%chk=000225287.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225287

0 1
O -0.305019 -1.845830 -0.384844
O -4.314494 -0.377643 -0.904499
N 0.676392 0.279490 -0.131220
N -2.661650 -0.133466 0.642912
N 0.233105 1.601856 -0.048394
C -1.680537 0.240886 -0.369252
C -1.076069 1.638458 -0.161063
C -0.407265 -0.652836 -0.303001
C 2.085479 0.004752 -0.010465
C -1.895349 2.863524 -0.130813
C -3.973861 -0.479816 0.258158
C 2.531125 -1.326930 -0.088904
C 3.000591 1.057749 0.180060
C 3.896965 -1.593766 0.025523
C 4.359947 0.765320 0.291426
C -4.852239 -0.936521 1.382637
C 4.813860 -0.556047 0.215722
H -2.137304 0.161146 -1.403066
H -2.332114 -0.214329 1.598169
H -1.291874 3.765821 0.064138
H -2.671283 2.806098 0.649372
H -2.414986 3.018166 -1.091683
H 1.826990 -2.149627 -0.239679
H 2.654650 2.090562 0.238226
H 4.246044 -2.624668 -0.035713
H 5.072497 1.576794 0.438213
H -5.877257 -1.109943 1.010150
H -4.509024 -1.888378 1.814392
H -4.926412 -0.203680 2.196512
H 5.875591 -0.774041 0.303381


%chk=000225287-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225287

0 1
O -0.290515 -1.972091 0.013059
O -4.324515 0.017347 -0.931476
N 0.705192 0.208455 -0.068591
N -2.694985 -0.231664 0.697199
N 0.245255 1.580781 -0.076989
C -1.630117 0.145234 -0.223536
C -1.073262 1.559759 -0.121897
C -0.353379 -0.717103 -0.079929
C 2.113924 -0.025940 0.006606
C -1.900528 2.804798 -0.127039
C -4.009760 -0.324878 0.248222
C 2.623402 -1.350841 0.062692
C 2.999391 1.083116 0.019052
C 4.018798 -1.549491 0.131483
C 4.389793 0.861458 0.089053
C -5.017791 -0.859485 1.254674
C 4.910097 -0.452544 0.145887
H -2.057065 0.014925 -1.244178
H -2.442713 -0.577400 1.624601
H -1.258480 3.699330 -0.095518
H -2.583642 2.820396 0.743086
H -2.539952 2.842200 -1.028565
H 1.936797 -2.199813 0.054061
H 2.589292 2.094017 -0.026951
H 4.407372 -2.573066 0.173872
H 5.068562 1.721556 0.097604
H -5.875939 -0.169320 1.311046
H -5.401715 -1.829933 0.894119
H -4.598462 -0.998738 2.265565
H 5.991444 -0.617965 0.199183


