MMs01772595 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 1.5000 0.0011 0.0000 C 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 4.5000 0.0032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7509 -1.2964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2509 -1.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0043 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0011 -1.4957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9989 1.5043 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 0.0054 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2491 1.3049 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8491 0.2657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4981 2.6034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2472 3.9030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4963 5.2015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2454 6.5011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7453 6.5022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4963 5.2037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7472 3.9041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7491 1.3060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4981 2.6056 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 0.0075 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0000 0.0086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7491 1.3082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2491 1.3092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0000 0.0107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2509 -1.2888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7509 -1.2899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0019 -2.5895 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 16.5000 0.0118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2491 1.3114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4981 2.6099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2472 3.9095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9981 2.6088 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7165 1.0006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8744 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5045 -1.1022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0009 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0009 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6483 2.3394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3483 2.3414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3517 -2.3352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6517 -2.3371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1007 -1.0334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5794 1.8314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5783 3.3741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2963 5.2007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6446 7.5399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3446 7.5418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6963 5.2045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0476 3.3847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1483 2.3470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8517 -2.3276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8411 2.1941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.9165 1.0014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.0480 -0.2408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2460 -1.6321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5342 -1.8082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1052 -2.1410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 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 42 1 0 0 0 0 4 5 1 0 0 0 0 4 43 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 7 45 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 18 19 2 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 52 1 0 0 0 0 20 53 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 26 35 1 0 0 0 0 27 28 2 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 31 32 2 0 0 0 0 31 38 1 0 0 0 0 32 33 1 0 0 0 0 32 36 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 36 37 1 0 0 0 0 36 56 1 0 0 0 0 36 57 1 0 0 0 0 37 38 1 0 0 0 0 37 58 1 0 0 0 0 37 59 1 0 0 0 0 38 60 1 0 0 0 0 38 61 1 0 0 0 0 M END