%chk=000290410.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290410

0 1
O 0.532842 2.662805 -0.335432
O -0.567103 1.451958 1.199173
O 0.854217 -3.102829 -1.700923
O 4.026859 1.498633 1.299541
N 1.913308 0.365163 0.110888
N 2.436470 -1.878660 -0.594259
N 4.094301 -0.658172 0.528274
N -5.535987 0.266354 1.796794
C 0.196767 -0.901341 -1.023438
C 0.606669 0.237354 -0.400976
C -1.156840 -1.103131 -1.636075
C -0.269703 1.469426 -0.187248
C -2.316200 -0.764260 -0.740246
C 1.134991 -2.057972 -1.156058
C 2.772926 -0.740259 -0.004257
C -2.359024 -1.239659 0.582202
C -3.382075 0.005895 -1.225690
C -3.433379 -0.936734 1.412694
C -4.467704 0.320156 -0.407852
C -4.493822 -0.143654 0.922430
C 0.600167 3.183582 -1.674949
C -1.670956 2.307629 1.584507
C 4.665211 0.473212 1.169900
C 6.069201 0.264144 1.638730
H -1.257349 -2.178160 -1.946639
H -1.207070 -0.537143 -2.591599
H -1.166338 1.507711 -0.835228
H 2.191560 1.256265 0.578730
H -1.535127 -1.847499 0.961388
H -3.373742 0.362176 -2.255330
H -3.446755 -1.300913 2.436749
H -5.283749 0.921819 -0.797295
H 4.644381 -1.524509 0.409405
H 1.244452 4.065408 -1.554959
H -0.393332 3.477391 -2.025209
H 1.065616 2.455881 -2.346344
H -1.668594 2.203505 2.676779
H -2.605004 1.923113 1.158983
H -1.470704 3.340731 1.288520
H -6.409796 0.509900 1.350306
H -5.689324 -0.327832 2.600688
H 6.446308 1.182351 2.124836
H 6.762612 0.032660 0.816171
H 6.152220 -0.543996 2.381518


%chk=000290410-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000290410

0 1
O 0.382767 2.781487 -0.823743
O 0.068022 1.968916 1.347597
O 0.917061 -2.784262 -2.091315
O 3.918230 1.341576 1.834744
N 1.932331 0.386184 0.272120
N 2.488405 -1.726455 -0.713097
N 4.046104 -0.669558 0.660284
N -5.770541 -0.426027 1.686310
C 0.254965 -0.675507 -1.098663
C 0.660443 0.384490 -0.307673
C -1.114114 -0.792566 -1.757503
C -0.140589 1.642238 -0.031743
C -2.324626 -0.670980 -0.832354
C 1.214807 -1.798721 -1.348609
C 2.771769 -0.676951 0.044704
C -2.377936 -1.352657 0.411296
C -3.459843 0.089172 -1.210524
C -3.509614 -1.277019 1.244681
C -4.603074 0.176448 -0.389253
C -4.646412 -0.507451 0.859061
C -0.030963 2.756745 -2.231174
C -0.739857 3.108155 1.815978
C 4.574971 0.303836 1.511346
C 5.981999 0.018996 2.010699
H -1.108998 -1.785432 -2.249674
H -1.210725 -0.052552 -2.576594
H -1.214769 1.493447 -0.270751
H 2.232343 1.143977 0.913373
H -1.519864 -1.956088 0.730398
H -3.458137 0.616503 -2.174043
H -3.521848 -1.818391 2.199158
H -5.466358 0.771356 -0.713273
H 4.593118 -1.501730 0.420602
H 0.318279 3.707715 -2.661909
H -1.135190 2.688467 -2.327258
H 0.435492 1.913439 -2.778306
H -0.498903 3.219271 2.883378
H -1.819876 2.889702 1.694541
H -0.473200 4.024727 1.262733
H -6.594902 0.090378 1.395123
H -5.808968 -0.938467 2.562144
H 6.298797 0.843591 2.664594
H 6.693493 -0.065339 1.169047
H 6.017312 -0.926165 2.582749


