%chk=000231716.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231716

0 1
O 3.231224 0.545545 0.000659
N -2.177651 0.146059 -0.000301
N 1.297718 -0.718458 -0.000457
N 1.278297 1.714283 0.000137
N -0.972446 -1.791903 -0.000226
C -0.827957 0.514555 -0.000434
C -0.202430 1.858729 -0.000453
C -0.105001 -0.700125 -0.000415
C 2.008235 0.512073 -0.000597
C -2.225734 -1.253771 -0.000332
C -3.312138 1.070465 -0.000171
C 2.029865 -2.005310 0.000009
H -0.510291 2.442218 -0.903102
H -0.510901 2.442494 0.901799
H 1.822963 2.575065 0.000574
H -3.139846 -1.827549 -0.000203
H -3.292990 1.718714 0.896457
H -3.292924 1.719024 -0.896568
H -4.270899 0.521790 -0.000306
H 3.120465 -1.819024 -0.000081
H 1.764857 -2.595425 -0.894855
H 1.764885 -2.594850 0.895265


%chk=000231716-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231716

0 1
O 3.289443 0.535007 0.002531
N -2.173394 0.153038 -0.000467
N 1.298321 -0.713168 -0.001494
N 1.271256 1.682146 -0.000665
N -0.950493 -1.772095 0.000590
C -0.822180 0.532580 -0.000791
C -0.196071 1.893567 -0.000419
C -0.104796 -0.661988 -0.000970
C 2.019787 0.492837 -0.003591
C -2.195192 -1.241865 -0.001167
C -3.333388 1.050192 0.000108
C 2.001383 -2.004479 0.000314
H -0.494252 2.488478 -0.893480
H -0.494338 2.487824 0.893053
H 1.870073 2.508488 0.001255
H -3.120593 -1.812630 -0.001197
H -3.338365 1.691918 0.899202
H -3.338481 1.692739 -0.898392
H -4.254099 0.445350 -0.000124
H 3.080828 -1.790558 -0.000693
H 1.730428 -2.592806 -0.893690
H 1.731423 -2.589975 0.896485


