%chk=000127066.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000127066

0 1
O -1.587704 1.628351 1.059206
N 2.872933 -0.047178 -0.267730
N 0.035904 0.218881 0.236553
N -2.362837 -0.107651 -0.250411
C 2.362712 0.414975 1.064668
C 1.881273 -0.989781 -0.884211
C 1.023168 1.149867 0.878604
C 0.537144 -0.260382 -1.085794
C 4.215904 -0.708663 -0.143661
C -1.323733 0.638487 0.381603
C 5.290628 0.336631 0.156267
C -2.268538 -1.591658 -0.338298
C -3.748712 0.406945 0.009782
C -2.125540 -2.279273 1.017635
C -4.528435 0.459025 -1.302337
H 3.103821 1.124466 1.493663
H 2.241637 -0.415550 1.793499
H 1.722378 -1.909282 -0.279994
H 2.270717 -1.305142 -1.876365
H 0.620573 1.476613 1.864852
H 1.165997 2.068818 0.267394
H 0.668745 0.589106 -1.794178
H -0.201084 -0.963584 -1.539986
H 4.235559 -1.509569 0.626807
H 4.447034 -1.195541 -1.117925
H 5.196064 1.199554 -0.518405
H 5.221069 0.719889 1.179922
H 6.293378 -0.082571 0.023647
H -3.173426 -1.963619 -0.869506
H -1.394850 -1.843276 -0.991780
H -4.273041 -0.225830 0.756770
H -3.683688 1.431773 0.454330
H -2.955393 -2.036168 1.691395
H -1.199748 -1.973063 1.525702
H -2.095972 -3.368529 0.910053
H -4.688305 -0.535862 -1.731145
H -3.995470 1.053789 -2.056344
H -5.510659 0.920800 -1.150681


%chk=000127066-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127066

0 1
O -1.690144 1.771062 1.163869
N 2.796333 -0.008273 -0.336429
N 0.002586 0.496547 0.162317
N -2.283930 -0.158557 -0.054887
C 2.313033 0.399704 1.008747
C 1.742423 -0.757369 -1.065381
C 1.036064 1.252245 0.901055
C 0.470526 0.099293 -1.185709
C 4.078810 -0.757034 -0.300553
C -1.348311 0.763516 0.461505
C 5.269346 0.095962 0.175083
C -2.022847 -1.621029 -0.052451
C -3.710781 0.247880 -0.060394
C -2.230779 -2.269024 1.337323
C -4.300956 0.284416 -1.485326
H 3.096038 0.998323 1.505823
H 2.100200 -0.494294 1.651031
H 1.485884 -1.721293 -0.550561
H 2.120024 -1.001139 -2.076510
H 0.642320 1.505753 1.898186
H 1.269470 2.203336 0.377051
H 0.717783 1.013313 -1.769184
H -0.324385 -0.438800 -1.723967
H 3.998644 -1.676558 0.337201
H 4.280120 -1.103460 -1.332901
H 5.334058 1.023403 -0.420551
H 5.188506 0.373248 1.241122
H 6.212362 -0.467399 0.051963
H -2.697359 -2.088029 -0.795447
H -0.991211 -1.821143 -0.381822
H -4.298037 -0.444950 0.575798
H -3.766366 1.242013 0.413121
H -3.258517 -2.113564 1.710390
H -1.529217 -1.835289 2.071663
H -2.048809 -3.358828 1.284013
H -4.231860 -0.700984 -1.983087
H -3.762935 1.021176 -2.107233
H -5.368587 0.571626 -1.451267


