MMs01248238 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 58 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 1.2518 -0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -2.3249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7649 -2.7241 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5913 -1.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6562 -0.2995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0554 1.1464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0027 2.2151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0898 -1.4051 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8973 -2.6692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2062 -4.0006 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3958 -2.6021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0868 -1.2707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2794 -0.0066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7779 0.0606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5853 -1.2035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3928 -2.4677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7017 -3.7990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8912 -2.4005 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.6987 -3.6646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1960 -3.7545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5733 -5.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3091 -6.0137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1506 -5.0609 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.2193 -7.5110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9695 -5.7543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1487 -2.5959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6285 -2.8417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1462 -3.2601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6611 1.0014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0014 0.6611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6611 -1.0014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6427 -0.3400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2405 -3.7920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5406 -2.9616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2907 0.6394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6334 1.0047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2681 -0.6525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8429 -0.4923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3307 1.1257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7128 0.6134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3242 -0.0323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6934 -0.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4441 -1.3354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0215 -7.4391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1475 -8.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4172 -7.5828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5310 -6.8714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0865 -6.1928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4080 -4.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6019 -2.3218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7921 -4.0082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8943 -4.1983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5071 1.5237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6218 -1.1915 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3840 -0.2647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8265 2.6804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 54 1 0 0 0 0 9 10 1 0 0 0 0 9 33 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 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 27 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 55 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 54 57 1 0 0 0 0 55 56 1 0 0 0 0 M END