%chk=000270226.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270226

0 1
O -0.258232 -3.748553 -0.807249
O -2.359974 -2.837391 -0.899435
N 3.128494 -1.294685 0.045648
N 0.785451 2.927231 0.886158
N -2.003469 0.126614 -0.717267
N -1.704502 3.803797 -0.143895
N -0.415289 -1.610450 -0.250198
N -3.536511 1.880546 -1.182706
C 3.057687 1.962652 0.445673
C 3.937588 0.848468 1.030972
C 2.089463 2.539043 1.505393
C 4.228239 -0.270252 0.010721
C 2.676712 3.764789 2.207397
C 2.924122 -1.936578 -1.298704
C 3.419047 -2.337535 1.091214
C -0.106863 2.009840 0.386825
C 2.370385 -0.928609 -2.304839
C 2.140356 -3.073357 1.489884
C -1.387620 2.461674 -0.149041
C 0.152122 0.638547 0.353812
C -2.295610 1.470394 -0.673050
C -0.802625 -0.248347 -0.209627
C -2.886073 4.157863 -0.635253
C -3.810451 3.176689 -1.157919
C -1.187133 -2.704329 -0.688051
C -0.805063 -5.069018 -1.113564
C -1.439277 -5.668651 0.123607
H 3.683618 2.762198 0.011566
H 2.478484 1.558558 -0.413925
H 3.453326 0.408322 1.927694
H 4.893722 1.275328 1.387296
H 1.870272 1.744453 2.274673
H 4.303097 0.166990 -1.009223
H 5.226379 -0.712701 0.217759
H 0.558797 3.921409 0.829931
H 3.633794 3.511975 2.681994
H 2.014382 4.142520 2.996725
H 2.873208 4.593064 1.515613
H 2.186741 -2.766108 -1.168474
H 3.850871 -2.402893 -1.696835
H 3.836202 -1.829231 1.989186
H 4.188130 -3.068985 0.758873
H 1.964280 -1.439235 -3.185657
H 3.135377 -0.225244 -2.651126
H 1.556892 -0.329819 -1.870139
H 2.350005 -3.844285 2.239284
H 1.658143 -3.573278 0.635014
H 1.401923 -2.386101 1.923415
H 1.094664 0.231448 0.731634
H 0.588646 -1.797420 -0.040886
H -3.147659 5.219588 -0.635567
H -4.783761 3.494635 -1.555564
H 0.109650 -5.597512 -1.438337
H -1.519794 -4.966906 -1.950782
H -2.351211 -5.118864 0.407032
H -0.761680 -5.634115 0.985396
H -1.726872 -6.713982 -0.038077


%chk=000270226-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270226

0 1
O -0.495944 -3.853591 -0.897256
O -2.531376 -2.766659 -1.412798
N 3.352295 -1.134117 0.092979
N 0.765430 2.798586 0.863420
N -2.193069 0.131749 -0.710363
N -1.712054 3.750827 0.124855
N -0.627359 -1.654556 -0.474596
N -3.688330 1.950303 -0.929318
C 3.077556 2.012249 0.247855
C 4.269837 1.149151 0.750105
C 2.089054 2.411914 1.384389
C 4.467504 -0.148936 -0.069394
C 2.643723 3.552278 2.258744
C 3.252055 -2.049424 -1.089522
C 3.514676 -1.910211 1.363173
C -0.144703 1.907027 0.357531
C 2.696951 -1.370058 -2.355184
C 2.217285 -2.576259 1.858684
C -1.455524 2.408474 -0.030582
C 0.085451 0.530043 0.189042
C -2.434924 1.478888 -0.556523
C -0.965541 -0.289567 -0.341018
C -2.939965 4.179442 -0.244939
C -3.914041 3.272673 -0.769355
C -1.369076 -2.724864 -0.973099
C -1.102215 -5.146342 -1.317372
C -1.848661 -5.806729 -0.154149
H 3.437445 2.933972 -0.249407
H 2.520261 1.437589 -0.512569
H 4.122431 0.887094 1.818140
H 5.214634 1.725611 0.710116
H 1.944272 1.512145 2.022732
H 4.531888 0.123944 -1.137863
H 5.446964 -0.617565 0.200229
H 0.440113 3.769589 0.922911
H 3.635462 3.280333 2.659289
H 1.975673 3.769140 3.111607
H 2.764574 4.476978 1.662500
H 2.577646 -2.882284 -0.817440
H 4.246522 -2.512051 -1.314412
H 3.865709 -1.208405 2.141925
H 4.316479 -2.683247 1.250477
H 2.575496 -2.118227 -3.159726
H 3.365752 -0.578641 -2.738387
H 1.710350 -0.915762 -2.157894
H 2.409879 -3.125404 2.798874
H 1.809827 -3.306432 1.135354
H 1.441473 -1.816348 2.064684
H 1.059322 0.077430 0.407408
H 0.314873 -1.910108 -0.168357
H -3.161040 5.244986 -0.127843
H -4.904396 3.637669 -1.065935
H -0.239472 -5.746349 -1.650307
H -1.780871 -4.956047 -2.167688
H -2.710767 -5.191037 0.152978
H -1.181515 -5.948476 0.714066
H -2.227421 -6.798184 -0.465776


