MMs02487457 MOE2007 2D CORINA 3.40 0006 02.08.2006 79 82 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 0.7485 -1.2999 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4515 -1.2999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7454 -3.8980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 -2.5963 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2546 -3.8945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7545 -3.8927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5061 -5.1909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0061 -5.1891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7545 -3.8892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0030 -2.5911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5030 -2.5928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2485 -1.3017 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2515 1.2964 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0053 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9000 -1.0445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2485 -1.3052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7485 -1.3069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7485 -1.3104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9970 -2.6086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4970 -2.6068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2485 -1.3122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9970 -2.6121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2454 -3.9103 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4970 -2.6138 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2454 -3.9138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7454 -3.9155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4939 -5.2154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9939 -5.2172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7454 -3.9190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9970 -2.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4970 -2.6173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2515 1.2929 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5030 2.5928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0030 2.5946 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2545 3.8910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5061 5.1909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2576 6.4891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5091 7.7890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2606 9.0871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7606 9.0854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5091 7.7855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7576 6.4873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0399 0.5988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5988 1.0399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0399 -0.5988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1274 -4.3062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4643 -5.0760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9073 -6.2308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6073 -6.2277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9545 -3.8878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6018 -1.5511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9018 -1.5543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8473 -2.3416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1204 -1.7143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4555 -2.4872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9012 1.0312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6012 1.0280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5957 -3.6485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8957 -3.6454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1173 -4.3229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4524 -5.0958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8927 -6.2540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5927 -6.2571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.9454 -3.9204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5982 -1.5806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8982 -1.5774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4515 1.2915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5859 4.4206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5877 5.9633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3091 7.7904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6618 10.1271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3618 10.1239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7091 7.7841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3564 5.4474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 48 1 0 0 0 0 1 49 1 0 0 0 0 1 50 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 51 1 0 0 0 0 7 52 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 53 1 0 0 0 0 10 11 1 0 0 0 0 10 54 1 0 0 0 0 11 12 2 0 0 0 0 11 55 1 0 0 0 0 12 13 1 0 0 0 0 12 56 1 0 0 0 0 13 57 1 0 0 0 0 14 15 1 0 0 0 0 14 58 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 37 1 0 0 0 0 19 20 1 0 0 0 0 19 59 1 0 0 0 0 19 60 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 61 1 0 0 0 0 22 23 1 0 0 0 0 22 62 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 63 1 0 0 0 0 25 64 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 65 1 0 0 0 0 30 66 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 32 67 1 0 0 0 0 33 34 1 0 0 0 0 33 68 1 0 0 0 0 34 35 2 0 0 0 0 34 69 1 0 0 0 0 35 36 1 0 0 0 0 35 70 1 0 0 0 0 36 71 1 0 0 0 0 37 38 1 0 0 0 0 37 72 1 0 0 0 0 38 39 2 0 0 0 0 38 40 1 0 0 0 0 40 41 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 42 47 2 0 0 0 0 43 44 2 0 0 0 0 43 75 1 0 0 0 0 44 45 1 0 0 0 0 44 76 1 0 0 0 0 45 46 2 0 0 0 0 45 77 1 0 0 0 0 46 47 1 0 0 0 0 46 78 1 0 0 0 0 47 79 1 0 0 0 0 M END