%chk=000299113.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299113

0 1
O 1.339013 -1.197803 0.099619
O 0.203789 0.524964 1.043394
O -0.306544 -1.792297 -1.628079
N 3.464213 1.798626 1.720503
C 3.426179 0.086730 -0.057959
C 4.944663 -0.272514 -0.061691
C 3.373203 -0.216492 -1.587136
C 4.876522 -0.569502 -1.575506
C 3.113174 1.555119 0.282329
C 2.592380 -0.875152 0.793378
C 2.364966 2.518752 2.427131
C 4.749819 2.546736 1.843422
C 0.243333 -0.409128 0.279092
C -0.898832 -0.973436 -0.611822
C -1.625527 0.135937 -1.353524
C -1.858176 -1.795990 0.236986
C -2.060353 1.280467 -0.670375
C -2.417601 -2.957930 -0.312208
C -1.886052 -0.004638 -2.723691
C -2.212080 -1.392873 1.531398
C -2.754183 2.278468 -1.358902
C -3.315576 -3.721913 0.437431
C -2.579684 0.998006 -3.406838
C -3.111530 -2.160014 2.276738
C -3.015846 2.138785 -2.726001
C -3.662229 -3.325127 1.733018
H 5.222874 -1.124227 0.565491
H 5.598607 0.564206 0.219591
H 3.104426 0.635886 -2.217971
H 2.703501 -1.043041 -1.856121
H 5.501312 0.081573 -2.195930
H 5.101387 -1.606498 -1.846735
H 3.652605 2.228392 -0.415108
H 2.028903 1.736279 0.100122
H 3.040285 -1.881011 0.875971
H 2.361111 -0.467082 1.795137
H 1.429379 1.935263 2.318154
H 2.174235 3.540927 2.072241
H 2.600184 2.561114 3.501508
H 5.026980 2.602419 2.908068
H 4.734279 3.568485 1.437933
H 5.542854 1.976336 1.326188
H 0.318183 -2.448982 -1.227586
H -1.847056 1.399394 0.394822
H -2.152051 -3.254990 -1.329145
H -1.539773 -0.896719 -3.251715
H -1.790961 -0.481457 1.962369
H -3.091095 3.166894 -0.827571
H -3.748173 -4.624770 0.009411
H -2.780249 0.887878 -4.471040
H -3.384206 -1.846751 3.283475
H -3.557998 2.917697 -3.259034
H -4.362281 -3.920692 2.316567


%chk=000299113-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000299113

0 1
O 1.352289 -0.699482 0.212015
O -0.048583 0.153322 1.868579
O -0.387567 -0.690794 -1.673031
N 3.044556 2.197508 -0.111523
C 3.749140 -0.240432 0.096114
C 5.111983 -0.354753 0.893113
C 4.154068 -1.554472 -0.674442
C 5.267920 -1.831173 0.393065
C 3.510696 0.985370 -0.817966
C 2.569996 -0.446041 1.047545
C 2.263765 3.108161 -0.973330
C 4.105599 2.898592 0.635689
C 0.120327 -0.297027 0.717732
C -0.994134 -0.547234 -0.344879
C -1.930455 0.680158 -0.405124
C -1.768733 -1.843053 0.022577
C -2.836512 0.950204 0.649120
C -2.365857 -2.574172 -1.035265
C -1.870767 1.559216 -1.512857
C -1.933323 -2.295310 1.355200
C -3.671119 2.087288 0.595717
C -3.114253 -3.739382 -0.764825
C -2.712720 2.693230 -1.567146
C -2.680136 -3.466079 1.622370
C -3.613692 2.963823 -0.512795
C -3.274467 -4.191567 0.566160
H 5.067846 -0.196467 1.985306
H 5.882695 0.313439 0.470182
H 4.577925 -1.326045 -1.669417
H 3.363086 -2.313852 -0.792804
H 6.259790 -2.120154 0.010365
H 4.955958 -2.571740 1.149668
H 4.447041 1.172545 -1.406284
H 2.725381 0.704106 -1.545306
H 2.706112 -1.325222 1.703347
H 2.378822 0.459526 1.647591
H 1.405593 2.565545 -1.407613
H 2.860452 3.551541 -1.810327
H 1.863419 3.938611 -0.364419
H 3.666326 3.747057 1.190119
H 4.917555 3.299632 -0.024342
H 4.570639 2.220388 1.370655
H 0.477210 -1.163274 -1.548845
H -2.892885 0.278064 1.510238
H -2.228293 -2.220839 -2.061549
H -1.177185 1.332817 -2.326625
H -1.481520 -1.742499 2.186007
H -4.366831 2.287511 1.418307
H -3.572834 -4.294150 -1.591394
H -2.664236 3.363272 -2.433324
H -2.796308 -3.808172 2.657033
H -4.265140 3.844273 -0.554324
H -3.854336 -5.097508 0.775741


