%chk=000257631.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257631

0 1
O -6.159682 -0.220495 0.251320
N 4.427288 -1.204804 0.282874
C 2.319158 0.234909 0.434235
C 1.602183 1.137371 -0.622624
C 3.772237 0.064358 -0.194396
C 0.059797 1.134221 -0.591064
C 2.156026 0.685414 -1.992792
C 1.630566 -1.144279 0.546211
C 3.478871 -0.047510 -1.724578
C -0.526864 -0.290358 -0.455775
C 0.115107 -1.044860 0.725402
C 2.324077 0.923506 1.804760
C -0.482566 2.040141 0.529808
C 4.653316 1.307099 0.051242
C -2.030599 -0.265574 -0.291697
C -2.004093 2.181285 0.429003
C -2.716277 0.884424 0.157633
C 4.834155 -1.166304 1.719788
C 5.614950 -1.592176 -0.540680
C -2.756732 -1.429254 -0.575000
C -4.104227 0.849559 0.324359
C -4.144638 -1.486226 -0.417292
C -4.800573 -0.337325 0.037306
C -6.984600 -1.380225 -0.008731
H 1.936301 2.190045 -0.449991
H -0.297293 1.553908 -1.566473
H 2.302244 1.550277 -2.659413
H 1.446337 0.015707 -2.509555
H 2.071437 -1.717788 1.383461
H 1.860221 -1.744595 -0.357079
H 3.387194 -1.109363 -2.020511
H 4.301187 0.370952 -2.323951
H -0.280293 -0.843769 -1.398340
H -0.319147 -2.058736 0.806637
H -0.133513 -0.537102 1.676605
H 2.895696 0.339448 2.540531
H 2.752065 1.928754 1.769173
H 1.296536 1.021891 2.187047
H -0.011239 3.038669 0.483205
H -0.201590 1.615273 1.517965
H 4.840981 1.476130 1.115206
H 5.626863 1.206095 -0.438972
H 4.181534 2.210922 -0.347904
H -2.261273 2.894434 -0.384849
H -2.394609 2.641569 1.360103
H 5.712559 -0.540638 1.933694
H 5.054253 -2.196774 2.042595
H 3.995403 -0.802335 2.342662
H 6.076168 -2.495724 -0.111606
H 6.389798 -0.816271 -0.623016
H 5.280216 -1.861982 -1.554578
H -2.231839 -2.318406 -0.927076
H -4.658950 1.717799 0.669816
H -4.679984 -2.399502 -0.644014
H -6.924654 -1.660377 -1.064183
H -7.985299 -1.006210 0.242716
H -6.698091 -2.205800 0.648880


%chk=000257631-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257631

0 1
O -6.293746 -0.225471 0.180096
N 4.536558 -1.207480 0.237591
C 2.375528 0.230942 0.486449
C 1.625139 1.152764 -0.554365
C 3.814004 0.045573 -0.198942
C 0.067148 1.168218 -0.513338
C 2.166367 0.735459 -1.957294
C 1.651394 -1.147457 0.598381
C 3.450849 -0.098685 -1.714284
C -0.536544 -0.257973 -0.388515
C 0.123887 -1.028609 0.789892
C 2.419338 0.932136 1.872568
C -0.553088 2.106103 0.553808
C 4.696533 1.316793 0.000071
C -2.062293 -0.233000 -0.264861
C -2.063921 2.278493 0.292333
C -2.781900 0.946098 0.093378
C 4.885648 -1.315702 1.669286
C 5.710785 -1.560468 -0.593802
C -2.795072 -1.422842 -0.488388
C -4.186412 0.891622 0.231651
C -4.199458 -1.484258 -0.360075
C -4.898106 -0.308770 0.010003
C -7.070214 -1.446817 -0.032959
H 1.953606 2.195218 -0.359339
H -0.256191 1.580700 -1.496002
H 2.366242 1.631017 -2.574106
H 1.414738 0.139477 -2.507824
H 2.085372 -1.729010 1.432987
H 1.851369 -1.742343 -0.312795
H 3.262828 -1.167498 -1.925645
H 4.282423 0.226994 -2.364979
H -0.281331 -0.823976 -1.311017
H -0.317267 -2.042171 0.855539
H -0.122249 -0.528753 1.747595
H 3.108021 0.440932 2.579329
H 2.732104 1.987958 1.780876
H 1.420343 0.930305 2.340900
H -0.053480 3.094264 0.520573
H -0.400530 1.703918 1.572313
H 4.956111 1.481040 1.060959
H 5.639168 1.221664 -0.569851
H 4.182572 2.224972 -0.362761
H -2.200164 2.894756 -0.621724
H -2.541246 2.841103 1.117523
H 5.564220 -0.509240 2.043834
H 5.401806 -2.280062 1.830874
H 3.981126 -1.321946 2.296554
H 6.053302 -2.572911 -0.309300
H 6.582697 -0.869012 -0.476783
H 5.440674 -1.589417 -1.660803
H -2.252203 -2.332139 -0.777663
H -4.754284 1.786388 0.511089
H -4.723167 -2.426334 -0.547297
H -6.969181 -1.815311 -1.073040
H -8.115422 -1.161054 0.157700
H -6.768330 -2.246801 0.671692


