%chk=000229944.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229944

0 1
N -3.991662 0.056570 0.269630
N 6.834546 2.705150 -0.010015
C -0.430982 -0.850428 0.028915
C 0.999423 -0.434575 0.022314
C -0.508245 -2.280385 -0.072528
C 1.773922 -1.697379 -0.080548
C 0.863032 -2.806619 -0.139728
C -1.577673 -0.085472 0.113180
C -1.733849 -2.923396 -0.087279
C 1.433546 0.830726 0.097846
C 3.139969 -1.919267 -0.114366
C 1.329689 -4.106127 -0.237846
C -2.829259 -0.754348 0.086919
C -2.906379 -2.150842 -0.012752
C 2.841879 1.255116 0.072544
C 3.608332 -3.244848 -0.214331
C 2.722073 -4.317044 -0.276152
C 3.507166 1.570251 1.266882
C 3.525784 1.381850 -1.146267
C 5.527696 2.129652 0.024704
C 4.832789 1.995434 1.249642
C 4.850435 1.808942 -1.175371
C -5.003318 0.000950 -0.537417
C 7.657004 2.399436 -1.213978
C 7.639028 2.587956 1.238404
C -6.194745 0.845871 -0.291584
C -7.200990 0.896042 -1.273219
C -6.341233 1.588658 0.891101
C -8.337326 1.680820 -1.069549
C -7.482105 2.371255 1.089116
C -8.479978 2.418568 0.111400
H -1.544630 0.998567 0.204748
H 0.721964 1.659540 0.186256
H -1.798163 -4.007325 -0.156470
H 3.847299 -1.091760 -0.062798
H 0.644537 -4.948174 -0.282981
H -3.874220 -2.647120 -0.012676
H 4.681544 -3.425379 -0.242204
H 3.103105 -5.333884 -0.353469
H 2.982979 1.475098 2.218120
H 3.014898 1.139727 -2.078586
H 5.321370 2.238533 2.190551
H 5.352274 1.908139 -2.135274
H -5.065948 -0.634574 -1.438696
H 8.594177 2.978340 -1.173733
H 7.118554 2.728046 -2.120680
H 7.908526 1.333207 -1.322872
H 7.885350 1.550987 1.514164
H 8.578607 3.152649 1.123103
H 7.088796 3.053094 2.075627
H -7.097321 0.326329 -2.195399
H -5.557339 1.552002 1.652441
H -9.114214 1.719147 -1.831317
H -7.591250 2.945417 2.008079
H -9.367964 3.029075 0.267398


%chk=000229944-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229944

0 1
N -3.826020 0.162857 0.172861
N 6.846743 2.816374 0.176651
C -0.344250 -1.102260 -0.101570
C 1.119314 -0.834898 -0.017903
C -0.554949 -2.468321 -0.483115
C 1.778159 -2.138230 -0.312888
C 0.757958 -3.115418 -0.598857
C -1.443221 -0.251703 0.109238
C -1.862865 -2.973738 -0.641421
C 1.621081 0.409661 0.320527
C 3.128561 -2.555286 -0.252940
C 1.089920 -4.457661 -0.877801
C -2.764461 -0.746638 -0.075517
C -2.963425 -2.117153 -0.439627
C 2.972113 0.967704 0.270511
C 3.455136 -3.905742 -0.520597
C 2.447754 -4.849016 -0.848300
C 3.310438 2.050401 1.138186
C 3.969138 0.570956 -0.671336
C 5.582438 2.226347 0.199892
C 4.574317 2.656478 1.124165
C 5.231889 1.178047 -0.714525
C -4.982101 0.065939 -0.439187
C 7.857062 2.357778 -0.786383
C 7.171277 3.900244 1.113572
C -6.109558 0.960162 -0.126265
C -7.332711 0.821717 -0.838740
C -6.003642 1.963801 0.878652
C -8.427843 1.665615 -0.555875
C -7.097090 2.804889 1.158722
C -8.313417 2.659663 0.443858
H -1.331457 0.795878 0.406655
H 0.866840 1.128725 0.677318
H -2.029662 -4.023978 -0.905772
H 3.922173 -1.855883 0.020894
H 0.308064 -5.193196 -1.098249
H -3.982698 -2.511057 -0.523716
H 4.501669 -4.227178 -0.470528
H 2.723542 -5.887795 -1.062306
H 2.559233 2.409591 1.853019
H 3.725778 -0.191433 -1.417600
H 4.778508 3.470853 1.824631
H 5.945681 0.850353 -1.475437
H -5.168570 -0.679114 -1.242561
H 8.792115 2.918339 -0.631542
H 7.533019 2.519461 -1.834687
H 8.081519 1.279438 -0.661070
H 7.076586 3.572135 2.168411
H 8.210923 4.225088 0.952161
H 6.512907 4.780932 0.969249
H -7.419568 0.050164 -1.614679
H -5.054871 2.055867 1.417036
H -9.365698 1.550912 -1.110538
H -7.009615 3.575674 1.932817
H -9.162660 3.315851 0.665508


