%chk=000261447.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261447

0 1
O 6.486657 -1.222899 0.125011
O 5.225385 0.260421 -1.027014
N -5.059917 -0.615103 0.941011
N -3.741498 -0.509438 1.133894
N -2.989596 -0.441867 0.104108
C -6.023262 0.502027 -1.073018
C -5.710702 -0.849781 -0.383228
C 2.604452 0.761799 0.566472
C 3.345602 -0.341917 1.335745
C -7.132152 1.260181 -0.337151
C -6.413791 0.242638 -2.532705
C 1.135838 0.453248 0.480731
C 4.859936 -0.107876 1.377420
C 0.264855 0.858567 1.502609
C 0.625440 -0.251154 -0.622690
C -5.801919 -1.079492 2.142016
C -1.602369 -0.138459 0.323534
C -1.097897 0.567417 1.430794
C -0.732785 -0.546804 -0.708931
C 5.484420 -0.283765 0.020382
C 7.268498 -1.541050 -1.068786
C 8.280842 -0.445064 -1.329921
H -5.091811 1.125169 -1.058502
H -5.035237 -1.451816 -1.036656
H -6.637496 -1.442409 -0.250974
H 3.044560 0.869530 -0.452274
H 2.768883 1.745067 1.049886
H 3.125346 -1.329030 0.880098
H 2.958757 -0.399274 2.373280
H -6.838807 1.480513 0.696006
H -7.344260 2.218360 -0.824742
H -8.068061 0.694333 -0.308154
H -7.302706 -0.390505 -2.615787
H -5.601416 -0.244562 -3.084378
H -6.635079 1.182611 -3.051452
H 5.088471 0.917336 1.740911
H 5.332364 -0.800569 2.109025
H 0.651016 1.406507 2.360157
H 1.297287 -0.566421 -1.420572
H -5.939732 -2.173349 2.149615
H -6.790294 -0.588914 2.158630
H -5.268067 -0.797445 3.068435
H -1.769053 0.886577 2.226652
H -1.130587 -1.087104 -1.567541
H 7.729735 -2.499056 -0.767428
H 6.573039 -1.686794 -1.914403
H 8.977207 -0.723912 -2.129210
H 8.871733 -0.219284 -0.433368
H 7.783974 0.488113 -1.636237


%chk=000261447-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000261447

0 1
O 6.881206 -0.832153 0.052471
O 4.973622 -1.083600 -1.268218
N -5.158967 -0.168781 1.136891
N -3.816279 -0.039915 1.352629
N -3.079382 -0.317564 0.295122
C -5.836389 0.406160 -1.255032
C -5.721989 -0.667631 -0.136675
C 2.691846 0.032222 0.871025
C 3.302725 -1.377739 1.107440
C -6.753262 1.578470 -0.840596
C -6.340968 -0.271292 -2.550175
C 1.176792 -0.013777 0.749757
C 4.841806 -1.365790 1.195139
C 0.334911 0.291263 1.852744
C 0.562740 -0.406896 -0.468217
C -6.004307 0.027817 2.317580
C -1.672499 -0.191541 0.530475
C -1.067305 0.206378 1.756566
C -0.838856 -0.493744 -0.579268
C 5.517380 -1.079916 -0.139036
C 7.693917 -0.561712 -1.174828
C 7.650031 0.925357 -1.537578
H -4.815714 0.794315 -1.433632
H -5.063532 -1.482677 -0.494447
H -6.723380 -1.084254 0.087069
H 3.130942 0.450540 -0.054381
H 2.987419 0.695542 1.708123
H 2.988805 -2.046734 0.285004
H 2.890566 -1.799265 2.044223
H -6.372788 2.087057 0.063991
H -6.812040 2.331439 -1.647925
H -7.783260 1.224397 -0.635758
H -7.351826 -0.701535 -2.406295
H -5.664404 -1.086088 -2.868655
H -6.402669 0.459772 -3.376891
H 5.203572 -0.625902 1.933958
H 5.217049 -2.348466 1.544708
H 0.791597 0.603495 2.801076
H 1.192922 -0.640128 -1.335452
H -6.441485 -0.929219 2.666920
H -6.830578 0.727402 2.097339
H -5.376953 0.446580 3.119197
H -1.705610 0.445717 2.612635
H -1.316654 -0.792689 -1.518525
H 8.707135 -0.889265 -0.891719
H 7.306123 -1.186607 -1.998641
H 8.322558 1.120905 -2.393542
H 7.981775 1.547961 -0.688769
H 6.629459 1.227392 -1.826529


