%chk=000239410.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239410

0 1
O 3.822689 1.972077 0.124951
O -2.924095 -0.479781 -0.518077
O 3.195536 1.310130 2.197588
N 3.395995 -0.260380 0.428278
C 3.606436 -0.128097 -1.049023
C 3.973375 1.372673 -1.198933
C 2.477707 -1.308427 0.940969
C 4.728941 -1.050409 -1.510555
C 3.413771 1.012870 1.051624
C 1.035990 -1.064781 0.575648
C 0.424659 -1.808395 -0.449361
C 0.298034 -0.090801 1.261931
C -1.628455 -0.599562 -0.084730
C -5.110012 0.335658 -0.604141
C -0.904119 -1.586385 -0.788555
C -1.038805 0.153492 0.940338
C -3.786019 0.506912 0.136019
C -6.172163 1.298795 -0.061692
C -7.499961 1.133948 -0.796189
H 2.664079 -0.364192 -1.606505
H 5.022212 1.553843 -1.482612
H 3.290374 1.935078 -1.853538
H 2.598675 -1.342523 2.053324
H 2.837596 -2.290066 0.557472
H 4.970936 -0.889867 -2.566986
H 5.647940 -0.897689 -0.926147
H 4.455810 -2.106091 -1.388456
H 0.993462 -2.570268 -0.982545
H 0.775701 0.491588 2.057154
H -5.453166 -0.715391 -0.516095
H -4.953724 0.496679 -1.690279
H -1.398428 -2.151398 -1.574964
H -1.592349 0.912682 1.482416
H -3.341777 1.506545 -0.002346
H -3.856439 0.255402 1.207269
H -5.820381 2.345322 -0.158537
H -6.322532 1.126150 1.022721
H -7.397478 1.334343 -1.869232
H -7.898383 0.117951 -0.690567
H -8.256733 1.824165 -0.405439


%chk=000239410-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239410

0 1
O 4.440386 1.952090 0.491174
O -2.985620 -0.714797 -0.533365
O 3.638763 1.075641 2.521175
N 3.417892 -0.092827 0.461581
C 3.575342 0.224456 -0.976879
C 4.573271 1.413702 -0.891453
C 2.567715 -1.187289 0.966189
C 4.102805 -0.947455 -1.818298
C 3.802438 0.958186 1.289984
C 1.096641 -1.041753 0.584890
C 0.466864 -1.977946 -0.275078
C 0.325840 0.036365 1.085262
C -1.645772 -0.759229 -0.123593
C -5.225916 0.191106 -0.619206
C -0.889494 -1.845773 -0.628842
C -1.034215 0.187882 0.739117
C -3.827063 0.390119 -0.032500
C -6.209409 1.296005 -0.167167
C -7.624672 1.094986 -0.750399
H 2.599274 0.560231 -1.387430
H 5.616300 1.072957 -1.027663
H 4.343143 2.231634 -1.590576
H 2.692342 -1.173242 2.064712
H 2.962137 -2.151176 0.594548
H 4.302702 -0.611819 -2.852451
H 5.040610 -1.345803 -1.391188
H 3.363918 -1.766084 -1.873208
H 1.041480 -2.827392 -0.666379
H 0.792804 0.762412 1.762052
H -5.606360 -0.801404 -0.310521
H -5.154489 0.178760 -1.723770
H -1.383239 -2.566449 -1.287812
H -1.601631 1.029373 1.147229
H -3.394183 1.361000 -0.353478
H -3.853835 0.363175 1.077124
H -5.820192 2.287718 -0.475734
H -6.265368 1.312055 0.940489
H -7.602234 1.103655 -1.856184
H -8.050476 0.125576 -0.430782
H -8.313602 1.893154 -0.419372


