%chk=000212819.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212819

0 1
O -2.919389 -1.314409 0.635708
N -2.273678 0.803008 -0.098361
N -3.694903 -0.620623 -1.411016
C 0.104524 0.416627 0.525768
C 1.120926 1.300466 0.119805
C -1.250116 0.894232 0.983385
C 2.595292 -0.594889 -0.305179
C 2.361480 0.785432 -0.290376
C 0.344232 -0.967719 0.504584
C 1.573951 -1.474461 0.094339
C 0.915608 2.782835 0.122914
C 3.916676 -1.141120 -0.739788
C -2.945419 -0.444931 -0.222206
H -1.596859 0.291777 1.861326
H -1.231893 1.953086 1.325096
H 3.149687 1.468148 -0.598954
H -0.455198 -1.651908 0.810653
H 1.743433 -2.548500 0.083839
H 1.743346 3.322654 -0.356594
H -0.000961 3.071828 -0.407537
H 0.840411 3.167424 1.150815
H -1.980981 1.260718 -0.964446
H 4.618275 -0.359703 -1.057859
H 4.401554 -1.698361 0.075026
H 3.802342 -1.836132 -1.584077
H -4.017824 0.177742 -1.933993
H -4.350818 -1.394020 -1.403974


%chk=000212819-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212819

0 1
O -3.587645 -0.190045 1.395232
N -2.296669 0.290589 -0.501317
N -4.300175 -0.932495 -0.697485
C 0.144336 0.493780 0.035427
C 1.276222 1.351956 0.161369
C -1.271917 1.031132 0.242789
C 2.787757 -0.565832 -0.302192
C 2.572634 0.803547 -0.012434
C 0.353011 -0.878297 -0.248508
C 1.650105 -1.404276 -0.415858
C 1.124707 2.830436 0.487906
C 4.190776 -1.123960 -0.473858
C -3.401949 -0.268045 0.141528
H -1.569456 0.955139 1.307471
H -1.314236 2.105760 -0.022386
H 3.441192 1.468140 0.084161
H -0.518853 -1.537799 -0.328204
H 1.782219 -2.472081 -0.631143
H 2.111693 3.315289 0.576648
H 0.557355 3.371180 -0.294805
H 0.586800 2.989009 1.441569
H -2.184818 0.203056 -1.511824
H 4.952011 -0.325796 -0.433063
H 4.430866 -1.856537 0.320251
H 4.301481 -1.647542 -1.441884
H -4.189347 -1.008133 -1.706066
H -5.114399 -1.348976 -0.254428


