DR0229 -OEChem-05042004262D 44 45 0 1 0 0 0 0 0999 V2000 7.1962 -1.8170 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0084 -1.6217 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.5920 -0.8170 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.6962 -2.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6962 -2.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.3170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5920 0.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5920 -1.8170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.3170 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 7.1962 1.1830 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5920 -0.8170 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.1830 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3301 -0.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0084 -0.0123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5920 -0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 0.4930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1181 0.2656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7196 -0.4246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 -2.2919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 -2.2919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.4930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2010 0.5771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 -0.8420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 -0.8420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7196 1.7907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1181 1.1004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 -2.2919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 -2.2919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9501 2.6830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.3030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7101 2.6830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9020 -0.2801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9020 -1.3539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -1.2800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.1270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -2.3539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 9 1 0 0 0 0 1 15 1 0 0 0 0 2 15 1 0 0 0 0 2 19 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 19 1 0 0 0 0 6 21 1 0 0 0 0 6 23 1 0 0 0 0 9 13 1 0 0 0 0 9 16 1 0 0 0 0 12 10 1 6 0 0 0 10 20 1 0 0 0 0 10 29 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 16 18 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 17 19 2 0 0 0 0 17 30 1 0 0 0 0 18 21 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 20 22 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 M END $$$$