%chk=000274661.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274661

0 1
O 0.495201 -1.681490 -1.584700
O 1.688859 2.447611 0.500124
O 4.400859 -1.219672 0.733232
N 2.410767 -1.456760 -0.408284
N 3.023786 0.626631 0.621938
C -1.768705 -0.074056 -0.202298
C -0.469448 0.323970 0.531503
C -2.874902 -0.341510 0.838026
C 0.746423 0.423608 -0.420323
C -2.190552 0.982586 -1.244433
C -4.077383 -1.074036 0.226308
C 1.156236 -0.963490 -0.871015
C 1.810349 1.271086 0.249643
C -2.421960 2.380134 -0.678888
C -5.156367 -1.354183 1.269552
C 3.362689 -0.727494 0.353266
H -1.573571 -1.029973 -0.760246
H -0.617541 1.307000 1.030888
H -0.252092 -0.400582 1.339971
H -3.208369 0.612669 1.290452
H -2.469730 -0.944253 1.673817
H 0.407838 0.988354 -1.345484
H -1.422322 1.029088 -2.043595
H -3.115934 0.632065 -1.747139
H -3.745505 -2.025997 -0.233513
H -4.504547 -0.471411 -0.600282
H -3.176560 2.372665 0.117201
H -2.776082 3.066616 -1.456650
H -1.505075 2.810635 -0.258224
H -5.534497 -0.429315 1.719730
H -6.011875 -1.873911 0.822988
H -4.779910 -1.984744 2.083022
H 2.668770 -2.425020 -0.662462
H 3.731749 1.187878 1.124274


%chk=000274661-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000274661

0 1
O 0.651850 -1.282585 -2.028335
O 1.749141 2.500209 0.748295
O 4.278144 -1.406994 0.881935
N 2.390028 -1.348949 -0.498456
N 2.959808 0.524755 0.830426
C -1.739674 -0.141545 -0.225181
C -0.448358 0.318265 0.503805
C -2.839145 -0.378851 0.851140
C 0.804343 0.568831 -0.423939
C -2.181164 0.835162 -1.352696
C -4.160556 -0.968362 0.305827
C 1.257943 -0.732626 -1.073017
C 1.861208 1.296409 0.402996
C -2.465851 2.287201 -0.903670
C -5.149679 -1.333868 1.433838
C 3.275419 -0.791995 0.444008
H -1.537336 -1.116944 -0.713499
H -0.635153 1.273365 1.030300
H -0.176192 -0.429403 1.275822
H -3.056122 0.569496 1.385386
H -2.436849 -1.075591 1.616990
H 0.486416 1.255013 -1.227408
H -1.410792 0.834151 -2.148632
H -3.087393 0.419374 -1.832795
H -3.937058 -1.871091 -0.298826
H -4.642533 -0.244215 -0.379648
H -3.263153 2.329142 -0.139030
H -2.799321 2.898259 -1.762167
H -1.569764 2.778254 -0.480068
H -5.401465 -0.445973 2.044370
H -6.092964 -1.742034 1.026938
H -4.716975 -2.093959 2.111578
H 2.651816 -2.272658 -0.858577
H 3.631980 0.974454 1.460691


