BJ8KV2 -OEChem-04012113103D 26 27 0 1 0 0 0 0 0999 V2000 -2.8776 -1.1707 -0.7603 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7752 0.0340 1.0981 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3676 -0.2634 -0.4895 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2796 1.4566 -0.4843 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1767 -2.0407 0.1264 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6033 1.5019 0.3161 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0926 0.1785 -0.2921 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6298 -0.9287 0.0826 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0771 -0.9770 0.4036 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5173 0.5081 -0.8999 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5534 0.2825 1.1347 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3695 -1.6062 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2824 1.0886 0.2818 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5604 1.9365 -0.2951 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2578 -1.8348 1.0631 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1638 -0.1687 -1.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 1.2969 -1.5841 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5800 0.1062 1.4785 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9517 0.4697 2.0331 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2612 -2.2136 -0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 2.1203 -0.8634 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1313 1.6879 -0.0616 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6394 1.7231 0.8999 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6673 2.9059 -0.8107 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6032 -2.0097 -1.1688 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3676 -0.5085 0.5501 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 25 1 0 0 0 0 2 13 1 0 0 0 0 2 26 1 0 0 0 0 3 7 1 0 0 0 0 3 10 1 0 0 0 0 3 12 1 0 0 0 0 4 7 1 0 0 0 0 4 14 1 0 0 0 0 4 21 1 0 0 0 0 5 8 1 0 0 0 0 5 12 2 0 0 0 0 6 11 1 0 0 0 0 6 14 2 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 10 13 1 0 0 0 0 10 16 1 0 0 0 0 10 17 1 0 0 0 0 11 18 1 0 0 0 0 11 19 1 0 0 0 0 12 20 1 0 0 0 0 13 22 1 0 0 0 0 13 23 1 0 0 0 0 14 24 1 0 0 0 0 M END $$$$