%chk=000231068.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231068

0 1
O -1.798454 1.952033 1.673417
O -0.390711 0.051275 -2.312830
N -0.842856 1.266674 -0.350352
N 3.357804 -0.731598 0.516415
C 0.245979 2.293834 -0.418246
C 1.619861 1.625442 -0.232188
C 1.842560 1.139803 1.203118
C 3.225400 0.486901 1.380922
C 0.161396 3.035704 -1.753453
C -1.775770 1.189448 0.741430
C -1.037761 0.212489 -1.311721
C -2.644331 0.001198 0.435529
C -2.204280 -0.582231 -0.784345
C 2.497170 -1.855465 1.016177
C 4.792031 -1.158228 0.396879
C -3.707031 -0.524382 1.137592
C -2.824224 -1.695427 -1.308057
C 2.219437 -2.836238 -0.124488
C 5.544493 -0.209458 -0.538180
C -4.346294 -1.668419 0.602697
C -3.915750 -2.239420 -0.589317
H 0.051674 3.013409 0.425728
H 2.417422 2.336437 -0.519838
H 1.738319 0.769010 -0.934823
H 1.748849 1.983135 1.914430
H 1.048366 0.416640 1.481246
H 4.012858 1.212257 1.075963
H 3.396143 0.271303 2.457842
H 0.904992 3.837824 -1.807740
H -0.824859 3.488572 -1.905387
H 0.342948 2.359035 -2.603066
H 2.941552 -2.388266 1.883632
H 1.529835 -1.427772 1.368578
H 5.308345 -1.218477 1.378942
H 4.813211 -2.183835 -0.036703
H -4.047684 -0.078216 2.072482
H -2.489554 -2.145242 -2.243475
H 1.468942 -3.577147 0.164885
H 3.123437 -3.371313 -0.435387
H 1.848122 -2.302490 -1.011799
H 6.538378 -0.599005 -0.777980
H 5.667609 0.787274 -0.100847
H 4.994849 -0.078836 -1.481117
H -5.189980 -2.101453 1.141903
H -4.421242 -3.121076 -0.985966


%chk=000231068-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000231068

0 1
O -2.043174 2.346782 1.389638
O -0.169446 -0.373820 -1.980427
N -0.829156 1.225153 -0.329329
N 3.429415 -0.791270 0.545590
C 0.269349 2.222087 -0.458774
C 1.650117 1.591213 -0.147330
C 1.752921 0.966399 1.258595
C 3.123860 0.295607 1.510951
C 0.228982 2.890209 -1.851062
C -1.907111 1.381400 0.596447
C -0.961789 0.027581 -1.089451
C -2.788942 0.185352 0.406895
C -2.222038 -0.627620 -0.602458
C 2.673860 -2.045196 0.811664
C 4.886877 -1.026038 0.372299
C -3.981844 -0.171233 1.052874
C -2.828692 -1.827609 -1.002007
C 2.400015 -2.855962 -0.471047
C 5.575331 0.050404 -0.489576
C -4.604705 -1.383806 0.656664
C -4.036604 -2.199446 -0.355103
H 0.032596 2.978312 0.315724
H 2.404788 2.397953 -0.247286
H 1.899204 0.825008 -0.901923
H 1.592913 1.739927 2.037763
H 0.943283 0.221968 1.394055
H 3.911883 1.066233 1.414501
H 3.165238 -0.069203 2.569636
H 0.997073 3.682550 -1.903789
H -0.755699 3.353289 -2.040263
H 0.435106 2.154158 -2.646640
H 3.202857 -2.684370 1.563945
H 1.704269 -1.772100 1.267222
H 5.407544 -1.108743 1.361500
H 5.010793 -2.004638 -0.126788
H -4.410102 0.467104 1.831952
H -2.381569 -2.447945 -1.785107
H 1.844563 -3.783581 -0.234103
H 3.338477 -3.147796 -0.977255
H 1.804194 -2.253582 -1.178653
H 6.647767 -0.186978 -0.621782
H 5.510051 1.053148 -0.029329
H 5.096398 0.100812 -1.482933
H -5.537845 -1.696448 1.137484
H -4.539809 -3.129561 -0.640481


