%chk=000206953.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206953

0 1
O 3.741393 0.594877 0.864307
O 2.256353 2.252196 0.573737
O -3.599686 1.837043 -0.630513
O -1.448337 2.237179 -0.655949
N 0.129241 0.406506 0.715721
N -1.041081 -1.645476 -0.055787
N -2.234298 0.311359 0.155146
N -2.434074 1.558006 -0.438964
C 1.728819 -0.815907 -0.836903
C 1.511134 -0.113358 0.514637
C 1.285024 -2.283694 -0.824758
C 0.072460 -2.591876 0.071433
C -0.945378 -0.379848 0.219278
C 2.472767 1.069023 0.641024
H 2.803972 -0.770025 -1.115742
H 1.193953 -0.265409 -1.639119
H 1.729232 -0.828202 1.361730
H 1.054586 -2.588005 -1.867750
H 2.128703 -2.928767 -0.505612
H -0.355390 -3.584743 -0.216807
H 0.388015 -2.688182 1.136078
H 0.045973 1.435470 0.589568
H -3.071933 -0.311884 0.205308
H 4.413054 1.326617 0.961838


%chk=000206953-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206953

0 1
O 3.769353 0.733975 0.604284
O 2.036268 2.283315 0.638348
O -3.661659 2.009763 -0.456760
O -1.553559 2.489972 0.328750
N 0.131402 0.342961 0.516329
N -1.059886 -1.667732 -0.248819
N -2.167102 0.314028 -0.198397
N -2.466693 1.678638 -0.107593
C 1.825500 -0.960572 -0.827525
C 1.527169 -0.135998 0.460023
C 1.323836 -2.431023 -0.742871
C 0.033311 -2.603502 0.097644
C -0.932604 -0.394688 0.030982
C 2.423935 1.098761 0.566161
H 2.913416 -0.955233 -1.011467
H 1.345342 -0.437304 -1.674859
H 1.775191 -0.756926 1.345753
H 1.148606 -2.797420 -1.771377
H 2.108193 -3.075210 -0.299192
H -0.352877 -3.627150 -0.047865
H 0.282915 -2.511093 1.177967
H -0.014855 1.354290 0.672636
H -2.945363 -0.266606 -0.527391
H 4.334662 1.547654 0.697139


