%chk=000181418.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181418

0 1
O 2.592295 -0.756305 1.829327
N 3.471712 0.260216 -0.039744
C 1.165204 0.656194 0.377551
C 1.571304 1.450339 -0.890231
C 3.065760 1.157288 -1.150038
C 0.019929 -0.283539 0.095584
C 2.445391 -0.055290 0.848368
C -1.326434 0.233073 0.088784
C 0.243150 -1.614007 -0.179010
C 4.861985 -0.195722 0.095159
C -2.397956 -0.649932 -0.209232
C -1.632956 1.602861 0.372025
C -0.838299 -2.493390 -0.469510
C -2.126988 -2.027396 -0.488477
C -3.740427 -0.151665 -0.225699
C -2.928079 2.056799 0.350765
C -3.998715 1.167901 0.045759
H 0.874564 1.358530 1.201264
H 1.397287 2.529613 -0.747428
H 0.955373 1.151343 -1.758220
H 3.223000 0.656970 -2.128297
H 3.675051 2.084427 -1.146449
H 1.251607 -2.030924 -0.165545
H 5.169728 -0.790302 -0.780921
H 4.953907 -0.836579 0.995789
H 5.552333 0.656107 0.210527
H -0.819015 2.285725 0.613260
H -0.616415 -3.540574 -0.672429
H -2.960955 -2.690880 -0.710106
H -4.549331 -0.843563 -0.456143
H -3.158352 3.098309 0.568553
H -5.016360 1.554475 0.035963


%chk=000181418-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000181418

0 1
O 2.794892 -0.631629 2.001716
N 3.406570 0.261128 -0.090652
C 1.194285 0.748664 0.628940
C 1.590585 1.716187 -0.534652
C 2.821078 1.039295 -1.197337
C 0.080898 -0.232842 0.243310
C 2.529448 0.042742 0.965968
C -1.277369 0.252190 0.105482
C 0.348017 -1.585519 -0.001378
C 4.738961 -0.333699 -0.152026
C -2.321508 -0.670692 -0.300823
C -1.647233 1.617172 0.361566
C -0.682620 -2.491526 -0.401639
C -1.993470 -2.043644 -0.553326
C -3.668415 -0.196196 -0.437725
C -2.968540 2.050152 0.224027
C -3.991364 1.137593 -0.183122
H 0.880376 1.313801 1.525311
H 1.887761 2.696971 -0.121113
H 0.772154 1.875434 -1.254038
H 2.525071 0.372513 -2.033650
H 3.548732 1.775170 -1.586937
H 1.363457 -1.970655 0.137093
H 4.822385 -1.050236 -0.992690
H 4.910071 -0.871555 0.795564
H 5.516919 0.443549 -0.274082
H -0.883515 2.334208 0.679825
H -0.432473 -3.542810 -0.581035
H -2.789748 -2.732766 -0.858950
H -4.445691 -0.906320 -0.745042
H -3.226846 3.094571 0.431570
H -5.023571 1.488854 -0.288956


