MMs02804981 MOE2007 2D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6848 -1.3346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1286 -2.5949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5562 -3.9295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0544 -4.0037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8678 -2.7433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 -1.4088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3178 -3.1274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4005 -4.6252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0017 -5.1667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6944 -6.3267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6609 -5.4385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4808 -2.1801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8827 -2.7137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0457 -1.7664 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4476 -2.2999 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9140 -3.7018 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9811 -0.8980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8495 -2.8335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0884 -4.3143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4903 -4.8479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6533 -3.9006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4144 -2.4197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0125 -1.8862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5774 -1.4724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3385 0.0084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0552 -4.4341 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0676 0.5478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5478 1.0676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0676 -0.5478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3271 -2.5355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0945 -4.9377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8337 -0.4005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0102 -6.4468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6691 -6.0892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3116 -4.4303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5729 -1.3955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0959 -1.1498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2676 -3.7440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7906 -3.4984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8546 -0.5817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1580 -5.0722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6814 -6.0326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8214 -0.7015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5232 0.1995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1474 1.1931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1539 -0.1827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 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 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 M END