MMs01043810 MOE2007 2D CORINA 3.40 0006 02.08.2006 45 47 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 0.7454 1.3017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0092 2.5981 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6092 1.5588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5092 2.5928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2638 3.8891 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2546 1.2911 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7546 1.2858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5092 2.5822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0091 2.5768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7546 1.2752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 -0.0212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7454 -1.3123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7637 3.8732 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.7362 3.8997 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1213 5.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1804 6.0133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8737 7.4816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6175 7.6437 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2324 6.2755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5341 5.5301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2274 4.0618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2351 2.9506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7766 1.5224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7012 3.2677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7088 2.1565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0413 0.5963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5963 -1.0413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0413 -0.5963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6674 0.5336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6619 2.0763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6509 0.2540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9128 3.6235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9545 1.2709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5963 -1.0626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7825 -1.9160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1417 -2.3494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7083 -0.7086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2749 5.5213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6798 8.3705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6286 6.0221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8199 1.3504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5149 1.2676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5977 2.9626 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 16 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 17 21 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 21 22 1 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 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 M END