MMs01548559 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 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 1.5000 0.0005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2504 -1.2983 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8504 -2.3375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5009 -2.5976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2513 -3.8964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5017 -5.1957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0017 -5.1962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7487 -3.8974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0009 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7479 -6.4954 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.7504 -1.2978 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7496 1.3003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7496 1.3013 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2496 1.3017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 0.0030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 0.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2496 1.3027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7496 1.3032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4991 2.6025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7487 3.9013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4983 5.2006 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2487 3.9008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4991 2.6015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9991 2.6010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0004 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0004 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2912 1.1822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6275 0.4113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4513 -3.8960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1020 -6.2347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9487 -3.8978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5995 -1.5590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3508 -2.3368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7920 -1.1799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1278 -0.4081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4003 -1.0365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1003 -1.0356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3499 0.2642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6991 2.6029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3988 3.6401 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 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 12 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 27 2 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 26 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 44 1 0 0 0 0 M END