%chk=000230516.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230516

0 1
O -0.461964 0.490763 1.081779
N 0.369426 0.268513 -2.262971
N -2.638583 3.434502 1.331942
C -0.221985 -0.456434 0.008195
C 0.741464 0.223287 -0.986263
C 0.446266 -1.640239 0.706674
C -1.547794 -0.956281 -0.562234
C 1.990134 0.795280 -0.526566
C -0.919070 1.817183 0.685659
C 2.842045 1.384555 -1.500033
C -1.919485 2.203054 1.786997
C 1.298048 -2.496424 -0.004687
C -2.741762 -0.700532 0.127670
C 0.172056 -1.890645 2.058609
C -1.584204 -1.747594 -1.719928
C 2.402902 0.806621 0.841704
C 2.419564 1.410205 -2.865905
C 1.202488 0.863649 -3.197603
C 4.095138 1.944231 -1.096825
C 1.875587 -3.594580 0.638710
C -3.957604 -1.193526 -0.351843
C 0.754948 -2.988028 2.697442
C -2.802036 -2.239317 -2.199398
C 3.609082 1.352137 1.205550
C 1.606693 -3.841465 1.988845
C -3.991524 -1.960534 -1.520244
C 4.468578 1.923530 0.223788
C -3.075754 4.256312 2.499143
C -3.811099 3.082053 0.476761
H -0.025685 2.463996 0.679319
H -1.375032 1.799112 -0.318422
H -2.587597 1.332995 1.993669
H -1.369774 2.398509 2.731457
H 1.513017 -2.311421 -1.056639
H -2.719516 -0.117006 1.054160
H -0.495354 -1.220298 2.604265
H -0.665269 -1.977509 -2.259877
H 1.729161 0.383801 1.596144
H 3.062207 1.863609 -3.616871
H 0.811506 0.859718 -4.220548
H 4.739161 2.384734 -1.855817
H 2.536813 -4.258994 0.085212
H -4.877914 -0.984456 0.188715
H 0.542008 -3.179582 3.747492
H -2.820623 -2.842144 -3.105199
H 3.924912 1.358059 2.247665
H 2.058276 -4.697309 2.486504
H -4.937897 -2.342803 -1.896176
H 5.421791 2.345066 0.542048
H -3.763679 3.751550 3.192416
H -3.569302 5.169070 2.127231
H -2.185518 4.580725 3.061991
H -4.222354 4.008379 0.044240
H -4.622178 2.551802 0.996089
H -3.475611 2.453817 -0.365534


%chk=000230516-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230516

0 1
O -0.697535 0.406860 1.046852
N 0.267776 0.286350 -2.277431
N -2.416792 3.706454 1.437707
C -0.293737 -0.560287 -0.013713
C 0.657817 0.184014 -0.992698
C 0.423756 -1.711415 0.730438
C -1.557894 -1.185561 -0.665994
C 1.882909 0.802942 -0.506159
C -1.263474 1.678315 0.546837
C 2.707039 1.507036 -1.470535
C -1.935160 2.343798 1.757041
C 1.384052 -2.511585 0.065694
C -2.803993 -1.079694 0.000139
C 0.067536 -2.027083 2.064392
C -1.483774 -1.984316 -1.835020
C 2.315078 0.774384 0.862447
C 2.262769 1.574547 -2.831194
C 1.057966 0.971711 -3.180023
C 3.928377 2.126551 -1.047650
C 1.984560 -3.606698 0.723967
C -3.955226 -1.725652 -0.503919
C 0.670541 -3.120662 2.723836
C -2.630951 -2.633619 -2.337658
C 3.507801 1.391025 1.247076
C 1.630720 -3.916822 2.057088
C -3.876087 -2.503968 -1.679336
C 4.325461 2.067829 0.288410
C -2.613014 4.531770 2.646251
C -3.611198 3.713900 0.567708
H -0.460059 2.336308 0.164524
H -1.978554 1.473058 -0.272431
H -2.753561 1.679789 2.138970
H -1.179187 2.420004 2.560444
H 1.673759 -2.276906 -0.965014
H -2.863728 -0.503085 0.928741
H -0.672541 -1.406640 2.577530
H -0.533634 -2.091010 -2.363360
H 1.694543 0.274447 1.607236
H 2.863067 2.102453 -3.580319
H 0.671543 1.012109 -4.203945
H 4.540177 2.650641 -1.791301
H 2.729239 -4.214545 0.197666
H -4.909008 -1.625986 0.027123
H 0.388397 -3.353294 3.757188
H -2.551890 -3.242488 -3.245610
H 3.821963 1.357794 2.296000
H 2.096435 -4.766551 2.568907
H -4.766105 -3.008407 -2.072543
H 5.259248 2.542696 0.609346
H -3.420770 4.150911 3.322844
H -2.878620 5.562956 2.350656
H -1.673599 4.575000 3.225422
H -3.880152 4.756634 0.321857
H -4.502061 3.228605 1.043861
H -3.403123 3.189077 -0.379842


