MMs00453366 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 42 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 -0.7508 -1.2986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0016 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2508 -1.2977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 0.0018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 0.0027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2508 -1.2959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5016 -2.5954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0016 -2.5963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7508 -1.2950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5000 0.0045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7492 1.3031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0000 0.0054 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7492 1.3049 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.3492 0.2657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9984 2.6035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7477 3.9030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9969 5.2015 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.7461 6.5010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2492 1.3058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0000 0.0072 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0389 -0.6006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6006 1.0389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0389 0.6006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4492 -1.2986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0411 -3.1975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5978 -3.6377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -1.9987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3994 1.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0994 1.0423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1022 -3.6342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4022 -3.6359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3514 -2.3339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6006 -1.0335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0797 1.8316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0787 3.3743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6674 3.1322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6665 4.6749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7065 7.1004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3455 7.5406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7857 5.9017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9984 2.6053 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 M CHG 1 42 -1 M END