%chk=000234506.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234506

0 1
O -2.687533 0.705437 -0.895675
N -0.649563 0.235226 -0.005601
N 1.017214 1.792369 0.285518
N 0.788420 -1.796418 -0.340912
N 3.180953 -1.275549 -0.208912
N 3.984760 0.934826 0.222308
C -2.001826 -0.337658 -0.161993
C -2.669148 -0.585552 1.199604
C -4.151683 -0.916025 0.996176
C -4.836732 0.185095 0.177563
C -4.085746 0.423426 -1.132875
C 0.560397 -0.459387 -0.116747
C -0.305654 1.609456 0.228186
C 1.589842 0.524479 0.078004
C 2.946182 0.067448 0.025518
C 2.110033 -2.114778 -0.373166
C 5.398347 0.526478 0.131221
H -1.951520 -1.259272 -0.795463
H -2.565108 0.306946 1.848422
H -2.149341 -1.408238 1.728756
H -4.649774 -1.026564 1.978637
H -4.260439 -1.895481 0.490337
H -5.889772 -0.081669 -0.029457
H -4.867109 1.123973 0.766172
H -4.155647 -0.438225 -1.819795
H -4.408208 1.345957 -1.650719
H -1.076174 2.364771 0.319837
H 2.360624 -3.174154 -0.554396
H 3.783381 1.924687 0.352676
H 5.807271 0.737375 -0.872980
H 5.516868 -0.561747 0.311510
H 5.994985 1.064170 0.886044


%chk=000234506-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000234506

0 1
O -2.675838 0.692284 -0.945653
N -0.618485 0.316264 0.113736
N 1.092960 1.795961 0.494467
N 0.714118 -1.703837 -0.471738
N 3.134425 -1.259434 -0.378843
N 4.021547 0.875581 0.207940
C -1.968394 -0.221343 -0.031919
C -2.717035 -0.343079 1.312516
C -4.162559 -0.838859 1.065622
C -4.880854 0.079526 0.048259
C -4.041178 0.200685 -1.236428
C 0.568085 -0.395076 -0.109306
C -0.242254 1.622136 0.467994
C 1.609549 0.534746 0.138826
C 2.947145 0.053603 -0.010408
C 2.032839 -2.045469 -0.585165
C 5.418700 0.455978 0.072220
H -1.858539 -1.223473 -0.500287
H -2.735464 0.648996 1.803538
H -2.164383 -1.037896 1.971507
H -4.718977 -0.876982 2.019581
H -4.132883 -1.875133 0.670083
H -5.882138 -0.319954 -0.203384
H -5.022506 1.086450 0.485788
H -3.971532 -0.785746 -1.746351
H -4.456686 0.939073 -1.940999
H -0.977462 2.399228 0.657612
H 2.238538 -3.079631 -0.877888
H 3.801364 1.837337 0.474301
H 5.940332 1.049258 -0.702232
H 5.422919 -0.603849 -0.224895
H 5.962949 0.564057 1.029306


