%chk=000248898.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248898

0 1
O -3.818463 1.026909 2.371958
O -2.932089 -0.799001 3.319963
N -0.828441 -0.293751 1.314484
C 0.061008 -0.125324 0.107924
C 0.076657 1.334063 -0.361067
C 1.508055 -0.399708 0.548847
C -0.426182 -1.112488 -0.963128
C -2.281459 -0.149343 1.025587
C 0.584957 1.645779 -1.633570
C 2.452960 -0.860082 -0.381723
C -1.296698 -0.709315 -1.985219
C -0.325603 2.375146 0.486826
C 1.917150 -0.124365 1.861804
C -0.081418 -2.470129 -0.859028
C 0.647918 2.972573 -2.063603
C 3.777595 -1.074795 0.006088
C -1.786690 -1.639931 -2.906821
C -0.263947 3.703013 0.051976
C 3.242930 -0.344523 2.247392
C -0.572254 -3.398891 -1.779347
C 0.216595 4.005450 -1.224448
C 4.175140 -0.823887 1.323269
C -1.423960 -2.985752 -2.808999
C -2.982744 -0.067209 2.362731
H -0.656119 -1.214429 1.746866
H -2.725235 -0.988182 0.437145
H -2.464453 0.782715 0.433259
H 0.941620 0.851785 -2.289602
H 2.161118 -1.048921 -1.414882
H -1.600669 0.335105 -2.072483
H -0.677047 2.157074 1.497940
H 1.206322 0.276047 2.588431
H 0.579030 -2.808062 -0.058693
H 1.039629 3.203110 -3.052730
H 4.502590 -1.435079 -0.721689
H -2.454858 -1.312164 -3.702073
H -0.586887 4.502880 0.716500
H 3.548648 -0.134629 3.271250
H -0.291480 -4.447743 -1.692640
H 0.263515 5.038791 -1.561407
H 5.206587 -0.994483 1.624710
H -1.804104 -3.709366 -3.527737
H -4.316024 1.126814 3.226940


%chk=000248898-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248898

0 1
O -4.325151 0.244943 2.280358
O -2.612179 -1.023880 3.207858
N -0.829379 -0.113470 1.264890
C 0.076900 -0.053621 0.076169
C 0.138031 1.405412 -0.461354
C 1.520537 -0.370758 0.562235
C -0.428003 -1.084529 -0.976641
C -2.258094 0.138094 1.058358
C 0.564461 1.690668 -1.783215
C 2.518860 -0.767783 -0.364562
C -1.389847 -0.729976 -1.959981
C -0.112790 2.488720 0.416602
C 1.891582 -0.180662 1.916538
C -0.092626 -2.459251 -0.841313
C 0.711222 3.024437 -2.222373
C 3.848335 -0.984806 0.052927
C -1.972464 -1.708440 -2.798398
C 0.029196 3.823584 -0.020645
C 3.222488 -0.404485 2.337748
C -0.670821 -3.437901 -1.676448
C 0.438757 4.099436 -1.345140
C 4.207786 -0.807953 1.409753
C -1.613751 -3.067444 -2.664512
C -3.029885 -0.279850 2.293210
H -0.677114 -0.961716 1.828510
H -2.702306 -0.424555 0.200286
H -2.451578 1.206566 0.853268
H 0.788041 0.871411 -2.475030
H 2.256643 -0.913072 -1.418295
H -1.678404 0.319363 -2.084509
H -0.399099 2.264987 1.450149
H 1.138704 0.157230 2.635162
H 0.632581 -2.765337 -0.078969
H 1.042199 3.223631 -3.248072
H 4.603341 -1.291457 -0.679892
H -2.708200 -1.405633 -3.552219
H -0.171700 4.647056 0.674251
H 3.488356 -0.256505 3.390682
H -0.387160 -4.489619 -1.555895
H 0.552051 5.134529 -1.686524
H 5.240122 -0.977523 1.735782
H -2.062184 -3.826747 -3.314858
H -4.824258 -0.087391 3.075110


