%chk=000235661.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235661

0 1
O 1.078902 1.021872 0.188263
N 5.036146 -0.392472 -0.135868
N 1.534919 -1.052442 1.108098
N -0.665815 -0.515888 0.391897
C 3.653249 -0.952673 -0.252378
C 6.073754 -1.405481 -0.523673
C 5.191641 0.882445 -0.913816
C 2.991524 -0.756069 1.131354
C 7.434077 -1.003839 0.049296
C 4.329857 1.993879 -0.317945
C -3.078896 -0.263377 -0.014468
C -1.740961 0.290242 -0.097297
C -4.153700 0.504301 -0.535406
C 0.684872 -0.084034 0.516769
C -1.531826 1.535414 -0.658345
C -3.368424 -1.538191 0.565863
C -3.904140 1.787032 -1.115163
C -5.485874 -0.020335 -0.470377
C -2.625410 2.281737 -1.168305
C -4.653234 -2.018490 0.617987
C -5.728851 -1.248032 0.090274
H 3.050066 -0.434203 -1.031358
H 3.652938 -2.025503 -0.528818
H 5.778476 -2.388663 -0.093757
H 6.149531 -1.545985 -1.623677
H 6.263177 1.181358 -0.855669
H 4.953458 0.753835 -1.992356
H 3.139666 0.297545 1.474654
H 3.465603 -1.408752 1.894479
H 1.295458 -2.037923 1.044924
H 7.838238 -0.109952 -0.439455
H 7.353380 -0.770980 1.120317
H 8.164059 -1.810775 -0.067102
H 3.252129 1.767452 -0.371299
H 4.564068 2.153966 0.741856
H 4.490420 2.939883 -0.843954
H -0.940181 -1.403069 0.825220
H -0.527190 1.970217 -0.714421
H -2.551627 -2.134039 0.974671
H -4.742699 2.357681 -1.507249
H -6.299332 0.579957 -0.876059
H -2.422189 3.260737 -1.604203
H -4.870417 -2.988470 1.061149
H -6.739141 -1.651319 0.142547


%chk=000235661-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000235661

0 1
O 1.035827 1.251370 0.036541
N 5.107242 -0.414108 -0.205021
N 1.497150 -0.832350 0.971639
N -0.721652 -0.291829 0.442590
C 3.679631 -0.808458 -0.295396
C 6.065465 -1.523226 -0.451368
C 5.425028 0.827542 -0.959033
C 2.942708 -0.552473 1.047130
C 7.447610 -1.289155 0.190908
C 4.703699 2.074791 -0.412677
C -3.138531 -0.267226 -0.009370
C -1.852903 0.410747 -0.048125
C -4.309020 0.442954 -0.490156
C 0.625530 0.122681 0.448955
C -1.761791 1.718366 -0.555725
C -3.318608 -1.606299 0.477407
C -4.178586 1.775873 -0.999170
C -5.587310 -0.207243 -0.451309
C -2.926202 2.388551 -1.030192
C -4.576984 -2.214388 0.501804
C -5.727299 -1.507586 0.034588
H 3.154048 -0.237240 -1.088052
H 3.589988 -1.881502 -0.562214
H 5.630387 -2.440267 -0.010757
H 6.194784 -1.725710 -1.546463
H 6.515743 0.992695 -0.894056
H 5.181479 0.707105 -2.046880
H 3.076767 0.504923 1.325762
H 3.387468 -1.173323 1.845156
H 1.165410 -1.763984 1.223274
H 7.973213 -0.425948 -0.254654
H 7.334583 -1.099285 1.272740
H 8.090584 -2.178056 0.049847
H 3.604220 1.983188 -0.473068
H 4.979643 2.243808 0.643824
H 4.999270 2.966250 -0.997069
H -0.915777 -1.203456 0.856372
H -0.787747 2.209325 -0.576966
H -2.468623 -2.200474 0.837236
H -5.071720 2.298413 -1.359587
H -6.461766 0.344506 -0.816552
H -2.820721 3.407173 -1.419289
H -4.682235 -3.238058 0.877327
H -6.710298 -1.990020 0.057249


