%chk=000184235.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184235

0 1
O 0.412580 0.437118 1.926099
N 1.670666 -0.259734 0.175780
N 3.764936 -1.153179 0.137953
C -0.852028 2.232050 -0.275016
C -0.637932 0.674403 -0.262893
C -1.904618 -0.113118 0.120179
C -1.797151 2.582741 -1.438182
C 0.510241 2.910882 -0.508912
C -1.450374 2.721481 1.049679
C -1.782597 -1.601247 -0.230331
C 0.456186 0.308572 0.724526
C -3.051526 -2.370439 0.164457
C -2.941899 -3.852246 -0.185772
C 2.004158 -0.514608 -1.184466
C 2.808958 -0.679792 0.940621
C 3.276488 -1.055664 -1.183891
H -0.348197 0.381210 -1.304412
H -2.110874 0.007107 1.204559
H -2.778695 0.327033 -0.402173
H -1.365008 2.328704 -2.411033
H -2.756537 2.058671 -1.354584
H -2.017840 3.656447 -1.453460
H 0.389134 3.987842 -0.676451
H 1.032261 2.509375 -1.382836
H 1.177670 2.806701 0.354724
H -2.486490 2.394748 1.181732
H -0.882498 2.347048 1.914792
H -1.446558 3.814973 1.110573
H -0.906309 -2.046015 0.281640
H -1.592317 -1.726617 -1.313530
H -3.237090 -2.257274 1.251269
H -3.933636 -1.931204 -0.341119
H -2.796932 -4.006290 -1.261000
H -2.099084 -4.328390 0.329330
H -3.848958 -4.395379 0.103507
H 1.331618 -0.297774 -1.991858
H 2.829618 -0.599362 2.020707
H 3.881736 -1.382376 -2.012509


%chk=000184235-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000184235

0 1
O 0.367075 0.234474 1.927537
N 1.715899 -0.233512 0.099355
N 3.865729 -0.987541 0.095045
C -0.820851 2.214644 -0.271801
C -0.655353 0.630563 -0.266399
C -1.943854 -0.144928 0.132193
C -1.701468 2.607001 -1.489713
C 0.570354 2.887231 -0.438579
C -1.479660 2.724291 1.035948
C -1.858635 -1.657316 -0.177550
C 0.472631 0.208967 0.674901
C -3.147361 -2.418462 0.208080
C -3.070420 -3.927283 -0.109540
C 2.095704 -0.383888 -1.258560
C 2.839568 -0.618938 0.867907
C 3.403859 -0.843185 -1.237723
H -0.394240 0.346491 -1.303572
H -2.128063 -0.000329 1.212704
H -2.808281 0.284508 -0.409307
H -1.228608 2.302880 -2.443340
H -2.705667 2.149127 -1.442420
H -1.837553 3.704066 -1.516416
H 0.448458 3.979307 -0.560290
H 1.106292 2.507252 -1.328915
H 1.213579 2.722819 0.445284
H -2.520177 2.366737 1.132756
H -0.918966 2.388367 1.925322
H -1.502815 3.830220 1.034881
H -1.001575 -2.105465 0.366462
H -1.656555 -1.805864 -1.259656
H -3.341651 -2.276074 1.290309
H -4.010372 -1.969716 -0.325503
H -2.905516 -4.098035 -1.190289
H -2.234970 -4.404744 0.436205
H -4.002000 -4.448859 0.176607
H 1.430539 -0.166990 -2.087145
H 2.817558 -0.599751 1.953456
H 4.048466 -1.081662 -2.080537


