MMs02464228 MOE2007 2D CORINA 3.40 0006 02.08.2006 71 71 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 0.0009 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9000 1.0401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2508 -1.2977 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0508 -1.2977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7508 -1.2968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0026 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5015 -2.5954 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0015 -2.5946 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.2015 -2.5946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7523 -3.8932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0030 -5.1926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7538 -6.4912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0046 -7.7907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5046 -7.7916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7538 -6.4930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5030 -5.1935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7553 -9.0911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3559 -10.1299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7508 -1.2951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0035 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2508 -1.2942 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 0.0053 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6000 -1.0340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2492 1.3039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9985 2.6034 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3979 3.6422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 0.0062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2492 1.3056 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2508 -1.2924 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7508 -1.2916 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.1508 -2.3308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5015 -2.5902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0015 -2.5893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7523 -3.8879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2523 -3.8870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5000 0.0079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7492 1.3065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2492 1.3004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6486 2.3392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0007 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0007 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9021 -3.6350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6711 -3.1213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6720 -4.6640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9538 -6.4905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6052 -8.8296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5538 -6.4937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9024 -4.1546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8514 -2.3331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3304 0.5320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3295 2.0747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6514 -2.3320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3741 -3.0012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7106 -3.7718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7925 -1.4076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1289 -2.1782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6249 -4.2990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9614 -5.0695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0432 -2.7053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3797 -3.4759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0030 -5.1856 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 16.9642 -5.7862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6037 -6.2245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0419 -4.5850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0000 0.0088 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5015 -2.5972 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4619 -1.9978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9021 -3.6368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5411 -3.1966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 39 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 68 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 20 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 48 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 28 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 37 1 0 0 0 0 33 34 1 0 0 0 0 33 55 1 0 0 0 0 33 56 1 0 0 0 0 34 35 1 0 0 0 0 34 57 1 0 0 0 0 34 58 1 0 0 0 0 35 36 1 0 0 0 0 35 59 1 0 0 0 0 35 60 1 0 0 0 0 36 61 1 0 0 0 0 36 62 1 0 0 0 0 36 63 1 0 0 0 0 37 38 2 0 0 0 0 37 67 1 0 0 0 0 39 40 1 0 0 0 0 63 64 1 0 0 0 0 63 65 1 0 0 0 0 63 66 1 0 0 0 0 68 69 1 0 0 0 0 68 70 1 0 0 0 0 68 71 1 0 0 0 0 M CHG 1 63 1 M CHG 1 67 -1 M CHG 1 68 1 M END