%chk=000231861.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231861

0 1
O -3.498406 1.913853 -0.063067
O 3.495843 -1.915060 -0.058566
N -2.819153 -0.291954 0.000965
N 2.816587 0.290923 -0.000663
C -1.397537 -0.112323 -0.005078
C 1.394966 0.111275 -0.005785
C -0.796828 1.159516 -0.007462
C 0.590553 1.269698 -0.008030
C -0.593125 -1.270745 -0.004985
C 0.794259 -1.160562 -0.005111
C -5.191826 0.212366 0.000716
C 5.189250 -0.213362 -0.000053
C -3.784518 0.733859 -0.020840
C 3.781944 -0.734945 -0.019783
C -6.026998 0.477141 -1.091994
C 6.024038 -0.480793 -1.092403
C -5.674276 -0.488854 1.112967
C 5.672064 0.490612 1.110303
C -7.348893 0.022624 -1.075408
C 7.345931 -0.026202 -1.077393
C -6.998354 -0.936119 1.124602
C 6.996130 0.937939 1.120376
C -7.833434 -0.683642 0.030551
C 7.830837 0.682791 0.026655
H -1.416438 2.064726 -0.010048
H 1.041996 2.260579 -0.010964
H -1.044564 -2.261632 -0.005556
H 1.413868 -2.065777 -0.005831
H -3.141592 -1.262608 0.002285
H 3.139027 1.261576 -0.002148
H -5.648105 1.042210 -1.945100
H 5.644871 -1.047956 -1.943994
H -5.026599 -0.674274 1.969869
H 5.024667 0.678118 1.966964
H -8.002532 0.224512 -1.923208
H 7.999277 -0.230167 -1.924921
H -7.380701 -1.478465 1.988349
H 7.378769 1.482419 1.982649
H -8.865165 -1.034405 0.042124
H 8.862563 1.033607 0.037015


%chk=000231861-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231861

0 1
O -3.599026 1.936862 -0.164197
O 3.596563 -1.938325 -0.159737
N -2.833084 -0.280021 -0.063644
N 2.830450 0.278716 -0.063978
C -1.422261 -0.098243 -0.072229
C 1.419627 0.096890 -0.072299
C -0.797802 1.178687 -0.077980
C 0.605362 1.260880 -0.076129
C -0.607999 -1.262240 -0.072327
C 0.795165 -1.180054 -0.074206
C -5.246003 0.160013 0.002954
C 5.243422 -0.160974 0.002787
C -3.835909 0.690803 -0.076007
C 3.833316 -0.692104 -0.073539
C -6.282705 1.007605 -0.465878
C 6.279746 -1.009437 -0.465306
C -5.583607 -1.107950 0.548134
C 5.581432 1.108158 0.544986
C -7.627335 0.587092 -0.418399
C 7.624382 -0.588703 -0.420004
C -6.931263 -1.526736 0.599187
C 6.929101 1.527161 0.593882
C -7.955954 -0.684144 0.109715
C 7.953395 0.683650 0.105163
H -1.416163 2.077352 -0.087861
H 1.074718 2.253564 -0.078622
H -1.077357 -2.254927 -0.071790
H 1.413521 -2.078749 -0.081172
H -3.143946 -1.253430 -0.089198
H 3.141294 1.252056 -0.092250
H -6.005654 1.992847 -0.854573
H 6.002429 -1.995524 -0.851663
H -4.815063 -1.761633 0.979952
H 4.813239 1.762651 0.976198
H -8.418493 1.247687 -0.789260
H 8.415243 -1.249993 -0.790260
H -7.182306 -2.501758 1.030819
H 7.180471 2.503091 1.023266
H -9.000873 -1.010920 0.149848
H 8.998324 1.010597 0.143616


