%chk=000256496.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256496

0 1
O 1.383679 -0.237257 2.156111
O 2.777423 0.219197 0.431656
N 0.913154 3.377887 -0.426622
C -0.362407 0.092984 -0.661712
C -0.243480 -1.394897 -0.255751
C -1.837847 0.582827 -0.649551
C 0.182568 0.321423 -2.092485
C 0.408865 0.959955 0.413387
C -1.124140 -2.338067 -1.084904
C -2.570576 0.354747 0.678250
C 1.656018 -0.044594 -2.304014
C -0.890272 -3.804402 -0.692334
C -3.931949 1.063130 0.697131
C 1.682221 0.302203 0.925416
C 2.039494 0.018342 -3.780641
C 0.703583 2.302000 -0.061991
C -1.773258 -4.750511 -1.502624
C -4.673211 0.822487 2.009934
C 2.455137 -0.907427 2.897545
C 3.379557 0.122370 3.509583
H -0.484997 -1.512036 0.819749
H 0.815430 -1.715826 -0.363744
H -2.393879 0.077715 -1.464099
H -1.864008 1.660839 -0.908442
H 0.027483 1.376839 -2.393551
H -0.437200 -0.272658 -2.796964
H -0.298690 1.054972 1.307388
H -0.911492 -2.202329 -2.164121
H -2.193459 -2.083887 -0.951369
H -1.946828 0.718368 1.524321
H -2.709975 -0.729773 0.855709
H 1.861929 -1.058193 -1.904930
H 2.310238 0.640256 -1.722717
H -1.088252 -3.942544 0.388544
H 0.174973 -4.069742 -0.841246
H -4.551439 0.712076 -0.151528
H -3.795088 2.151447 0.540020
H 3.100936 -0.220030 -3.918239
H 1.462855 -0.690517 -4.384045
H 1.876098 1.018910 -4.197799
H -1.599483 -5.794621 -1.218459
H -2.838165 -4.542362 -1.348907
H -1.575019 -4.667331 -2.577452
H -4.105553 1.195195 2.870225
H -5.643957 1.331651 2.014615
H -4.862642 -0.243646 2.179164
H 2.977874 -1.595166 2.209633
H 1.866029 -1.468087 3.646361
H 2.824492 0.879819 4.078176
H 3.953166 0.655302 2.735190
H 4.103364 -0.341438 4.190532


%chk=000256496-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256496

0 1
O 1.616686 -0.324061 2.161820
O 2.930296 0.548388 0.444824
N 0.745061 3.520709 -0.217783
C -0.329051 0.119355 -0.583667
C -0.264091 -1.381237 -0.164734
C -1.804262 0.657905 -0.583852
C 0.225127 0.350416 -2.030206
C 0.462830 0.974073 0.520100
C -1.096860 -2.349323 -1.035605
C -2.657312 0.461380 0.690959
C 1.595846 -0.253871 -2.416659
C -0.935536 -3.819889 -0.584484
C -4.084545 1.034300 0.517302
C 1.814449 0.399206 0.985532
C 1.929613 0.034752 -3.897450
C 0.634730 2.378934 0.109212
C -1.769407 -4.803436 -1.433103
C -4.959767 0.861970 1.776911
C 2.834786 -0.954597 2.770638
C 3.565013 0.045492 3.670225
H -0.582213 -1.484239 0.891904
H 0.791817 -1.716799 -0.191497
H -2.332300 0.172563 -1.428450
H -1.778108 1.739319 -0.832281
H 0.256159 1.442690 -2.220136
H -0.534196 -0.050475 -2.733257
H -0.176012 0.965999 1.422891
H -0.793451 -2.264118 -2.098205
H -2.170743 -2.078381 -0.992390
H -2.190347 0.958246 1.566562
H -2.731339 -0.614933 0.944879
H 1.586934 -1.350584 -2.256722
H 2.393866 0.157165 -1.774703
H -1.228267 -3.908185 0.482010
H 0.136392 -4.101065 -0.636136
H -4.572628 0.537737 -0.346183
H -4.013805 2.109903 0.257423
H 2.906425 -0.398859 -4.179407
H 1.162073 -0.389309 -4.573517
H 1.977991 1.123773 -4.085718
H -1.638509 -5.846071 -1.089996
H -2.847660 -4.561884 -1.375671
H -1.472849 -4.758741 -2.498048
H -4.510997 1.379404 2.645809
H -5.972715 1.277127 1.624168
H -5.069425 -0.206484 2.042832
H 3.486052 -1.313631 1.954429
H 2.425219 -1.805505 3.337517
H 2.888042 0.449146 4.442615
H 3.973675 0.881369 3.078634
H 4.406614 -0.460043 4.179061


