%chk=000207650.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207650

0 1
O 1.243502 2.473544 -0.359208
O 5.466431 -0.271354 -0.050511
O 4.277735 -2.069377 -0.650953
N 1.055206 0.184778 -0.090770
C 3.239144 -0.349179 0.772590
C 1.843371 -0.952269 0.447145
C 3.132652 1.161643 0.497845
C 1.724510 1.411963 -0.025096
C -0.369021 0.029460 -0.440209
C -1.278169 0.103678 0.802092
C 4.312492 -1.017742 -0.058823
C -2.718455 -0.045109 0.397029
C -3.434890 1.068369 -0.069243
C -3.351358 -1.294662 0.474012
C -4.771656 0.930775 -0.450414
C -4.689522 -1.426062 0.091800
C -5.402061 -0.315541 -0.370516
H 3.495732 -0.525777 1.847781
H 1.909094 -1.768346 -0.310003
H 1.368754 -1.377951 1.354890
H 3.885583 1.519212 -0.235120
H 3.312569 1.763274 1.409123
H -0.638635 0.846599 -1.155085
H -0.514765 -0.935623 -0.973348
H -1.121111 1.072585 1.323253
H -0.992427 -0.670925 1.539688
H -2.948120 2.040750 -0.134303
H -2.804112 -2.163678 0.831763
H 6.198338 -0.692689 -0.580713
H -5.324023 1.797422 -0.810867
H -5.177588 -2.397310 0.154672
H -6.443400 -0.419856 -0.667204


%chk=000207650-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207650

0 1
O 1.281451 2.462070 -0.405147
O 5.392582 -0.349170 -0.485455
O 3.789293 -1.910757 -1.092915
N 1.106613 0.176489 0.154789
C 3.344293 -0.340183 0.786878
C 1.887603 -0.884589 0.816798
C 3.182333 1.203317 0.640493
C 1.770550 1.394506 0.062175
C -0.285880 0.002150 -0.267011
C -1.299505 0.087836 0.914588
C 4.140450 -0.962437 -0.358568
C -2.731233 -0.060867 0.423689
C -3.410166 1.043845 -0.154539
C -3.400867 -1.309516 0.487411
C -4.724534 0.904919 -0.652837
C -4.716140 -1.453408 -0.010695
C -5.382455 -0.345647 -0.583292
H 3.890449 -0.590707 1.714151
H 1.803942 -1.836284 0.262485
H 1.547223 -1.046761 1.859379
H 3.939876 1.663663 -0.011215
H 3.237967 1.709780 1.621190
H -0.505396 0.805903 -0.992057
H -0.392682 -0.970612 -0.783702
H -1.157638 1.066255 1.410252
H -1.066508 -0.700800 1.655452
H -2.906606 2.017459 -0.206677
H -2.891340 -2.172044 0.935838
H 5.901841 -0.784579 -1.221686
H -5.235963 1.769325 -1.091383
H -5.220824 -2.424422 0.050438
H -6.402929 -0.454132 -0.967532


