BTD09A -OEChem-04012113272D 55 58 0 1 0 0 0 0 0999 V2000 2.8757 4.0701 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.2685 2.6152 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.2685 2.6191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2685 2.6114 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8602 -1.9782 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7818 -3.4986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5137 -3.4786 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2723 1.6152 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.6304 0.0806 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3743 1.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1744 1.0944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3904 0.0460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1664 0.0528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2564 -0.4540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2646 3.6152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5243 -0.4540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5243 -1.4540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2564 -1.4540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3904 -1.9540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1287 4.1186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3967 4.1119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6304 -1.9887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7243 -0.4332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7243 -1.4748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8602 0.0701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6420 -2.9886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 1.0701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.5668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0038 2.5734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7359 2.5668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8718 3.0701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1563 1.6679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7652 0.9720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7844 0.9836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3880 1.6765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3709 -0.5325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7780 0.1542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7289 3.3032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7933 -1.7640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3904 -2.5740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4408 3.5828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6645 4.4306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8167 4.6543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7046 4.6500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8586 4.4198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0888 3.5738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2501 0.1801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6459 -0.5117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3221 -1.6702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 1.2655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2678 1.2547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7889 -4.1186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4681 2.8855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2740 2.8747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 8 1 0 0 0 0 2 15 1 0 0 0 0 5 24 1 0 0 0 0 5 50 1 0 0 0 0 6 26 1 0 0 0 0 6 53 1 0 0 0 0 7 26 2 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 9 16 2 0 0 0 0 9 23 1 0 0 0 0 10 12 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 13 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 14 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 18 1 0 0 0 0 15 20 1 0 0 0 0 15 21 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 17 19 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 24 1 0 0 0 0 22 26 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 27 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 28 51 1 0 0 0 0 29 31 2 0 0 0 0 29 52 1 0 0 0 0 30 32 2 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 M END $$$$