MMs03953461 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 58 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 3 0 0 0 0 0 0 0 0 0 1.3454 -2.3409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2453 -1.3071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0107 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2453 -1.3178 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2546 1.2803 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0546 1.2803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5093 2.5820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2639 3.8783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7639 3.8730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5092 2.5713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7546 1.2749 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.9546 1.2749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0321 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0093 -2.5981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5093 -2.5927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2546 -1.2910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2639 -3.8891 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0639 -3.8891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5185 -5.1908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2732 -6.4871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7732 -6.4818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5185 -5.1800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7639 -3.8837 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9639 -3.8837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5093 -2.5820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7546 -1.2856 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0414 0.5963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5963 1.0414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0414 -0.5963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0327 -2.4881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3715 -1.7215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4037 1.0307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5872 1.8139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5928 3.3566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1377 4.2928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4765 5.0594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5597 5.0555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8930 4.2794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4312 3.3393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4257 1.7966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 -3.6394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5965 -4.4227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6021 -5.9654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 -6.9016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4858 -7.6681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5690 -7.6643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9023 -6.8881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4405 -5.9481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4350 -4.4054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7453 -1.3231 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0092 -2.5766 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6055 -1.5353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3416 -2.3645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 18 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 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 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 54 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 27 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 29 55 1 0 0 0 0 54 57 1 0 0 0 0 55 56 1 0 0 0 0 M END