%chk=000296159.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296159

0 1
O 5.385039 -1.692327 -0.311505
O -1.975282 2.512365 0.818789
O 3.286950 2.802676 -0.331762
O 1.444209 2.302812 -1.348438
N 0.227946 0.287645 0.552700
N 2.425283 2.019362 -0.676982
C -3.042549 0.484650 0.183697
C 1.521723 -0.188672 0.195317
C -5.295266 -1.178897 -0.059244
C 2.591558 0.593427 -0.288748
C -2.898425 -0.840242 -0.254066
C -4.323685 0.969825 0.507403
C 4.086703 -1.290811 -0.109312
C 3.878218 0.061640 -0.423561
C -4.015781 -1.666125 -0.375810
C -5.440562 0.147678 0.384688
C 1.773938 -1.544511 0.518904
C 3.035287 -2.101726 0.357127
C -1.891022 1.407463 0.336562
C -6.496666 -2.054496 -0.185960
C -0.558900 0.933204 -0.231225
C 5.733236 -3.056828 0.031077
H 4.717512 0.679135 -0.758398
H -1.911555 -1.236696 -0.496538
H -4.428631 2.001875 0.858218
H -3.893842 -2.692617 -0.715824
H -6.427739 0.532230 0.635585
H 0.953206 -2.152086 0.911433
H 3.200647 -3.148918 0.602489
H -7.249360 -1.609485 -0.854110
H -6.263388 -3.050564 -0.584729
H -6.983419 -2.205162 0.789852
H -0.393931 1.238942 -1.282377
H 6.805348 -3.075326 -0.211991
H 5.179063 -3.760838 -0.595682
H 5.573235 -3.235999 1.098120


%chk=000296159-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000296159

0 1
O 5.447329 -1.753479 0.329352
O -2.120156 0.736894 -3.058265
O 1.618438 -0.812190 3.314758
O 0.167216 0.393436 2.032134
N 0.011219 -0.402088 -0.500133
N 1.211405 -0.356761 2.175160
C -3.023790 0.113311 -0.898837
C 1.391455 -0.624116 -0.328755
C -5.265202 -0.389453 0.803025
C 1.987971 -0.707042 0.971068
C -2.845509 -0.007832 0.507549
C -4.335492 -0.013483 -1.442686
C 4.130447 -1.395843 0.039242
C 3.326495 -1.088206 1.159807
C -3.958899 -0.252113 1.338152
C -5.433154 -0.266128 -0.606403
C 2.228226 -0.950514 -1.432702
C 3.573221 -1.327218 -1.265431
C -1.914319 0.417676 -1.838806
C -6.458727 -0.652469 1.700979
C -0.461945 0.368567 -1.439910
C 6.337045 -2.062920 -0.796614
H 3.743377 -1.136416 2.168409
H -1.850427 0.088589 0.947195
H -4.459710 0.094452 -2.525539
H -3.809811 -0.337010 2.420709
H -6.436001 -0.368396 -1.038826
H 1.789372 -0.947149 -2.436098
H 4.171130 -1.572026 -2.147862
H -6.996105 -1.569192 1.393569
H -6.156349 -0.771961 2.754789
H -7.186558 0.179641 1.649373
H 0.183171 0.993982 -2.090390
H 7.306195 -2.298765 -0.335068
H 6.445723 -1.192233 -1.471176
H 5.971817 -2.938945 -1.366071


