%chk=000214898.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214898

1 1
Cl 0.843495 -0.841783 -1.595352
N -3.034477 0.007273 -0.277853
C -3.781527 1.347274 -0.343972
C -4.059136 -1.135731 -0.225664
C -4.776748 1.522101 0.806266
C -5.043785 -0.981029 0.935672
C -5.772748 0.362893 0.878242
C -2.197396 -0.175536 -1.563445
C -2.119179 -0.007760 0.958684
C -1.185419 0.905840 -1.736266
C -1.365279 -1.291318 1.101922
C 0.142336 0.722868 -1.773753
C -0.030200 -1.326990 1.207926
C 1.146971 1.820246 -1.918145
C 0.746074 -2.591831 1.406870
C 1.539487 2.334218 -0.553282
C 1.948212 -2.624855 0.495938
C 1.067160 3.576557 -0.108158
C 2.378641 1.566877 0.268370
C 1.867495 -3.267384 -0.749280
C 3.144972 -2.006492 0.887076
C 1.437583 4.049477 1.154589
C 2.742317 2.045114 1.529644
C 2.979265 -3.284281 -1.597521
C 4.252709 -2.030666 0.035014
C 2.271909 3.284891 1.975652
C 4.171549 -2.665934 -1.208455
H -4.318743 1.405047 -1.319552
H -3.038704 2.178609 -0.338594
H -3.516474 -2.106872 -0.144950
H -4.617657 -1.157340 -1.190644
H -4.249280 1.637914 1.775531
H -5.322248 2.482060 0.663719
H -5.780102 -1.814843 0.895461
H -4.530479 -1.103216 1.911855
H -6.425160 0.478810 1.770113
H -6.464475 0.391872 0.011544
H -2.887446 -0.186979 -2.442158
H -1.726434 -1.190352 -1.521986
H -2.748441 0.161638 1.867397
H -1.424556 0.865796 0.884163
H -1.588330 1.912321 -1.885282
H -1.969879 -2.195537 1.170316
H 0.582940 -0.417190 1.169197
H 2.057482 1.472651 -2.464792
H 0.753692 2.642797 -2.557511
H 1.068905 -2.659422 2.473671
H 0.120960 -3.498188 1.255664
H 0.432164 4.187338 -0.746424
H 2.762774 0.605917 -0.079619
H 0.949664 -3.766004 -1.052477
H 3.219846 -1.518502 1.856902
H 1.083552 5.023141 1.494929
H 3.405646 1.455861 2.163319
H 2.918215 -3.788734 -2.562380
H 5.186215 -1.558796 0.344145
H 2.566146 3.660108 2.956039
H 5.038527 -2.686645 -1.868711


%chk=000214898-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000214898

1 1
Cl 1.307015 0.191501 -1.551355
N -2.925711 -0.001973 -0.325374
C -3.955010 1.146438 -0.425206
C -3.644471 -1.352520 -0.533302
C -5.191380 0.952611 0.473723
C -4.833031 -1.553236 0.417566
C -5.866827 -0.417746 0.254236
C -1.877732 0.128639 -1.474894
C -2.193808 0.065244 1.065870
C -1.166283 1.451470 -1.526243
C -1.474682 -1.194854 1.463443
C 0.179693 1.636479 -1.595949
C -0.117783 -1.295890 1.519357
C 0.900334 2.960020 -1.725452
C 0.643407 -2.519315 1.987923
C 1.762869 3.296300 -0.504428
C 1.576389 -3.038620 0.888756
C 1.152490 3.658668 0.723329
C 3.175642 3.257916 -0.586107
C 1.147382 -4.060981 0.005527
C 2.868146 -2.480090 0.715488
C 1.941088 3.976094 1.851297
C 3.967327 3.573972 0.541688
C 1.993657 -4.520301 -1.029519
C 3.714870 -2.934416 -0.320642
C 3.352475 3.931902 1.763020
C 3.278897 -3.955075 -1.197434
H -4.255205 1.191810 -1.488302
H -3.423024 2.077109 -0.168529
H -2.876914 -2.135876 -0.425526
H -3.995984 -1.349994 -1.581649
H -4.924885 1.078052 1.540093
H -5.891560 1.774975 0.237390
H -5.287680 -2.531663 0.177893
H -4.491803 -1.617265 1.468220
H -6.696445 -0.547957 0.970000
H -6.309982 -0.462590 -0.760358
H -2.451593 -0.044375 -2.405122
H -1.163628 -0.700871 -1.340393
H -2.977946 0.320973 1.796389
H -1.499101 0.918049 0.977688
H -1.771619 2.359692 -1.639829
H -2.088409 -2.035320 1.816889
H 0.502167 -0.445775 1.195966
H 1.533201 2.935277 -2.631806
H 0.135186 3.744235 -1.883299
H 1.244654 -2.240817 2.876037
H -0.063283 -3.307299 2.305790
H 0.057785 3.713450 0.793873
H 3.658991 2.984721 -1.531416
H 0.157052 -4.514894 0.139221
H 3.220671 -1.698881 1.400672
H 1.461029 4.268500 2.791640
H 5.059456 3.548031 0.464944
H 1.657609 -5.322912 -1.695222
H 4.714943 -2.502915 -0.436605
H 3.965919 4.184091 2.634475
H 3.938038 -4.314497 -1.994833


