%chk=000260758.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000260758

0 1
O -2.393144 1.926840 -1.208314
O -2.752901 1.946599 1.014934
O -1.458145 -3.569741 0.510151
N -3.630446 -0.364935 -0.681902
N -3.361506 -2.749243 -0.459172
N -5.412757 -1.860542 -1.281685
C 0.842345 -0.844822 -0.316065
C -0.185176 -1.036279 0.811663
C 2.245906 -0.598574 0.248028
C -1.569946 -1.190738 0.262802
C 3.283304 -0.451594 -0.876491
C -2.351219 -0.151494 -0.133926
C -1.955057 1.316600 -0.001228
C 4.649664 -0.179333 -0.307968
C -2.074270 -2.594772 0.142132
C -4.085898 -1.700434 -0.814002
C 5.460116 -1.242839 0.120036
C 5.120862 1.137516 -0.194026
C -2.212466 3.380017 -1.259662
C -2.309639 1.719821 2.383841
C 6.726760 -0.989620 0.651745
C 6.389265 1.385253 0.338150
C 7.194952 0.323978 0.761707
C -2.705038 3.745953 -2.645038
C -3.280400 2.533998 3.216597
H 0.541228 -0.010536 -0.976594
H 0.844415 -1.748327 -0.960537
H -0.132081 -0.204449 1.538645
H 0.079017 -1.952980 1.393755
H 2.539061 -1.434391 0.915075
H 2.253755 0.308221 0.882659
H 3.301429 -1.372218 -1.496045
H 2.980434 0.357590 -1.570612
H -0.874274 1.484487 0.176882
H -4.202489 0.451505 -0.913462
H 5.100390 -2.266820 0.038589
H 4.499565 1.968143 -0.520178
H -1.142795 3.602279 -1.110375
H -2.816348 3.825423 -0.448869
H -1.266999 2.067521 2.482513
H -2.375330 0.636563 2.593469
H 7.351370 -1.818334 0.981342
H 6.750595 2.408590 0.422415
H -5.695408 -2.836733 -1.389952
H -5.687300 -1.295871 -2.075822
H 8.181831 0.518474 1.174726
H -2.562016 4.813440 -2.849244
H -3.772566 3.518323 -2.764405
H -2.172332 3.177271 -3.420358
H -3.089460 2.410028 4.288748
H -4.318983 2.230033 3.020070
H -3.216977 3.603654 2.977758


%chk=000260758-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000260758

0 1
O -2.925087 2.091431 -1.269179
O -3.084471 1.994914 1.061215
O -0.972117 -3.284011 0.278316
N -3.644427 -0.406878 -0.802896
N -3.079344 -2.722975 -0.578739
N -5.141367 -2.104847 -1.494870
C 1.006092 -0.758133 -0.371321
C -0.116064 -0.612717 0.694368
C 2.410799 -0.525651 0.224183
C -1.485531 -0.930151 0.132013
C 3.539968 -0.686891 -0.831649
C -2.420389 0.005263 -0.254900
C -2.310282 1.510329 -0.102710
C 4.925151 -0.458450 -0.244523
C -1.811001 -2.385533 -0.047719
C -3.922647 -1.759516 -0.942378
C 5.590425 -1.493215 0.464524
C 5.567002 0.802358 -0.352285
C -2.824308 3.572231 -1.333621
C -2.419301 1.775843 2.364069
C 6.857653 -1.275465 1.049842
C 6.834838 1.026703 0.231985
C 7.485141 -0.012471 0.936602
C -3.485791 4.012260 -2.636643
C -3.302754 2.415337 3.433385
H 0.827062 -0.043116 -1.201050
H 0.946229 -1.776283 -0.799064
H -0.072350 0.399756 1.139231
H 0.092052 -1.341538 1.500861
H 2.583820 -1.243649 1.050623
H 2.474794 0.488319 0.670485
H 3.469755 -1.705440 -1.261692
H 3.357258 0.024865 -1.660761
H -1.250924 1.831981 0.004441
H -4.241754 0.335211 -1.179992
H 5.111787 -2.476959 0.551978
H 5.070754 1.611464 -0.903444
H -1.749474 3.851744 -1.310895
H -3.324411 4.001101 -0.446710
H -1.408997 2.241536 2.347150
H -2.298586 0.688136 2.543816
H 7.357141 -2.088562 1.589314
H 7.316454 2.006698 0.133985
H -5.321196 -3.100613 -1.598270
H -5.868614 -1.429371 -1.712404
H 8.469554 0.157546 1.387327
H -3.420949 5.110367 -2.742187
H -4.552062 3.726973 -2.648258
H -2.989895 3.547462 -3.505930
H -2.853000 2.274561 4.432950
H -4.304641 1.952984 3.433538
H -3.419095 3.497560 3.250389


