%chk=000298405.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298405

0 1
O -2.393725 2.548168 -0.819542
N 1.409986 0.910756 -0.095848
N -7.269061 -1.486953 0.157315
C 2.476341 1.912610 0.230314
C 3.691023 1.177169 0.821591
C 1.871907 -0.074633 -1.131534
C 0.152637 1.597365 -0.537016
C 4.141851 0.065776 -0.084988
C 3.302993 -0.497315 -0.965555
C -1.040267 0.665308 -0.267620
C 5.547489 -0.375059 0.061544
C -2.358311 1.379585 -0.477837
C -3.604603 0.604704 -0.263271
C 6.442625 -0.240849 -1.011501
C 5.992580 -0.925386 1.273948
C -3.628166 -0.705511 0.240624
C -4.829689 1.226092 -0.577436
C 7.770515 -0.652186 -0.869833
C 7.320702 -1.337658 1.408121
C -6.060883 -0.758830 0.101037
C 8.211691 -1.200965 0.338480
C -4.827140 -1.380808 0.428075
C -6.038294 0.568459 -0.400190
C -7.319013 -2.689438 1.029929
C -8.543726 -0.722099 0.171990
H 2.066878 2.619807 0.983885
H 2.790167 2.513674 -0.649879
H 3.420970 0.744523 1.809602
H 4.511342 1.896450 1.008777
H 1.730644 0.299604 -2.173003
H 1.215014 -0.970148 -1.017274
H 0.160817 1.905423 -1.604901
H 0.012991 2.535360 0.048305
H 3.613391 -1.310656 -1.619399
H -0.987326 -0.230738 -0.916266
H -0.971906 0.281973 0.774140
H 6.099874 0.187122 -1.951804
H 5.299318 -1.036249 2.105787
H -2.695526 -1.210596 0.499642
H -4.812631 2.251447 -0.965046
H 8.462711 -0.544994 -1.703151
H 7.662281 -1.767019 2.348372
H -4.810267 -2.395792 0.816613
H -6.963470 1.076781 -0.659613
H 9.245623 -1.521351 0.446317
H -8.252848 -3.244971 0.841679
H -7.263871 -2.451487 2.104417
H -6.485620 -3.370053 0.778164
H -9.393096 -1.414467 0.049396
H -8.572003 -0.026044 -0.686133
H -8.694718 -0.142604 1.096976


%chk=000298405-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298405

0 1
O -2.452387 2.776765 -0.365304
N 1.444500 1.105753 -0.020804
N -7.277927 -1.512333 0.254832
C 2.548368 2.073245 0.185508
C 3.786483 1.360757 0.760716
C 1.808185 0.087891 -1.031688
C 0.149626 1.766981 -0.312822
C 4.166922 0.141796 -0.074289
C 3.228910 -0.410934 -0.898183
C -1.036897 0.798133 -0.167274
C 5.546359 -0.410236 0.055646
C -2.394609 1.512954 -0.222425
C -3.633036 0.696055 -0.102136
C 6.140971 -1.208052 -0.965254
C 6.322655 -0.144992 1.219738
C -3.624527 -0.712584 0.100408
C -4.900134 1.341318 -0.184613
C 7.440246 -1.734086 -0.818814
C 7.624595 -0.670953 1.368746
C -6.089935 -0.793648 0.135740
C 8.191637 -1.471636 0.351992
C -4.814754 -1.445553 0.218100
C -6.098246 0.627557 -0.072336
C -7.243936 -2.965318 0.473502
C -8.572757 -0.821259 0.165867
H 2.198817 2.850005 0.890086
H 2.830859 2.591013 -0.767946
H 3.571696 1.053061 1.803663
H 4.632744 2.074661 0.799124
H 1.663844 0.482777 -2.077395
H 1.119783 -0.776035 -0.938186
H 0.131814 2.226507 -1.332943
H 0.012750 2.595763 0.403763
H 3.468790 -1.298849 -1.497559
H -1.017530 0.019870 -0.955852
H -0.938132 0.263087 0.798883
H 5.590638 -1.396052 -1.893993
H 5.900404 0.464527 2.025743
H -2.673183 -1.250853 0.173661
H -4.909309 2.425861 -0.339425
H 7.874438 -2.338967 -1.623297
H 8.195315 -0.456134 2.279545
H -4.757535 -2.525980 0.375608
H -7.046131 1.167854 -0.144231
H 9.203513 -1.876774 0.463654
H -8.273237 -3.348825 0.549855
H -6.713058 -3.226054 1.411139
H -6.744177 -3.495542 -0.362109
H -9.386659 -1.553002 0.286111
H -8.705007 -0.321893 -0.814811
H -8.683558 -0.054350 0.958460


