MMs03922626 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 44 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 0.0072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2437 1.3098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4875 2.6053 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8875 3.6445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0125 2.5980 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2125 2.5980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7562 1.2954 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3562 0.2562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2562 1.2882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7687 3.8935 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9687 3.8877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2312 3.9079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7312 3.9151 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9312 3.9151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4875 2.6197 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0875 1.5804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9874 2.6269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7437 1.3315 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2437 1.3387 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.2509 -0.1613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2364 2.8387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7437 1.3171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3487 0.2807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4750 5.2177 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0750 6.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7187 6.5131 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1187 7.5524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4625 7.8158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7062 9.1112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9749 5.2249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5699 6.2670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2562 -1.2882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5125 -2.5908 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5950 -1.0421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8512 0.2461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7734 3.8076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1131 3.0427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6625 7.8215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7436 1.3459 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.2187 6.5059 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6238 5.4638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6138 7.5423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7562 -1.2810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 8 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 13 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 25 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 23 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 40 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 31 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 41 1 0 0 0 0 29 30 2 0 0 0 0 29 39 1 0 0 0 0 31 32 1 0 0 0 0 33 34 1 0 0 0 0 33 44 2 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 M CHG 1 34 -1 M CHG 1 40 -1 M END