MMs02516125 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 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 -0.7544 1.2965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0088 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4912 2.6031 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8912 3.6424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2456 1.3066 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8456 0.2674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4912 2.6133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9912 2.6184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7368 3.9199 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7456 1.3219 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2456 1.3269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7544 -1.2863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5088 -2.5828 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7368 3.9098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4824 5.2113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7280 6.5078 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3245 7.5491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4824 5.2012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0176 5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7720 6.4926 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9720 6.4886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1262 -0.4142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2124 -1.1811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6710 0.5220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6762 2.0647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1378 3.0047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1956 3.7805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2956 -1.1774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 -0.4015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5934 3.2045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9267 2.8166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1491 0.2806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0332 2.5080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3718 1.7412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8737 -0.3838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2123 -1.1506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4218 -0.7530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4166 0.7897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3013 3.7065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6346 3.3185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 6.3823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6087 5.6154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7456 1.3117 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.9456 1.3117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 0.0355 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 10.5040 -1.1645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6999 0.0396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4959 1.2355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2544 -1.2914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6579 -2.3327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2368 3.9047 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8368 4.9439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9824 5.2164 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7632 3.8946 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 55 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 47 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 9 47 1 0 0 0 0 10 11 2 0 0 0 0 10 12 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 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 47 1 0 0 0 0 16 17 2 0 0 0 0 16 53 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 55 1 0 0 0 0 19 20 1 0 0 0 0 19 57 2 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 55 1 0 0 0 0 23 24 1 0 0 0 0 23 58 2 0 0 0 0 24 25 1 0 0 0 0 47 48 1 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 49 52 1 0 0 0 0 53 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 47 1 M CHG 1 49 1 M CHG 1 55 1 M END