MMs02491593 MOE2007 2D CORINA 3.40 0006 02.08.2006 64 69 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 1.5000 0.0011 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2491 1.3006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7491 1.3017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4982 2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7473 3.8997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2473 3.8987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4982 2.5991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0018 2.5981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4964 5.1972 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0036 5.1962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9982 2.6023 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3982 3.6415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7491 1.3038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7509 -1.2943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2509 -1.2932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 0.0063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2491 1.3048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9982 2.6044 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5982 1.5652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2473 3.9029 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.4064 4.2135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7473 3.9019 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3473 2.8626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2827 5.3281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8558 5.7906 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4956 6.2106 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7098 5.3298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4982 2.6054 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0989 1.5666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2473 3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4963 5.2035 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7473 3.9061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4963 5.2056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9963 5.2067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7473 3.9082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9982 2.6086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4982 2.6076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2473 3.9092 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7154 -2.7195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5025 -3.6020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2884 -2.7212 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0008 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0008 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3498 0.2629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3465 4.9394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6026 3.6369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0045 6.3962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2036 5.1953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0028 3.9962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8000 0.0034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2000 0.0072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8064 4.8425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3091 6.3695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8956 6.2444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5956 6.2463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5989 1.5698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8989 1.5679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8480 2.8704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8465 4.9489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3061 -4.4932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7002 -4.4944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 1 46 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 47 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 2 0 0 0 0 6 48 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 9 49 1 0 0 0 0 10 11 1 0 0 0 0 11 50 1 0 0 0 0 11 51 1 0 0 0 0 11 52 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 53 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 54 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 30 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 29 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 35 1 0 0 0 0 34 39 2 0 0 0 0 35 36 2 0 0 0 0 35 57 1 0 0 0 0 36 37 1 0 0 0 0 36 58 1 0 0 0 0 37 38 2 0 0 0 0 37 40 1 0 0 0 0 38 39 1 0 0 0 0 38 59 1 0 0 0 0 39 60 1 0 0 0 0 40 61 1 0 0 0 0 40 62 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 42 63 1 0 0 0 0 42 64 1 0 0 0 0 M END