%chk=000249536.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249536

0 1
O 2.842021 0.715031 1.755207
O 1.192261 -0.802604 -2.280011
N 1.887984 0.275901 -0.322935
N -2.703620 -0.176607 0.467084
C 1.237039 1.614156 -0.521126
C -0.291751 1.478576 -0.405300
C -0.748102 1.271168 1.042076
C -2.273873 1.092350 1.141900
C 1.650161 2.184342 -1.878538
C 3.090492 -1.499773 0.721974
C 2.521715 -2.004832 -0.608744
C 2.633279 -0.053222 0.848541
C 1.771786 -0.827660 -1.224031
C -4.174700 -0.162008 0.168553
C -2.324724 -1.380007 1.280638
C -4.456456 0.757180 -1.021453
C -2.297563 -2.621273 0.386713
H 1.627808 2.277287 0.300908
H -0.659788 0.635948 -1.034292
H -0.775527 2.378490 -0.829902
H -0.444126 2.132465 1.668064
H -0.237121 0.386570 1.474335
H -2.583336 1.138570 2.208364
H -2.775457 1.945709 0.632831
H 1.289124 1.554559 -2.707385
H 1.240120 3.189016 -2.026382
H 2.739190 2.254600 -1.976646
H 4.195620 -1.555225 0.757431
H 2.733671 -2.091208 1.586638
H 1.834627 -2.862513 -0.475931
H 3.310777 -2.357246 -1.299891
H -4.486113 -1.198371 -0.094477
H -4.790076 0.141425 1.042517
H -1.305160 -1.211022 1.697936
H -2.998349 -1.545569 2.148464
H -5.489763 0.651295 -1.365182
H -3.792456 0.515115 -1.863526
H -4.287112 1.811341 -0.776273
H -1.857446 -3.475472 0.908435
H -1.709013 -2.431507 -0.522425
H -3.301746 -2.908676 0.054639


%chk=000249536-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249536

0 1
O 3.310382 1.313445 1.364956
O 0.867808 -1.287568 -1.688267
N 1.921008 0.277538 -0.247984
N -2.806117 -0.191317 0.475857
C 1.180280 1.514372 -0.638068
C -0.339271 1.378748 -0.368107
C -0.693914 1.052422 1.096753
C -2.217657 0.886278 1.310817
C 1.487225 1.879900 -2.106762
C 3.492900 -1.131552 0.879189
C 2.675095 -1.986001 -0.114447
C 2.942710 0.291635 0.736925
C 1.707934 -1.008056 -0.797903
C -4.249440 0.008480 0.184915
C -2.505062 -1.559053 0.977200
C -4.510312 1.098628 -0.872909
C -2.425629 -2.602062 -0.155920
H 1.600759 2.292719 0.028877
H -0.779918 0.609215 -1.025115
H -0.802416 2.346172 -0.650584
H -0.328072 1.852944 1.772152
H -0.172808 0.124696 1.407485
H -2.421608 0.724466 2.400612
H -2.712375 1.837160 1.037294
H 1.108917 1.102987 -2.792309
H 0.994960 2.836176 -2.358883
H 2.573332 2.001606 -2.267042
H 4.573845 -1.118880 0.657180
H 3.385055 -1.453889 1.928943
H 2.087191 -2.781393 0.375215
H 3.294516 -2.473013 -0.886666
H -4.647506 -0.949596 -0.196975
H -4.827141 0.240338 1.117166
H -1.527708 -1.527234 1.493497
H -3.252822 -1.883160 1.745321
H -5.592756 1.177883 -1.087115
H -3.979302 0.851044 -1.808548
H -4.163819 2.093112 -0.537504
H -2.209325 -3.607275 0.254200
H -1.628332 -2.327215 -0.868177
H -3.376309 -2.668402 -0.716470


