B4MJU2 -OEChem-04022101293D 28 30 0 0 0 0 0 0 0999 V2000 -5.0078 0.0150 -0.2627 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5318 -0.3018 0.2123 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2298 0.7925 -0.3189 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5293 -1.6028 0.6237 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8719 -0.2319 -0.0142 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5662 -0.3161 0.0705 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5789 0.6766 -0.2256 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1769 -0.4901 0.2323 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6128 1.5921 -0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5764 -1.1215 -0.8254 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5575 0.7405 0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1905 -1.4654 0.5228 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8079 0.9617 -0.2494 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6518 -0.0661 -0.1805 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9663 -1.0387 -0.9086 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9473 0.8234 0.6308 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6451 1.0328 0.5081 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5063 2.5986 -0.9088 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2218 -0.9848 0.4929 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 -1.8833 -1.4057 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 1.4403 1.3541 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6265 -2.3397 0.8342 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8308 1.2998 -0.3378 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5097 -1.7334 -1.5433 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4164 1.6017 1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7213 0.9521 0.3232 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3393 2.0335 0.1843 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4928 0.8792 1.5818 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 17 1 0 0 0 0 2 8 1 0 0 0 0 2 13 1 0 0 0 0 2 19 1 0 0 0 0 3 6 1 0 0 0 0 3 7 2 0 0 0 0 4 8 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 5 11 1 0 0 0 0 6 12 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 13 2 0 0 0 0 9 18 1 0 0 0 0 10 15 1 0 0 0 0 10 20 1 0 0 0 0 11 16 2 0 0 0 0 11 21 1 0 0 0 0 12 22 1 0 0 0 0 13 23 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 24 1 0 0 0 0 16 25 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 M END $$$$