MMs02449965 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 58 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 1.2990 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4952 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6913 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9904 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2894 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5885 0.0000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 16.6277 0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8875 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1865 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4952 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 -3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 0.0000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6373 0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8971 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8971 -2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7713 0.9193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7713 0.9193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5277 -1.6693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0704 -1.6693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8267 0.9193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3694 0.9193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9675 0.9193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4248 0.9193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4952 0.4500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0229 0.9193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5656 0.9193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1636 0.9193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6210 0.9193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9200 -1.6693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4627 -1.6693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2190 0.9193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7617 0.9193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5181 -1.6693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0608 -1.6693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5277 -1.6693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0704 -1.6693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8971 -0.7500 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.1258 -1.6693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6685 -1.6693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0933 -0.7500 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 8.3219 -1.6693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8646 -1.6693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8875 -2.2500 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 15.5885 1.5000 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 16.7885 1.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5885 2.7000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3885 1.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -3.0000 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.1962 0.0000 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.5981 1.5000 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.3981 1.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 2.7000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7981 1.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 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 43 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 6 46 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 7 46 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 50 1 0 0 0 0 13 14 2 0 0 0 0 13 49 1 0 0 0 0 15 16 2 0 0 0 0 15 54 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 56 1 0 0 0 0 20 21 2 0 0 0 0 20 55 1 0 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 50 53 1 0 0 0 0 56 57 1 0 0 0 0 56 58 1 0 0 0 0 56 59 1 0 0 0 0 M CHG 1 43 1 M CHG 1 46 1 M CHG 1 49 -1 M CHG 1 50 1 M CHG 1 54 -1 M CHG 1 55 -1 M CHG 1 56 1 M END