BWG3K1 -OEChem-04022106472D 50 54 0 1 0 0 0 0 0999 V2000 10.8160 -2.1390 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 1.0782 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 1.4849 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 0.0781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8590 -1.7266 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4426 -0.9219 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -1.9218 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -0.4219 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 1.5782 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 0.0836 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 1.5782 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.9128 -0.4219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -1.4218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 2.5782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 0.0781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1697 -2.6771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 1.0782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8590 -0.1171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 3.0782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 3.0782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1482 -2.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5018 -3.4214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 4.0782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 4.0782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -1.4218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 4.5782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4589 -3.8338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8125 -4.3719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 1.0782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7910 -4.5782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -0.1243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.7417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0933 -1.0378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 0.9581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0516 0.4722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5837 2.7682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7778 2.7682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8952 -3.2936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 2.1982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5837 4.3882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7778 4.3882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6438 -1.7318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 5.1982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0655 -3.9617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3984 -4.8334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9836 -5.1675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 0.8065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5269 -0.7857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8411 -1.6042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6597 -1.2900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 2 11 1 0 0 0 0 2 15 1 0 0 0 0 3 29 1 0 0 0 0 3 32 1 0 0 0 0 4 17 2 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 5 16 1 0 0 0 0 6 18 2 0 0 0 0 7 13 1 0 0 0 0 7 25 2 0 0 0 0 8 15 2 0 0 0 0 8 25 1 0 0 0 0 9 17 1 0 0 0 0 9 29 1 0 0 0 0 9 39 1 0 0 0 0 10 29 2 0 0 0 0 10 31 1 0 0 0 0 11 14 1 0 0 0 0 11 17 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 12 18 1 0 0 0 0 14 19 2 0 0 0 0 14 20 1 0 0 0 0 16 21 1 0 0 0 0 16 22 2 0 0 0 0 18 35 1 0 0 0 0 19 23 1 0 0 0 0 19 36 1 0 0 0 0 20 24 2 0 0 0 0 20 37 1 0 0 0 0 21 27 2 0 0 0 0 22 28 1 0 0 0 0 22 38 1 0 0 0 0 23 26 2 0 0 0 0 23 40 1 0 0 0 0 24 26 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 27 30 1 0 0 0 0 27 44 1 0 0 0 0 28 30 2 0 0 0 0 28 45 1 0 0 0 0 30 46 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 32 47 1 0 0 0 0 33 48 1 0 0 0 0 33 49 1 0 0 0 0 33 50 1 0 0 0 0 M END $$$$