DR0554 -OEChem-05042004222D 42 43 0 1 0 0 0 0 0999 V2000 3.5344 0.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.1920 3.9753 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 6.0631 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 6.0631 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 5.5631 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1350 6.0631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 5.5631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 4.5631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 7.0631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 7.5631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 8.5631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 3.9753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 7.5631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6270 7.0284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 9.0631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 8.5631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6270 9.0977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5010 3.0242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5010 3.0242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 5.5631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5331 7.5422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5331 8.5839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5380 5.2531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5335 6.5380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7365 6.5380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8705 5.0881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6675 5.0881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3997 4.1669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 6.6831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 7.2531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6199 6.4084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 9.6831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 8.8731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6199 9.7177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8655 2.5226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1366 2.5226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2269 6.1000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 5.2531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8469 5.0261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0688 7.2302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0688 8.8959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5344 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 42 1 0 0 0 0 2 8 1 0 0 0 0 2 19 1 0 0 0 0 5 3 1 6 0 0 0 3 9 1 0 0 0 0 4 7 1 0 0 0 0 4 20 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 12 2 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 15 1 0 0 0 0 11 17 2 0 0 0 0 12 18 1 0 0 0 0 12 28 1 0 0 0 0 13 16 1 0 0 0 0 13 30 1 0 0 0 0 14 21 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 33 1 0 0 0 0 17 22 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 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 M END $$$$