B3MEA8 -OEChem-04012115323D 44 46 0 0 0 0 0 0 0999 V2000 2.8205 -2.1626 1.0204 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.8223 0.5018 -2.5654 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.5339 0.1323 1.5117 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1335 4.2472 -0.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8593 -1.2121 2.5267 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5093 0.2003 -0.6101 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3822 2.1404 0.4406 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0969 0.1800 0.9379 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3896 1.0122 -1.8247 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1363 -1.1900 -0.6607 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9572 2.4287 -1.4967 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2549 -1.7317 0.2747 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1523 0.7568 0.5191 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8924 3.0425 -0.4953 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7552 1.0690 1.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1687 0.6096 2.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6732 -1.9981 -1.6627 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6763 -0.9152 1.3346 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9103 -3.0817 0.2081 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0812 0.5497 1.0167 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3288 -3.3482 -1.7295 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4473 -3.8899 -0.7941 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4242 -0.6621 0.4173 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5860 1.7467 0.5085 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2718 -0.6772 -0.6903 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4336 1.7317 -0.5992 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7765 0.5197 -1.1986 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3729 1.0180 -2.3109 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6621 0.5568 -2.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9538 3.0390 -2.4055 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9492 2.4391 -1.0669 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1544 1.1354 2.7817 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 2.0617 1.4049 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5988 1.3185 2.9378 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1308 -0.3400 2.7598 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9436 2.5382 1.1889 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3682 -1.5962 -2.3954 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2217 0.3592 -0.0545 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2259 -3.5186 0.9306 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7483 -3.9781 -2.5085 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1795 -4.9412 -0.8456 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3281 2.6984 0.9657 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5403 -1.6216 -1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8194 2.6721 -0.9845 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 2 27 1 0 0 0 0 3 13 2 0 0 0 0 4 14 2 0 0 0 0 5 18 2 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 6 13 1 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 7 36 1 0 0 0 0 8 15 1 0 0 0 0 8 18 1 0 0 0 0 8 38 1 0 0 0 0 9 11 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 12 1 0 0 0 0 10 17 2 0 0 0 0 11 14 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 18 1 0 0 0 0 12 19 2 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 20 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 21 1 0 0 0 0 17 37 1 0 0 0 0 19 22 1 0 0 0 0 19 39 1 0 0 0 0 20 23 2 0 0 0 0 20 24 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 23 25 1 0 0 0 0 24 26 2 0 0 0 0 24 42 1 0 0 0 0 25 27 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 M END $$$$