MMs01727774 MOE2007 2D CORINA 3.40 0006 02.08.2006 93 94 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 -1.3020 0.7448 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3412 1.3448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3079 2.2448 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0119 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2901 2.2551 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2961 0.7551 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3353 1.3551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0103 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0178 4.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 -0.0103 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5588 -0.6103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6261 -1.5082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9440 -2.2245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3541 -2.2991 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4708 -3.8249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8725 -4.4005 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0316 -4.0900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0755 -5.8685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8524 -6.7368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3676 -6.5305 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6738 -6.1193 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3632 -7.2784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5978 -5.1471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9936 -5.6963 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5830 -3.6658 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8371 -2.8769 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.7978 -2.2769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1539 -1.5701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6536 -1.5446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7863 -0.2511 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5302 0.4749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5976 1.9734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9291 2.6642 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.9965 4.1627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7325 4.9703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3280 4.8535 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1861 -0.1482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0546 -1.6425 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9436 0.7194 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0548 -3.7528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4222 -3.1362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.3963 -3.8369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4681 -7.3918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7633 -8.7158 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3987 -9.7338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6868 -5.3193 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2983 -4.7519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0954 -3.2657 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8874 -5.6707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2759 -5.1033 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2759 -6.3033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4616 -6.0221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8501 -5.4547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0358 -6.3735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7677 -0.9223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -0.9162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3495 2.8407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6349 0.6144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 5.1041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0594 5.0958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2837 -1.7566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2745 -3.7302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1922 -4.9921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2666 -7.7262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5297 -3.0909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7348 0.4839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5864 2.6195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9403 2.0181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3819 6.0523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3392 4.2074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0111 1.9175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1955 -4.5905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7305 -4.7444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3602 -6.5892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4134 -8.1310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7680 -5.9138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0012 -6.4772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5273 -6.6858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5730 -6.8286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1015 -7.0372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2102 -4.4396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7387 -4.6482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1472 -7.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6757 -7.3886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4243 -5.8061 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 7.8783 -6.9169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5352 -5.3521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9704 -4.6952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4788 -3.6171 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6678 -3.7794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6411 -2.4281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2898 -3.4548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 56 1 0 0 0 0 1 57 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 4 5 1 0 0 0 0 4 58 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 59 1 0 0 0 0 10 60 1 0 0 0 0 10 61 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 40 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 62 1 0 0 0 0 16 17 1 0 0 0 0 16 63 1 0 0 0 0 16 64 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 47 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 65 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 44 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 66 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 41 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 67 1 0 0 0 0 32 33 2 0 0 0 0 32 38 1 0 0 0 0 33 34 1 0 0 0 0 33 68 1 0 0 0 0 34 35 1 0 0 0 0 34 69 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 37 70 1 0 0 0 0 37 71 1 0 0 0 0 38 39 2 0 0 0 0 38 40 1 0 0 0 0 40 72 1 0 0 0 0 41 42 1 0 0 0 0 41 73 1 0 0 0 0 41 74 1 0 0 0 0 42 43 1 0 0 0 0 44 45 1 0 0 0 0 44 75 1 0 0 0 0 44 76 1 0 0 0 0 45 46 1 0 0 0 0 47 48 1 0 0 0 0 47 77 1 0 0 0 0 48 49 2 0 0 0 0 48 50 1 0 0 0 0 50 51 1 0 0 0 0 50 78 1 0 0 0 0 50 79 1 0 0 0 0 51 52 1 0 0 0 0 51 53 1 0 0 0 0 51 90 1 0 0 0 0 53 54 1 0 0 0 0 53 80 1 0 0 0 0 53 81 1 0 0 0 0 54 55 1 0 0 0 0 54 82 1 0 0 0 0 54 83 1 0 0 0 0 55 84 1 0 0 0 0 55 85 1 0 0 0 0 55 86 1 0 0 0 0 86 87 1 0 0 0 0 86 88 1 0 0 0 0 86 89 1 0 0 0 0 90 91 1 0 0 0 0 90 92 1 0 0 0 0 90 93 1 0 0 0 0 M CHG 1 86 1 M CHG 1 90 1 M END