%chk=000240520.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240520

0 1
O 2.103913 1.108211 0.248364
O 2.552309 -1.510748 2.141490
O 1.670143 -1.804074 -1.320078
O 4.858979 -0.385562 0.671460
O -4.526827 1.338792 -0.181017
N -0.049487 0.723317 1.032378
N -0.639697 1.853049 1.692741
N -1.902717 2.059849 1.239236
N -1.026963 -0.934870 -0.506480
N -3.429778 -0.508758 -1.009484
N -2.288952 -2.340989 -1.926818
C 1.705934 -1.131633 1.074684
C 1.376253 0.382851 1.245183
C 2.441405 -1.240791 -0.289371
C 2.861774 0.211772 -0.623378
C 4.339566 0.511514 -0.324475
C -1.051106 0.165652 0.234946
C -2.229324 1.059526 0.436194
C -3.524808 0.681953 -0.263355
C -2.298324 -1.224498 -1.123374
H 0.825996 -1.810279 1.160005
H 1.703819 0.785463 2.237579
H 3.309310 -1.939844 -0.220217
H 2.567736 0.513603 -1.651745
H 4.434278 1.510521 0.156472
H 4.961547 0.476796 -1.233479
H 3.463340 -1.100958 2.034425
H 0.736817 -1.435614 -1.338022
H -0.028801 2.672524 1.838014
H 5.308934 -1.147609 0.248136
H -1.499719 -2.968233 -1.928508
H -3.156352 -2.663234 -2.337005


%chk=000240520-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240520

0 1
O 2.057039 1.002767 0.033218
O 2.824292 -1.231405 2.279668
O 1.303487 -2.030296 -1.025777
O 4.744034 -0.137270 0.768353
O -4.592021 1.293268 -0.048052
N -0.080673 0.673119 1.091741
N -0.689893 1.746246 1.784409
N -1.997130 1.903265 1.479915
N -0.968649 -0.794335 -0.653862
N -3.364093 -0.384937 -1.158565
N -2.134872 -2.041640 -2.246974
C 1.795066 -1.088575 1.267989
C 1.374899 0.419912 1.184368
C 2.301870 -1.433607 -0.176560
C 2.803322 -0.059249 -0.721966
C 4.304101 0.202232 -0.602286
C -1.067129 0.187189 0.247436
C -2.255833 0.963410 0.526895
C -3.510975 0.665473 -0.228114
C -2.194129 -1.028158 -1.325563
H 0.963162 -1.744479 1.567045
H 1.715439 0.926572 2.107407
H 3.126509 -2.161827 -0.096328
H 2.510862 0.037207 -1.782299
H 4.506507 1.269960 -0.812054
H 4.839931 -0.431221 -1.337721
H 3.683056 -0.873689 1.883569
H 0.386365 -1.541910 -0.910269
H -0.223593 2.240632 2.543753
H 5.661268 0.181301 0.938655
H -1.271023 -2.558850 -2.398876
H -2.981997 -2.263407 -2.764654


