MMs00898498 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 65 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 -0.7505 -1.2987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7515 -3.8968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2515 -3.8962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0010 -2.5969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2505 -1.2982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5010 -2.5963 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2515 -3.8951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7515 -3.8945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5010 -2.5952 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7505 -1.2964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2505 -1.2970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0010 -2.5946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7515 -3.8934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7505 -1.2953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0000 0.0035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7495 1.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2495 1.3034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0000 0.0046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2505 -1.2947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5000 0.0052 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -14.2505 -1.2936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7423 -1.4498 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -16.0548 -2.9169 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -17.0940 -2.3169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.1699 -3.9201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.5603 -5.2907 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -17.8880 -5.9886 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -16.5543 -6.7907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.0685 -5.1345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7560 -3.6674 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -13.7168 -4.2674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6409 -2.6641 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -11.9990 2.6027 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.0020 -5.1950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -0.6004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6004 1.0390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 0.6004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -2.5985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1519 -4.9363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8501 -0.2587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6878 -4.1005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4603 -5.0768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5436 -5.0764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8793 -4.3045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8780 -0.8856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5417 -0.1148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1227 -0.8870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4584 -0.1152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8000 0.0030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1491 2.3418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8509 -2.3337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0996 1.0447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.8748 -2.9491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.2093 -4.5197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0689 -6.3345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8751 -5.2604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5215 -4.8948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6024 -6.2340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 -5.7954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 49 1 0 0 0 0 13 50 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 51 1 0 0 0 0 18 19 1 0 0 0 0 18 52 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 54 1 0 0 0 0 23 24 2 0 0 0 0 23 34 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 32 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 29 2 0 0 0 0 28 30 2 0 0 0 0 28 31 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 36 59 1 0 0 0 0 36 60 1 0 0 0 0 36 61 1 0 0 0 0 M END