%chk=000219970.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219970

0 1
O 2.135732 1.952139 1.295822
N 4.271037 0.704752 -0.265466
C 0.533417 0.431807 0.444810
C 2.009815 0.639802 0.712072
C 0.021157 -0.918362 0.268279
C -1.356762 -1.104063 -0.006501
C 2.818360 0.578381 -0.606902
C -2.243627 0.049945 -0.093030
C -1.710684 1.344953 0.101709
C -0.300320 1.503884 0.368332
C 0.863126 -2.059319 0.366152
C -1.850448 -2.424244 -0.188886
C -3.632508 -0.081646 -0.363225
C -2.564384 2.478567 0.029537
C 0.358993 -3.332530 0.187317
C -1.012703 -3.517616 -0.096564
C 5.031129 1.311036 -1.398727
C 4.854428 -0.620219 0.100655
C -4.448558 1.030459 -0.432175
C -3.910905 2.323617 -0.233043
H 2.391909 -0.084017 1.469679
H 2.505072 1.433596 -1.246704
H 2.564492 -0.339773 -1.175337
H 0.090346 2.516313 0.521001
H 1.920412 -1.927884 0.593241
H -2.911340 -2.566483 -0.403240
H -4.051540 -1.077327 -0.515428
H -2.140470 3.469851 0.186669
H 1.009603 -4.201820 0.265419
H -1.398770 -4.525551 -0.237365
H 3.088017 2.213332 1.296641
H 5.005189 0.735269 -2.335250
H 6.084623 1.433511 -1.098583
H 4.634771 2.319915 -1.599141
H 4.839877 -1.370921 -0.703007
H 4.312786 -1.029053 0.968399
H 5.900566 -0.474140 0.416199
H -5.512066 0.922979 -0.638840
H -4.568873 3.189060 -0.288318


%chk=000219970-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000219970

0 1
O 2.326471 1.748658 1.271462
N 4.235023 0.848944 -0.344377
C 0.542675 0.269249 0.463970
C 2.035868 0.425662 0.725913
C -0.044845 -1.047319 0.238962
C -1.458487 -1.161047 -0.048539
C 2.876183 0.293292 -0.590881
C -2.289877 0.045249 -0.103876
C -1.671841 1.322903 0.145776
C -0.259706 1.395309 0.428471
C 0.740564 -2.243952 0.304382
C -2.005396 -2.463432 -0.265891
C -3.690546 0.019621 -0.387476
C -2.463963 2.512805 0.111088
C 0.174363 -3.506247 0.091040
C -1.213002 -3.616474 -0.201783
C 4.879688 1.400323 -1.557341
C 5.120804 -0.084345 0.391253
C -4.449751 1.197841 -0.420173
C -3.834241 2.457762 -0.167790
H 2.364580 -0.347725 1.455559
H 2.390580 0.914778 -1.364236
H 2.896436 -0.757792 -0.954455
H 0.201919 2.365659 0.636912
H 1.807214 -2.178465 0.541116
H -3.071574 -2.573860 -0.484882
H -4.194080 -0.931805 -0.584126
H -1.975408 3.474084 0.308932
H 0.795599 -4.406580 0.152886
H -1.662096 -4.601158 -0.371479
H 3.258006 1.929921 0.914758
H 5.109459 0.621042 -2.321973
H 5.827093 1.895297 -1.278556
H 4.219346 2.154916 -2.017999
H 5.368018 -0.996343 -0.202156
H 4.637628 -0.400801 1.331207
H 6.063332 0.427981 0.652070
H -5.522132 1.149457 -0.639679
H -4.433009 3.374793 -0.191888


