%chk=000268078.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268078

0 1
O -0.803015 1.890458 -0.816505
O 0.100153 -1.159478 0.615644
N -0.997519 0.831389 0.086958
N 1.376875 0.645317 -0.129580
N -2.539168 -1.179491 -2.270596
C -2.372657 0.219553 -0.039756
C -3.394338 1.384600 -0.088770
C -2.623273 -0.690548 1.184930
C -4.834859 0.866442 -0.043937
C -4.073393 -1.182706 1.224372
C -5.071082 -0.018994 1.185865
C -2.459386 -0.570541 -1.294308
C 0.192444 -0.020096 0.201151
C 2.695320 0.100483 0.042997
C 3.805852 0.982891 -0.031744
C 2.893089 -1.274121 0.247113
C 5.092839 0.445697 0.090800
C 3.636870 2.454498 -0.233826
C 4.188881 -1.779555 0.369622
C 5.289127 -0.924244 0.289628
H -3.232864 2.008880 -0.988082
H -3.201752 2.057393 0.774314
H -2.381400 -0.127512 2.109536
H -1.925085 -1.558414 1.174330
H -5.065950 0.299027 -0.967540
H -5.534748 1.724329 -0.033706
H -4.228767 -1.785529 2.140481
H -4.262515 -1.871299 0.376354
H -4.981082 0.585629 2.109183
H -6.106327 -0.409537 1.176770
H -0.866818 1.537056 -1.767057
H 1.316340 1.645312 -0.368329
H 2.037238 -1.954266 0.317975
H 5.957428 1.106676 0.033091
H 4.596655 2.990120 -0.196182
H 3.194261 2.682834 -1.213679
H 3.004805 2.903677 0.546343
H 4.334891 -2.847636 0.528266
H 6.298430 -1.319792 0.383474


%chk=000268078-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268078

0 1
O -0.689325 1.900990 -0.742973
O 0.082390 -1.377351 0.519359
N -0.948485 0.713262 0.094960
N 1.389542 0.538198 0.045602
N -2.583034 -0.912834 -2.466531
C -2.356334 0.205256 -0.029567
C -3.331629 1.427102 0.059477
C -2.697047 -0.793843 1.124999
C -4.814058 0.994867 0.032448
C -4.182314 -1.220420 1.094379
C -5.137036 -0.009012 1.161600
C -2.505887 -0.447166 -1.370034
C 0.200519 -0.156086 0.219785
C 2.720098 0.038606 0.149529
C 3.781778 0.964469 -0.106564
C 3.005784 -1.309407 0.490396
C 5.113083 0.498736 -0.009033
C 3.495342 2.410213 -0.478516
C 4.346325 -1.740230 0.576289
C 5.407429 -0.841825 0.328984
H -3.121791 2.140541 -0.754659
H -3.096399 1.942392 1.010473
H -2.471926 -0.263789 2.071055
H -2.033796 -1.667762 1.067085
H -5.053249 0.539104 -0.949469
H -5.445862 1.898582 0.123274
H -4.363257 -1.905078 1.944285
H -4.383158 -1.803290 0.172987
H -5.024939 0.493778 2.144146
H -6.189392 -0.342259 1.087148
H -0.728445 1.590837 -1.699565
H 1.272822 1.534571 -0.160441
H 2.181427 -1.998469 0.680886
H 5.931595 1.202180 -0.203662
H 4.435549 2.964963 -0.631255
H 2.914141 2.492784 -1.419182
H 2.930612 2.945127 0.311736
H 4.556342 -2.782882 0.839180
H 6.448088 -1.176351 0.396989


