%chk=000249187.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249187

0 1
O 1.385647 -0.232646 -1.317944
O 1.361469 -1.949015 1.905095
O -0.553167 -2.857152 -0.648115
O 2.948913 1.699890 0.291876
O -0.725873 0.757663 -3.634060
O -0.000984 -0.250361 2.555841
O -1.716787 -3.381248 1.225008
O 1.261165 2.947202 -0.578051
O -2.475325 4.245960 -1.213746
N -0.868813 0.540667 -1.314326
N -1.219917 1.061614 -0.113445
N -1.629553 2.529797 -2.459302
C 1.277873 -1.732040 0.495366
C -0.153667 -1.587660 -0.078872
C 2.039542 -0.495041 -0.046378
C 0.016047 -0.664147 -1.312616
C 2.012779 0.741542 0.851111
C -1.023586 1.254202 -2.571278
C 0.621334 -1.237797 2.846535
C -1.376626 -3.687058 0.111461
C -1.776125 2.236755 -0.049281
C 2.445661 2.744337 -0.465007
C 0.798984 -1.916991 4.154573
C -2.005495 3.135228 -1.212934
C -1.683080 -4.892657 -0.698129
C 3.591230 3.509600 -1.025403
H 1.750128 -2.682170 0.130469
H -0.902757 -1.247677 0.678104
H 3.083658 -0.726060 -0.362282
H -0.119955 -1.189147 -2.298251
H 2.435172 0.537926 1.852124
H 1.002202 1.189162 0.952326
H -1.736416 3.075525 -3.326325
H -2.085889 2.620929 0.935207
H 0.937662 -1.186090 4.966861
H 1.653570 -2.613421 4.163052
H -0.101294 -2.510887 4.398852
H -1.375881 -5.810477 -0.170309
H -2.768172 -4.973360 -0.882013
H -1.181532 -4.885587 -1.680957
H 3.651481 3.367503 -2.117591
H 4.558317 3.198359 -0.599101
H 3.468259 4.589327 -0.844647


%chk=000249187-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249187

0 1
O 1.620826 -0.186895 -1.337065
O 1.463089 -2.179150 1.829122
O -0.641507 -2.739650 -0.633021
O 2.972956 1.848328 0.326767
O -0.399116 0.823176 -3.720856
O 0.155452 -0.452663 2.720961
O -1.445125 -3.218169 1.507233
O 1.179466 2.936809 -0.710531
O -2.693832 4.172297 -1.375525
N -0.689909 0.622528 -1.387195
N -1.172388 1.097037 -0.182820
N -1.570755 2.481319 -2.548994
C 1.372430 -1.701137 0.436578
C -0.055102 -1.471929 -0.125875
C 2.166422 -0.426716 0.027477
C 0.184367 -0.567788 -1.354486
C 2.062752 0.824507 0.912449
C -0.843817 1.284646 -2.642415
C 0.717478 -1.558045 2.857202
C -1.345318 -3.524887 0.299646
C -1.837356 2.235185 -0.172254
C 2.407991 2.821740 -0.510580
C 0.706042 -2.435630 4.081189
C -2.083814 3.070708 -1.365340
C -1.934655 -4.745893 -0.367006
C 3.494614 3.676745 -1.121043
H 1.816811 -2.541796 -0.123886
H -0.725151 -1.011476 0.615720
H 3.233829 -0.656931 -0.128521
H 0.035074 -1.100529 -2.305142
H 2.464900 0.630892 1.918633
H 1.036706 1.214554 0.986545
H -1.693203 2.999368 -3.425704
H -2.209523 2.582371 0.793790
H 0.501599 -1.830748 4.977033
H 1.653076 -2.986950 4.188636
H -0.108357 -3.173133 3.956014
H -1.551995 -5.654647 0.128875
H -3.030519 -4.738733 -0.234335
H -1.692102 -4.775946 -1.438379
H 3.907213 3.156788 -2.004970
H 4.318694 3.836091 -0.408232
H 3.071960 4.638854 -1.446201


