%chk=000224504.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224504

0 1
O -2.754587 -0.897785 1.831387
N 1.171724 -0.164120 0.873894
N -3.267896 0.550080 -1.527053
C 2.336274 -0.929100 1.431683
C 1.052736 1.190372 1.512403
C -0.102971 -0.936949 1.043719
C 2.678029 -2.140744 0.547719
C 2.198766 2.115781 1.069062
C 3.193059 -1.720354 -0.835195
C 2.150746 2.418524 -0.434434
C -1.180996 -0.395577 0.142087
C -2.527003 -0.402827 0.565187
C 3.542832 -2.927271 -1.702021
C 3.258013 3.381410 -0.855684
C -0.914702 0.097016 -1.139266
C -3.555446 0.075139 -0.286732
C -1.974025 0.557867 -1.936257
C -4.987879 0.078985 0.136285
H 3.211785 -0.238703 1.460872
H 2.166508 -1.266605 2.476809
H 1.024904 1.138875 2.622238
H 0.081911 1.633789 1.193957
H -0.463762 -0.964512 2.099293
H 0.087154 -2.000888 0.751868
H 1.786165 -2.789524 0.430261
H 3.437742 -2.758367 1.063638
H 3.176748 1.660025 1.324546
H 2.140426 3.057747 1.647412
H 4.077645 -1.064116 -0.725291
H 2.422271 -1.099624 -1.337468
H 2.236273 1.467302 -0.999688
H 1.161969 2.837812 -0.703176
H 3.910705 -2.613068 -2.685217
H 4.322196 -3.544819 -1.242358
H 2.670977 -3.569555 -1.869999
H 3.214345 3.585833 -1.931321
H 3.178188 4.342785 -0.336357
H 4.251709 2.973123 -0.640633
H 0.116124 0.126439 -1.499842
H -1.795675 0.950311 -2.943426
H -5.634084 0.486242 -0.663119
H -5.353742 -0.935272 0.344251
H -5.150947 0.710957 1.019149
H -3.713210 -0.853633 2.070318


%chk=000224504-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000224504

0 1
O -2.895643 -1.082691 1.804341
N 1.170772 -0.103757 0.975622
N -3.324352 0.544090 -1.521759
C 2.297278 -0.947173 1.462098
C 1.182214 1.274083 1.548978
C -0.142813 -0.755959 1.201458
C 2.623561 -2.140886 0.535401
C 2.332943 2.172372 1.043775
C 3.119559 -1.717269 -0.864650
C 2.321820 2.415235 -0.481880
C -1.232238 -0.278063 0.252116
C -2.600518 -0.462212 0.572680
C 3.423316 -2.921768 -1.780614
C 3.466835 3.341603 -0.943402
C -0.948351 0.327355 -0.993320
C -3.623740 -0.041107 -0.323726
C -2.007393 0.717286 -1.840371
C -5.088966 -0.231451 0.018577
H 3.195432 -0.306531 1.524695
H 2.100041 -1.321258 2.499604
H 1.208556 1.235097 2.669222
H 0.221891 1.749341 1.271527
H -0.498044 -0.629322 2.252395
H -0.022915 -1.847334 1.060627
H 1.736131 -2.796846 0.423453
H 3.399547 -2.759301 1.032995
H 3.315596 1.751033 1.338943
H 2.252088 3.145908 1.570592
H 4.030509 -1.093219 -0.752875
H 2.352005 -1.069498 -1.329197
H 2.391175 1.439416 -0.998998
H 1.345712 2.855736 -0.771055
H 3.781577 -2.594286 -2.774059
H 4.201001 -3.574454 -1.339527
H 2.517780 -3.538632 -1.935937
H 3.438271 3.506227 -2.036383
H 3.403248 4.331154 -0.451555
H 4.454161 2.907681 -0.694170
H 0.097058 0.483961 -1.273365
H -1.810335 1.186375 -2.810359
H -5.692116 0.174284 -0.807762
H -5.356945 -1.300549 0.140814
H -5.380296 0.305084 0.944782
H -3.874409 -1.126756 1.943771


