%chk=000280092.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000280092

0 1
O -0.370555 3.069880 -0.000563
O -2.533131 2.450010 0.001687
N -0.683029 -1.483398 -0.000044
C 0.660573 -0.996778 -0.000064
C 0.588890 0.403167 0.000154
C -1.571034 -0.404416 0.000190
C -0.797142 0.770967 0.000332
C 1.743091 -1.959686 -0.000288
C 1.423423 -3.342328 -0.000470
C -0.982917 -2.866226 -0.000228
C 1.720537 1.336244 0.000227
C -3.026730 -0.584635 0.000183
C 0.031625 -3.763798 -0.000429
C 3.098782 -1.563646 -0.000338
C -1.364887 2.118997 0.000682
C 2.464534 -4.297755 -0.000690
C 2.263793 1.781455 1.216356
C 2.263521 1.781981 -1.215833
C -3.720297 -0.667332 -1.216888
C -3.720631 -0.664686 1.217240
C 4.106548 -2.517103 -0.000562
C 3.789935 -3.889168 -0.000737
C 3.345063 2.666228 1.211476
C 3.344795 2.666746 -1.210811
C -5.106867 -0.840416 -1.211891
C -5.107202 -0.837782 1.212232
C 3.887593 3.108181 0.000367
C -5.799724 -0.928044 0.000172
C -0.798129 4.475659 -0.000381
C 0.511042 5.236302 -0.001766
H -2.044163 -3.130943 -0.000195
H -0.175915 -4.834483 -0.000560
H 3.352186 -0.501312 -0.000199
H 2.218039 -5.358577 -0.000817
H 1.832878 1.443595 2.157300
H 1.832378 1.444541 -2.156824
H -3.179922 -0.580977 -2.158799
H -3.180511 -0.576250 2.159108
H 5.151077 -2.207023 -0.000607
H 4.592045 -4.625701 -0.000910
H 3.764486 3.013154 2.153999
H 3.764012 3.014075 -2.153278
H -5.649073 -0.897564 -2.154453
H -5.649669 -0.892871 2.154768
H 4.729859 3.796437 0.000421
H -6.880826 -1.057800 0.000166
H -1.410291 4.642023 -0.902725
H -1.408545 4.642321 0.903090
H 0.346049 6.318473 -0.001769
H 1.121319 4.977560 0.875681
H 1.119618 4.977300 -0.880312


%chk=000280092-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000280092

0 1
O -0.388134 3.159777 -0.000229
O -2.593676 2.409543 0.003965
N -0.672103 -1.451301 -0.000215
C 0.682812 -0.987066 -0.000267
C 0.636380 0.424474 0.000451
C -1.554807 -0.369587 0.000622
C -0.763076 0.803873 0.001070
C 1.749500 -1.978867 -0.000826
C 1.392846 -3.377939 -0.001347
C -1.003346 -2.813953 -0.000700
C 1.816793 1.337813 0.000696
C -3.027495 -0.576240 0.000418
C -0.009461 -3.757540 -0.001257
C 3.132863 -1.632529 -0.000838
C -1.360510 2.152899 0.001855
C 2.415979 -4.367933 -0.001873
C 2.391975 1.777707 1.220934
C 2.392448 1.777799 -1.219286
C -3.738171 -0.694213 -1.222003
C -3.739896 -0.685380 1.222629
C 4.125182 -2.627583 -0.001358
C 3.771676 -4.003732 -0.001883
C 3.512470 2.638310 1.223013
C 3.512949 2.638388 -1.220865
C -5.134150 -0.908153 -1.222683
C -5.135849 -0.899340 1.222856
C 4.077827 3.072657 0.001200
C -5.837032 -1.011470 -0.000020
C -0.902428 4.559835 0.000469
C 0.322065 5.470719 -0.002670
H -2.069865 -3.044893 -0.000538
H -0.281709 -4.816992 -0.001590
H 3.426100 -0.580736 -0.000432
H 2.127254 -5.426023 -0.002257
H 1.953347 1.445499 2.168439
H 1.954164 1.445692 -2.166985
H -3.195601 -0.600513 -2.169449
H -3.198663 -0.584802 2.170114
H 5.180967 -2.335296 -0.001351
H 4.551671 -4.772577 -0.002280
H 3.943944 2.968001 2.175191
H 3.944788 2.968157 -2.172851
H -5.672213 -0.987529 -2.173847
H -5.675258 -0.971876 2.173801
H 4.947587 3.739552 0.001392
H -6.920941 -1.172663 -0.000195
H -1.539491 4.700247 -0.892087
H -1.535350 4.700857 0.895872
H 0.003131 6.529399 -0.002237
H 0.946607 5.290322 0.888783
H 0.942402 5.289803 -0.896950


