MMs02556181 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 55 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 1.4248 -0.4689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3997 -1.6089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8744 -1.3347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3743 0.0796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8738 0.0412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9057 1.1299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3644 0.7806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7913 -0.6574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7594 -1.7461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3007 -1.3968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0650 -2.2471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1863 -3.1840 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 9.3963 1.8693 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8551 1.5200 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.5058 0.0612 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2044 2.9787 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3138 1.1707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7407 -0.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1995 -0.6166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2314 0.4721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6901 0.1228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7220 1.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2951 2.6494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8364 2.9987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8045 1.9101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3457 2.2593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3994 1.2196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8993 2.6339 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9247 0.9454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2977 -1.4586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1876 0.5699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1399 0.3751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3751 -1.1399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8829 -1.9138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8206 -2.7327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5642 2.2803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9583 -0.9368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0548 3.0196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9152 -1.1382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5410 -1.7670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0316 -1.0276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8890 0.9320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1206 3.5204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4949 4.1491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0042 3.4097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3329 1.0440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9135 2.1453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4941 -0.5569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6041 -2.2503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6935 -1.9095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 27 2 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 27 46 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 47 1 0 0 0 0 30 48 1 0 0 0 0 31 49 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 M END