%chk=000184576.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184576

0 1
O 0.724257 4.151156 0.299329
O -0.907726 2.919517 -0.392715
O -5.176501 -1.089066 -0.008435
O -4.530692 0.973799 0.086946
N 0.247434 3.079678 -0.035697
N -4.316108 -0.222984 0.031593
C 1.743620 -0.420775 -0.009482
C 0.715987 0.598623 -0.017085
C 1.180453 -1.747643 -0.005498
C -0.568680 -0.135396 -0.007352
C -0.283856 -1.556875 -0.002514
C 3.116406 -0.172124 -0.004548
C 1.147640 1.906356 -0.017444
C 2.019256 -2.827974 -0.002621
C -1.878458 0.302538 0.000249
C -1.300511 -2.494058 0.006816
C 3.512588 1.205497 0.001367
C 3.973386 -1.323237 -0.001889
C 2.560752 2.193524 -0.001014
C 3.435144 -2.589600 -0.001682
C -2.904233 -0.673029 0.015486
C -2.632728 -2.043037 0.015099
H 1.651147 -3.852093 -0.000680
H -2.145987 1.372843 -0.008640
H -1.084840 -3.561981 0.007929
H 4.574365 1.452300 0.010407
H 5.052887 -1.172855 0.000171
H 2.856283 3.251297 0.014425
H 4.092846 -3.461704 0.000002
H -3.460832 -2.763398 0.021480


%chk=000184576-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000184576

0 1
O 0.884465 4.302343 0.058983
O -0.953836 2.977264 -0.066699
O -5.269651 -1.201914 0.007938
O -4.618177 0.983790 0.002680
N 0.323012 3.140979 -0.002741
N -4.362429 -0.280480 0.004254
C 1.737056 -0.402926 -0.003790
C 0.710705 0.613565 -0.005727
C 1.171549 -1.716221 -0.001972
C -0.592003 -0.125178 -0.004471
C -0.290364 -1.543064 -0.001204
C 3.136974 -0.169317 -0.002239
C 1.196954 1.939287 -0.002656
C 2.018870 -2.828280 -0.000903
C -1.936921 0.290855 -0.003927
C -1.311348 -2.510130 0.002733
C 3.562381 1.200733 -0.000324
C 3.992548 -1.323562 -0.001332
C 2.608240 2.217150 0.001016
C 3.437933 -2.612675 -0.000903
C -2.939697 -0.708983 0.002197
C -2.659068 -2.093058 0.004673
H 1.627638 -3.851072 0.000185
H -2.221295 1.341077 -0.009926
H -1.070426 -3.577652 0.004655
H 4.628921 1.449167 0.000669
H 5.080249 -1.192557 -0.000469
H 2.905238 3.268623 0.005475
H 4.103159 -3.482747 0.000024
H -3.487377 -2.805715 0.007804


