%chk=000258673.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258673

0 1
O 6.242631 -1.071505 -0.436750
N -0.103937 0.619127 0.126930
N 2.604064 -0.424013 -0.044872
C 1.087823 1.490723 0.444693
C 2.291186 0.996739 -0.403463
C 0.216111 -0.811435 0.457444
C 1.423331 -1.288292 -0.370529
C -1.326952 1.051835 0.884645
C 0.801962 2.953965 0.083282
C 3.836747 -0.899978 -0.746431
C -2.546949 0.298557 0.407984
C 5.037750 -0.570176 0.158756
C -2.814242 0.175665 -0.964478
C -3.437585 -0.252410 1.340685
C -3.962331 -0.490864 -1.397036
C -4.587732 -0.915690 0.901952
C -4.852652 -1.036179 -0.465192
H 1.363466 1.423971 1.530032
H 2.064743 1.130693 -1.483603
H 3.178869 1.621000 -0.171085
H -0.670430 -1.432041 0.197863
H 0.420901 -0.965350 1.539755
H 1.666386 -2.336144 -0.091991
H 1.164783 -1.280799 -1.451773
H -1.495348 2.137659 0.684694
H -1.205368 0.953732 1.986345
H 0.418343 3.043363 -0.941854
H 0.054238 3.400452 0.748323
H 1.706751 3.566299 0.156193
H 3.976520 -0.463516 -1.756551
H 3.799788 -2.001974 -0.895789
H 4.987629 -1.114292 1.121548
H 5.140862 0.509993 0.352251
H -2.110572 0.594603 -1.685369
H -3.239446 -0.166760 2.406660
H 6.443651 -0.597526 -1.264780
H -4.165395 -0.585681 -2.462218
H -5.277692 -1.339967 1.629048
H -5.747701 -1.552586 -0.804222


%chk=000258673-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000258673

0 1
O 6.348538 -0.934487 -0.659842
N -0.081747 0.564425 0.252586
N 2.626539 -0.452748 -0.036230
C 1.089017 1.459438 0.508174
C 2.290175 0.959571 -0.328276
C 0.262677 -0.851748 0.548966
C 1.452077 -1.318217 -0.298338
C -1.323434 0.966706 0.961009
C 0.792623 2.927244 0.136406
C 3.858378 -0.912992 -0.713423
C -2.566811 0.258781 0.426775
C 5.135460 -0.445281 0.015753
C -2.736716 0.056931 -0.966777
C -3.594189 -0.158247 1.307875
C -3.912400 -0.543673 -1.467315
C -4.775017 -0.756598 0.809512
C -4.938593 -0.950605 -0.581125
H 1.390322 1.405142 1.586537
H 2.040129 1.103109 -1.412537
H 3.163254 1.594882 -0.093647
H -0.617952 -1.479308 0.324445
H 0.516770 -0.986064 1.630568
H 1.709647 -2.359054 -0.028333
H 1.155412 -1.300955 -1.377845
H -1.459067 2.054156 0.819941
H -1.248376 0.793544 2.065446
H 0.322270 2.980997 -0.862439
H 0.129107 3.426072 0.863532
H 1.734013 3.506045 0.109322
H 3.899529 -0.577396 -1.785243
H 3.864590 -2.018429 -0.726143
H 5.172839 -0.884312 1.024246
H 5.159563 0.660372 0.113461
H -1.928090 0.364594 -1.639301
H -3.469538 -0.017069 2.389199
H 6.366393 -0.576856 -1.583846
H -4.031082 -0.694950 -2.546663
H -5.560840 -1.075045 1.504147
H -5.851269 -1.416776 -0.969477


