%chk=000286161.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286161

0 1
O 6.065597 0.411598 -1.184120
O 5.537950 -1.254273 0.090571
O -4.005143 0.183675 -0.129763
O -3.403940 -1.661756 -1.278065
N 2.072542 0.292899 1.602169
N 5.322613 -0.165730 -0.414013
C 3.978858 0.538423 -0.046568
C 3.313030 -0.303026 1.084600
C 3.147128 0.550087 -1.323536
C 4.334148 1.945921 0.422266
C 0.823476 0.049128 1.008845
C -0.248676 0.922794 1.327230
C 0.593418 -1.073746 0.178222
C -1.747112 -0.451628 0.003203
C -1.518601 0.662720 0.830178
C -0.682790 -1.317861 -0.310663
C -3.077841 -0.749218 -0.548299
C -5.380837 -0.001903 -0.608486
C -6.130016 1.177623 0.003737
C -7.601359 1.148132 -0.392230
H 3.126081 -1.344291 0.721666
H 4.024455 -0.417947 1.939431
H 3.653079 1.090385 -2.138492
H 2.919256 -0.459168 -1.692753
H 2.179420 1.048317 -1.164198
H 3.438746 2.572567 0.521230
H 4.989878 2.459407 -0.302480
H 4.857325 1.952781 1.386338
H 2.197721 1.189229 2.069610
H -0.086743 1.783409 1.969829
H 1.405768 -1.757604 -0.058429
H -2.354533 1.326550 1.074211
H -0.874451 -2.187992 -0.948242
H -5.361838 0.008501 -1.710999
H -5.733291 -0.984127 -0.252059
H -5.657857 2.127809 -0.318971
H -6.022390 1.155437 1.107454
H -7.732777 1.207173 -1.479483
H -8.143098 1.994675 0.047059
H -8.097798 0.232031 -0.049702


%chk=000286161-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000286161

0 1
O 6.634877 -0.037327 0.214185
O 5.224304 -1.700106 -0.442286
O -4.179042 0.271364 -0.060332
O -3.487439 -1.558808 -1.332780
N 2.091906 0.588553 1.303213
N 5.471283 -0.479861 -0.104432
C 4.242698 0.484767 -0.036222
C 3.313324 -0.164023 1.063954
C 3.579603 0.480119 -1.428277
C 4.719144 1.883437 0.375897
C 0.812409 0.280284 0.824259
C -0.288106 1.089490 1.246327
C 0.555206 -0.810435 -0.059970
C -1.846341 -0.274225 -0.066394
C -1.591338 0.817268 0.808076
C -0.754775 -1.077952 -0.487334
C -3.203551 -0.607225 -0.558093
C -5.574670 0.005543 -0.508891
C -6.466162 1.070021 0.132530
C -7.944692 0.882097 -0.275524
H 3.079785 -1.197613 0.762031
H 3.895239 -0.220848 2.004436
H 4.225944 0.980232 -2.170634
H 3.380387 -0.548504 -1.769739
H 2.624302 1.028771 -1.374298
H 3.845394 2.558394 0.400528
H 5.445682 2.285799 -0.348518
H 5.201865 1.879330 1.368049
H 2.151724 1.364597 1.962706
H -0.107317 1.931624 1.926724
H 1.370384 -1.446969 -0.415578
H -2.426890 1.441046 1.137574
H -0.957448 -1.916452 -1.162155
H -5.605406 0.046327 -1.613935
H -5.857671 -1.017760 -0.198210
H -6.111034 2.072053 -0.173467
H -6.364293 1.013165 1.232574
H -8.071707 0.957824 -1.371682
H -8.581814 1.653790 0.191451
H -8.326365 -0.106786 0.040537


