%chk=000184239.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184239

0 1
O 1.486531 0.395889 -1.869140
N 0.708401 1.583729 -0.048870
N 1.326834 2.782432 -0.308791
N -0.377363 3.113589 1.197780
C 2.386349 -1.610171 0.269837
C 0.986893 -0.901555 0.140627
C -0.103528 -1.802905 -0.467763
C 2.268477 -2.719705 1.329772
C 3.413776 -0.565820 0.739758
C 2.833688 -2.211915 -1.067563
C 1.115138 0.337768 -0.731856
C -1.473936 -1.221627 -0.246177
C -2.151748 -1.456275 0.959763
C -2.071445 -0.426295 -1.235284
C -0.350228 1.811704 0.885266
C -3.414526 -0.896902 1.173029
C -3.334204 0.130850 -1.016638
C -4.006887 -0.101008 0.187448
C 0.676345 3.694036 0.449833
H 0.676819 -0.626032 1.181342
H 0.088970 -1.962455 -1.551017
H -0.036328 -2.816589 -0.015442
H 2.023415 -2.319784 2.319085
H 1.500817 -3.456589 1.068235
H 3.214697 -3.265035 1.430515
H 4.377277 -1.035935 0.970219
H 3.092208 -0.039915 1.644438
H 3.617898 0.192420 -0.027532
H 3.864938 -2.578916 -1.012987
H 2.803207 -1.469297 -1.879193
H 2.208977 -3.055555 -1.375344
H -1.699478 -2.079571 1.728545
H -1.554115 -0.240510 -2.176587
H -1.019088 1.035946 1.236739
H -3.939141 -1.082576 2.109614
H -3.794002 0.749925 -1.786939
H -4.989240 0.336951 0.356655
H 0.909403 4.749300 0.500921


%chk=000184239-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000184239

0 1
O 1.234674 0.401395 -1.920265
N 0.817076 1.622454 0.030350
N 1.175016 2.851594 -0.570729
N 0.234553 3.193778 1.534084
C 2.355074 -1.571918 0.277049
C 0.916531 -0.909434 0.128201
C -0.159427 -1.840154 -0.520516
C 2.277256 -2.663711 1.379158
C 3.371715 -0.488251 0.735592
C 2.843017 -2.203787 -1.051748
C 1.002951 0.377922 -0.694492
C -1.568821 -1.293472 -0.329641
C -2.286617 -1.555249 0.867135
C -2.175810 -0.478136 -1.319822
C 0.254934 1.873305 1.288630
C -3.576544 -1.015935 1.071801
C -3.465766 0.063494 -1.118286
C -4.169845 -0.201726 0.078770
C 0.811159 3.743658 0.377712
H 0.587592 -0.674725 1.157570
H 0.071942 -1.947339 -1.594600
H -0.078510 -2.839391 -0.056831
H 1.972108 -2.233432 2.352259
H 1.568757 -3.471685 1.121375
H 3.271187 -3.128858 1.513501
H 4.348689 -0.957522 0.952932
H 3.033830 0.023703 1.657110
H 3.538823 0.277457 -0.043859
H 3.870012 -2.592881 -0.920964
H 2.852896 -1.463866 -1.870084
H 2.203494 -3.049969 -1.361466
H -1.838372 -2.198269 1.636131
H -1.635701 -0.269906 -2.251455
H -0.145751 1.108631 1.946036
H -4.120188 -1.233704 1.998206
H -3.920106 0.689640 -1.894194
H -5.170288 0.216753 0.234942
H 0.964262 4.811137 0.242707


