%chk=000219163.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219163

0 1
O -1.269870 -0.553576 -1.933006
N 2.342144 -0.494488 0.150412
C 1.049976 -0.023103 -0.473940
C 3.507888 0.313636 -0.350848
C 2.577325 -1.950537 -0.147543
C 4.792615 -0.124874 0.371723
C 3.838362 -2.434238 0.586307
C 5.065908 -1.618935 0.162044
C -0.143419 -0.780389 0.161966
C 0.839295 1.464298 -0.234334
C -1.354037 -0.776427 -0.742069
C 0.355616 2.260362 -1.282480
C 1.077166 2.040842 1.022616
C -2.679265 -1.063526 -0.106086
C 0.124013 3.623496 -1.076931
C 0.846301 3.403630 1.222907
C 0.370595 4.197739 0.173718
C -2.801285 -1.828426 1.062232
C -3.830009 -0.551758 -0.726476
C -4.064132 -2.072071 1.608574
C -5.090940 -0.790624 -0.174060
C -5.208093 -1.550599 0.993826
H 1.040342 -0.225237 -1.583314
H 3.316262 1.386889 -0.131718
H 3.640878 0.228940 -1.450767
H 2.669212 -2.153758 -1.236529
H 1.694611 -2.525877 0.215954
H 4.692826 0.086761 1.455307
H 5.644237 0.479860 0.011276
H 3.997077 -3.508762 0.384695
H 3.687511 -2.336359 1.680155
H 5.308537 -1.817608 -0.898861
H 5.952200 -1.931060 0.744212
H -0.379429 -0.339297 1.152817
H 0.143503 -1.834595 0.382663
H 0.145121 1.812806 -2.255011
H 1.454325 1.418404 1.835815
H -0.251541 4.237251 -1.893634
H 1.035871 3.848056 2.198018
H 0.191002 5.258785 0.331640
H -1.918752 -2.242486 1.548438
H -3.727720 0.029613 -1.647015
H -4.157892 -2.668236 2.514743
H -5.980563 -0.387609 -0.655667
H -6.190872 -1.738912 1.425031


%chk=000219163-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000219163

0 1
O -1.390399 -0.231385 -1.945480
N 2.363711 -0.530447 0.099314
C 1.074854 -0.055535 -0.514429
C 3.520860 0.267938 -0.407986
C 2.631389 -1.979499 -0.123792
C 4.828061 -0.105999 0.317105
C 3.912985 -2.435816 0.605772
C 5.136764 -1.610059 0.156002
C -0.141679 -0.832244 0.062047
C 0.862158 1.439929 -0.241930
C -1.428782 -0.627868 -0.742128
C 0.448341 2.314617 -1.274894
C 1.029155 1.956483 1.069373
C -2.747382 -0.962506 -0.098151
C 0.208139 3.682177 -1.005253
C 0.792638 3.321224 1.340498
C 0.379420 4.190751 0.302348
C -2.849869 -1.511309 1.208935
C -3.935919 -0.731606 -0.844049
C -4.113119 -1.823204 1.755766
C -5.196553 -1.036846 -0.295913
C -5.288950 -1.584916 1.006934
H 1.081549 -0.210713 -1.620795
H 3.303525 1.337965 -0.258718
H 3.652791 0.106458 -1.511071
H 2.729461 -2.201924 -1.220024
H 1.786014 -2.578089 0.256554
H 4.721341 0.139421 1.391800
H 5.654897 0.510296 -0.085667
H 4.072964 -3.514478 0.413236
H 3.762275 -2.308592 1.695526
H 5.358631 -1.828636 -0.909185
H 6.034053 -1.893097 0.738402
H -0.285375 -0.547204 1.119192
H 0.045304 -1.925041 0.055385
H 0.297238 1.916417 -2.284398
H 1.374814 1.280849 1.861016
H -0.113819 4.347359 -1.814686
H 0.931890 3.708958 2.356447
H 0.194342 5.250775 0.510855
H -1.950261 -1.702177 1.802976
H -3.836632 -0.312134 -1.850724
H -4.182410 -2.248087 2.763121
H -6.106276 -0.850646 -0.877137
H -6.269243 -1.823559 1.434602


