MMs03753311 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 40 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 -1.4808 0.2392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1659 -1.0952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1085 -2.1591 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2301 -1.4822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6481 -1.3253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5885 -0.1567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0467 1.2420 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0708 -0.3869 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5042 -1.5058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0112 0.7817 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.3218 -0.3774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4934 0.5516 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.1828 1.7107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0353 -0.8471 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.5175 -1.0772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4579 0.0914 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -12.0579 1.1306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9161 1.4901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4338 1.7202 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -12.9402 -0.1387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0593 -2.4759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1189 -3.6445 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.4693 2.1805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4098 3.3491 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8511 0.8459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0223 1.3101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2977 -2.0303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2609 -2.4612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6994 -1.9039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0933 1.7227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8915 2.6899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5530 -1.2745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9915 -0.7173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8806 1.0299 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.4471 2.1489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0664 0.8458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5416 -2.7060 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9871 2.4106 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 21 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 38 2 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 M CHG 1 23 -1 M CHG 1 39 -1 M END