%chk=000206364.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206364

0 1
I 0.543494 -3.013789 -0.866979
I 0.216352 2.999374 -0.653791
I -4.844627 -0.402542 0.038213
O 3.435137 2.404883 1.399318
O 5.617785 -0.706452 1.382658
O 2.022546 0.118008 -1.909215
O 3.678052 -1.139883 2.423556
O -3.115005 -3.184407 -1.543669
O -1.811676 2.854856 1.957044
N 2.235263 0.109355 0.372671
N -2.928219 2.210083 0.055389
N -2.761223 -3.405132 0.713597
C 3.704815 0.205393 0.342331
C 4.201752 1.691942 0.438233
C 0.007262 -0.026688 -0.586074
C 1.503524 0.068214 -0.813402
C 4.164433 2.364826 -0.924034
C 4.251391 -0.612272 1.504448
C -0.615423 -1.277493 -0.584442
C -0.753156 1.132747 -0.417347
C -2.000163 -1.380983 -0.415308
C -2.141366 1.045691 -0.183589
C -2.755191 -0.227633 -0.211774
C -2.679480 -2.740207 -0.500161
C -2.672764 3.098631 1.143581
C -3.371868 -4.747330 0.792444
C -3.570562 4.296918 1.152425
H 4.092236 -0.235435 -0.627420
H 5.227535 1.713326 0.884861
H 1.795902 0.083658 1.296119
H 3.241579 2.145709 -1.485561
H 4.996514 2.041570 -1.561762
H 4.238047 3.454962 -0.820547
H 2.522035 2.595959 1.070421
H -3.806283 2.277779 -0.472960
H 6.035960 -1.219565 2.127199
H -2.370129 -3.026097 1.567818
H -4.215008 -4.746017 1.503055
H -2.628109 -5.496932 1.111022
H -3.761925 -5.057205 -0.198936
H -3.503976 4.878603 0.221049
H -3.281806 4.975462 1.974477
H -4.625553 4.034711 1.312644


%chk=000206364-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206364

0 1
I 0.624979 -3.004285 -0.814108
I 0.106795 3.138155 -0.646960
I -4.880996 -0.370802 0.093086
O 3.898366 2.443942 1.368038
O 5.538367 -0.778497 1.604830
O 2.036980 0.136725 -2.007150
O 3.402418 -0.882463 2.516012
O -3.093303 -3.197123 -1.599683
O -2.047769 2.746224 2.109947
N 2.286305 0.253072 0.312406
N -2.967358 2.244790 0.022368
N -2.748020 -3.407776 0.703608
C 3.753227 0.196191 0.318656
C 4.429181 1.618724 0.276357
C 0.039989 0.035299 -0.594846
C 1.539500 0.149370 -0.844417
C 4.293429 2.300849 -1.091903
C 4.168439 -0.540442 1.588860
C -0.585189 -1.237476 -0.577056
C -0.769026 1.187035 -0.438423
C -1.985584 -1.378638 -0.413089
C -2.169693 1.088421 -0.210667
C -2.755218 -0.207398 -0.218589
C -2.658055 -2.744346 -0.500990
C -2.877740 3.011687 1.199894
C -3.358463 -4.737063 0.825769
C -3.833601 4.196000 1.252926
H 4.100673 -0.370998 -0.565875
H 5.493163 1.484788 0.533899
H 1.829346 0.133031 1.224420
H 3.235860 2.431067 -1.379283
H 4.776248 1.702451 -1.884599
H 4.778067 3.291972 -1.049813
H 2.959469 2.684676 1.149846
H -3.747211 2.425431 -0.614495
H 5.794797 -1.221655 2.458070
H -2.362275 -2.959381 1.536968
H -4.205233 -4.717837 1.535393
H -2.617508 -5.484430 1.163932
H -3.729829 -5.027935 -0.169428
H -3.299282 5.106864 0.925176
H -4.151926 4.350798 2.295446
H -4.724218 4.067582 0.613069


