MMs02489191 MOE2007 2D CORINA 3.40 0006 02.08.2006 67 67 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 -0.7501 1.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0003 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4997 2.5982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2499 1.2993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2501 -1.2988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5003 -2.5979 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7003 -2.5979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2504 -3.8969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5006 -5.1960 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7504 -3.8967 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5006 -5.1957 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1006 -4.1564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7507 -6.4948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5009 -7.7937 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9010 -8.8330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0006 -5.1955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7504 -3.8964 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7507 -6.4944 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2507 -6.4943 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6507 -7.5335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0006 -5.1952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5006 -5.1950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1005 -4.1557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0009 -7.7932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2510 -9.0924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0003 -2.5981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7496 -3.8972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0006 -5.1962 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2496 -3.8974 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4496 -3.8974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9994 -5.1965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2493 -6.4954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8492 -7.5347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9997 -2.5984 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4997 -2.5986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2496 -3.8977 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2499 -1.2996 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8499 -0.2604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7499 -1.2998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5000 -0.0008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7000 -0.0010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7504 3.8970 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1505 4.9363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5999 -1.0393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9501 1.2988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0996 3.6375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4499 1.2994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1693 -0.5273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1695 -2.0700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3503 -2.8574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8314 -5.7235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8316 -7.2662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1508 -7.5337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8729 -4.7849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2088 -4.0134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5998 -1.5589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9188 -4.4252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9186 -5.9679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3998 -1.5591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5413 -2.4815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8774 -1.7103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5009 -7.7931 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0005 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3000 -0.0004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1001 1.0387 0.0000 H 0 0 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 46 1 0 0 0 0 2 3 2 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 44 1 0 0 0 0 4 5 2 0 0 0 0 4 48 1 0 0 0 0 5 6 1 0 0 0 0 5 49 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 50 1 0 0 0 0 7 51 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 28 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 52 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 18 1 0 0 0 0 15 16 1 0 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 16 17 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 26 1 0 0 0 0 23 24 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 24 25 1 0 0 0 0 26 27 2 0 0 0 0 26 64 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 36 1 0 0 0 0 33 34 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 34 35 1 0 0 0 0 36 37 1 0 0 0 0 36 61 1 0 0 0 0 37 38 2 0 0 0 0 37 39 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 39 65 1 0 0 0 0 41 42 1 0 0 0 0 41 62 1 0 0 0 0 41 63 1 0 0 0 0 42 43 1 0 0 0 0 44 45 1 0 0 0 0 65 66 1 0 0 0 0 65 67 1 0 0 0 0 M CHG 1 64 -1 M END