%chk=000231199.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231199

0 1
O 1.250494 -0.477498 1.554319
N 2.274126 -1.093718 -0.424788
N 3.393583 -1.655604 0.245026
C 0.105262 0.038357 -0.536225
C -1.202169 -0.668735 -0.237778
C -0.047203 1.532197 -0.327543
C 1.244232 -0.523221 0.343543
C -2.030374 -1.042186 -1.307988
C -0.245222 2.356298 -1.446611
C -1.605850 -0.936462 1.077887
C -0.014520 2.099129 0.954326
C -3.248463 -1.680760 -1.059881
C -0.404947 3.734714 -1.280538
C -2.823637 -1.576684 1.319463
C -0.172956 3.477776 1.113789
C -3.647487 -1.950247 0.252890
C -0.368413 4.298607 -0.001528
C 3.503018 -3.112500 -0.087680
C 4.640994 -0.929620 -0.157818
H 0.352192 -0.135498 -1.618527
H -1.734602 -0.830528 -2.332760
H -0.283700 1.928317 -2.445501
H -0.959965 -0.651119 1.915068
H 0.144994 1.459872 1.829166
H 2.236501 -1.113476 -1.444621
H -3.888599 -1.967094 -1.892362
H -0.560089 4.370046 -2.150636
H -3.130304 -1.783760 2.343845
H -0.144390 3.912147 2.112183
H -4.595971 -2.447461 0.443983
H -0.492961 5.371764 0.125703
H 3.713419 -3.345973 -1.139761
H 2.567204 -3.619497 0.206063
H 4.305569 -3.540331 0.536125
H 4.924846 -1.021341 -1.214515
H 5.467793 -1.311113 0.464317
H 4.527696 0.141404 0.085466


%chk=000231199-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000231199

0 1
O 1.321151 -0.465118 1.619959
N 2.278470 -1.085749 -0.427653
N 3.433886 -1.675727 0.133399
C 0.111524 0.062908 -0.481449
C -1.201242 -0.693517 -0.200928
C -0.030179 1.583808 -0.283515
C 1.280710 -0.510917 0.360876
C -1.996508 -1.119004 -1.295407
C -0.158475 2.415784 -1.424798
C -1.656690 -0.953539 1.117332
C -0.067865 2.178055 1.004159
C -3.224408 -1.786004 -1.084014
C -0.328838 3.812187 -1.289169
C -2.881368 -1.624795 1.328486
C -0.233182 3.574160 1.139617
C -3.672231 -2.041074 0.232078
C -0.368295 4.397012 -0.003016
C 3.468165 -3.139438 -0.066934
C 4.667200 -0.956256 -0.245779
H 0.344604 -0.095597 -1.552703
H -1.657324 -0.922349 -2.320862
H -0.131923 1.968698 -2.427161
H -1.037909 -0.652694 1.968476
H 0.059240 1.547644 1.889466
H 2.162430 -1.088672 -1.453855
H -3.826814 -2.105314 -1.942211
H -0.429166 4.439276 -2.182473
H -3.218747 -1.823487 2.352208
H -0.256233 4.020604 2.140352
H -4.623382 -2.558583 0.400872
H -0.500071 5.479366 0.107380
H 3.574859 -3.439512 -1.139290
H 2.542072 -3.580086 0.335172
H 4.323346 -3.553033 0.495040
H 4.902031 -1.020521 -1.337716
H 5.514311 -1.386726 0.315729
H 4.566952 0.104412 0.034432


