%chk=000236265.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236265

0 1
O -1.230738 -1.632436 -0.812373
O 3.153224 2.755384 0.035548
O 1.417303 4.121463 0.352398
N -3.357563 -0.340114 0.237780
N 1.760381 -2.620396 0.483605
C -1.189201 0.743191 -0.283143
C 0.868073 -0.602581 -0.592756
C -2.689267 0.896693 -0.297072
C 1.510211 -1.945002 -0.835711
C -0.550846 -0.496215 -0.548800
C -0.393593 1.866104 -0.057711
C 1.628427 0.540437 -0.385823
C 1.006302 1.775744 -0.116527
C -4.805877 -0.357790 -0.124186
C -3.178908 -0.454541 1.715919
C 2.998275 -2.100724 1.135234
C 1.857291 -4.099086 0.293609
C 1.790590 2.992123 0.113841
H -2.991823 1.815353 0.253586
H -3.016457 1.044089 -1.354519
H 0.806617 -2.576986 -1.431465
H 2.427224 -1.829183 -1.452860
H -0.851608 2.836455 0.159858
H 2.721506 0.495732 -0.425846
H -5.259024 -1.293311 0.244004
H -4.910521 -0.356126 -1.221299
H -5.388764 0.483347 0.280278
H -3.576959 -1.424187 2.055283
H -3.662333 0.342973 2.298321
H -2.099607 -0.444379 1.953685
H 2.856086 -1.032069 1.366225
H 3.918733 -2.211926 0.544934
H 3.140700 -2.615833 2.098569
H 1.994592 -4.576325 1.277180
H 2.668985 -4.432556 -0.368066
H 0.899685 -4.468682 -0.109264
H -2.247623 -1.536424 -0.596385
H 3.680808 3.582583 0.190746


%chk=000236265-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000236265

0 1
O -1.305364 -1.586520 -0.702406
O 3.245923 2.871373 -0.109109
O 1.402301 4.226389 0.286810
N -3.304071 -0.356398 0.284018
N 1.699093 -2.708163 0.409258
C -1.146971 0.799291 -0.246532
C 0.898373 -0.573620 -0.602477
C -2.666272 0.892486 -0.273284
C 1.532444 -1.930815 -0.848533
C -0.523248 -0.467335 -0.515260
C -0.345010 1.933640 -0.054677
C 1.669631 0.591730 -0.445457
C 1.068253 1.848738 -0.160507
C -4.726030 -0.491088 -0.125216
C -3.134716 -0.457813 1.762109
C 2.764618 -2.181131 1.279635
C 1.830307 -4.155981 0.161918
C 1.856301 3.079924 0.028451
H -3.019353 1.796773 0.267195
H -3.014133 0.974229 -1.322766
H 0.869337 -2.517314 -1.508125
H 2.511164 -1.793589 -1.377389
H -0.793755 2.910891 0.160605
H 2.759455 0.537587 -0.535641
H -5.134445 -1.436076 0.271191
H -4.794842 -0.515717 -1.226231
H -5.350219 0.347933 0.252566
H -3.491179 -1.443697 2.105097
H -3.698569 0.337179 2.295579
H -2.065820 -0.366340 2.015338
H 2.563640 -1.124481 1.526236
H 3.783695 -2.238054 0.813795
H 2.788112 -2.753638 2.224451
H 1.864833 -4.693945 1.126869
H 2.750688 -4.432829 -0.415279
H 0.949970 -4.515453 -0.399350
H -2.290969 -1.307877 -0.355515
H 3.701127 3.744511 0.029430


