%chk=000248945.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248945

0 1
O 0.416155 2.299707 0.130206
O 3.963669 -1.273352 2.795575
O 6.230112 0.319947 -0.792246
O -1.018560 -1.488035 -1.105960
N 5.067685 -0.481694 0.982599
C 2.628040 0.350574 -0.198995
C 1.335438 0.354210 -1.031019
C 0.155343 0.941447 -0.245725
C 2.583302 -0.733851 0.890110
C 3.846943 0.123430 -1.108985
C -1.162308 0.896171 -1.039279
C 3.870142 -0.860154 1.660518
C 5.142882 0.022516 -0.345831
C -1.716896 -0.504335 -1.194994
C -3.223211 -0.573113 -1.479170
C -3.576635 -1.879961 -2.189759
C -3.932872 -0.464174 -0.158043
C -4.626428 0.606764 0.260762
C -4.793218 1.870026 -0.524172
C -5.281301 0.623728 1.587081
C -6.049403 -0.362692 2.048227
H 2.730718 1.351554 0.299511
H 1.069468 -0.681559 -1.348077
H 1.489164 0.915923 -1.970628
H 0.031480 0.448542 0.748772
H 1.756273 -0.527847 1.607218
H 2.329798 -1.726410 0.453551
H 3.721597 -0.802940 -1.712500
H 3.937744 0.941620 -1.855899
H -1.037422 1.349299 -2.041646
H -1.900162 1.547214 -0.517280
H 5.951918 -0.564771 1.507024
H -3.510971 0.283220 -2.145156
H 0.639776 2.853767 -0.640553
H -4.662446 -2.017403 -2.249797
H -3.175816 -1.906169 -3.208858
H -3.159396 -2.749139 -1.659515
H -3.850906 -1.355751 0.468072
H -5.845840 2.190602 -0.539460
H -4.213295 2.692820 -0.082930
H -4.476904 1.761493 -1.571395
H -5.096262 1.528418 2.172666
H -6.527106 -0.335687 3.017901
H -6.263387 -1.266355 1.493377


%chk=000248945-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248945

0 1
O 0.479112 2.385128 0.255002
O 4.145854 -1.318319 2.784725
O 6.351822 0.141762 -1.016174
O -1.088088 -1.524053 -0.704351
N 5.176801 -0.559282 0.854970
C 2.724677 0.368475 -0.218106
C 1.389426 0.433219 -0.996296
C 0.211214 0.993447 -0.173889
C 2.689133 -0.702656 0.899033
C 3.896798 0.064603 -1.180870
C -1.137731 0.914956 -0.918397
C 4.024462 -0.888517 1.607783
C 5.238376 -0.095729 -0.477397
C -1.740125 -0.490313 -1.013122
C -3.220776 -0.570043 -1.457255
C -3.523610 -1.908343 -2.170015
C -4.058673 -0.417667 -0.192377
C -4.827563 0.650506 0.190508
C -4.940599 1.956798 -0.581857
C -5.619043 0.613681 1.449819
C -6.152301 -0.487867 2.047320
H 2.897476 1.357406 0.253139
H 1.117456 -0.580061 -1.348237
H 1.522044 1.071468 -1.897582
H 0.118081 0.448384 0.780238
H 1.948774 -0.466495 1.680895
H 2.392049 -1.683168 0.471708
H 3.694424 -0.876346 -1.734859
H 4.022747 0.856656 -1.939141
H -1.037185 1.310524 -1.953880
H -1.868009 1.572525 -0.407705
H 6.078114 -0.684747 1.333352
H -3.417483 0.275539 -2.142691
H 0.622289 2.941932 -0.554025
H -4.595074 -1.970947 -2.427410
H -2.931612 -2.006603 -3.097959
H -3.263846 -2.758334 -1.516448
H -4.002879 -1.284837 0.482032
H -5.999703 2.186324 -0.805193
H -4.555046 2.799591 0.025792
H -4.387838 1.951010 -1.535156
H -5.805479 1.595356 1.913391
H -6.710908 -0.408324 2.985992
H -6.060655 -1.489038 1.609992


