MMs02976123 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 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 -0.7485 1.2999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5029 2.5964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2515 1.2965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -0.0017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7515 1.2948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0051 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9916 -0.1636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3018 -1.6312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0019 -2.3797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8883 -1.3747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4612 -1.8366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1477 -3.3035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2613 -4.3085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6884 -3.8466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6714 -2.2428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8860 -1.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3120 -1.8277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7739 -3.2548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1951 -0.6152 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3148 0.5994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7799 2.0254 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.8877 0.1375 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.6951 -0.6169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4465 0.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6980 1.9812 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2544 3.8946 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.6012 -1.0385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9485 1.3013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5959 3.6380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0988 -1.0416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5444 2.4768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8796 1.7039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7956 0.7273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5704 -1.0327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 -3.6730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0104 -5.4820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5792 -4.6505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7955 -3.4364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4853 -1.7984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8222 -1.0286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9465 0.6796 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 24 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 25 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 26 27 2 0 0 0 0 26 43 1 0 0 0 0 M CHG 1 43 -1 M END