802331
H -4.206119 1.979345 -0.144597
H 0.601481 3.421307 0.987005
H 2.788865 2.614128 1.284008
H 4.498936 1.088767 1.697935
H 3.344470 -0.250491 1.630806
H -5.959988 -1.898920 -1.052665
H -6.198668 0.568931 -0.726105
H 3.425146 -0.174076 -0.910461
H 4.469785 1.263414 -0.818858
H 4.884317 -1.728281 -1.837692
H 6.442090 -2.122344 -1.121523


