DR2262 -OEChem-05042004012D 40 42 0 0 0 0 0 0 0999 V2000 3.4022 1.2879 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.9323 -0.7363 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4022 -0.7604 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.5304 0.7637 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4323 -1.6023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4323 -1.6023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9056 -1.6245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8989 0.1037 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9323 1.2637 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7984 -0.2363 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5381 -1.2637 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0663 -0.2363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0663 0.7637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1724 -0.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2663 -0.2571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7984 0.7637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1724 1.2984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2663 0.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6644 1.2637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3964 1.2637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2625 0.7637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2625 -0.2363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1285 1.2637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1285 -0.7363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9945 0.7637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9945 -0.2363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1796 -1.3909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9323 1.8837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1796 1.9184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0629 1.7387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2659 1.7387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7950 1.7387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9979 1.7387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.9558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5405 -1.8837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7255 -0.5463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1285 1.8837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1285 -1.3563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5315 1.0737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5315 -0.5463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 5 2 0 0 0 0 2 6 2 0 0 0 0 2 10 1 0 0 0 0 2 12 1 0 0 0 0 3 7 2 0 0 0 0 3 8 2 0 0 0 0 3 11 1 0 0 0 0 3 15 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 9 13 1 0 0 0 0 9 16 1 0 0 0 0 9 28 1 0 0 0 0 10 16 2 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 13 17 2 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 18 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 22 36 1 0 0 0 0 23 25 2 0 0 0 0 23 37 1 0 0 0 0 24 26 2 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 26 40 1 0 0 0 0 M END $$$$