MMs00029583 MOE2007 2D CORINA 3.40 0006 02.08.2006 63 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 1.2951 0.7568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6059 -1.4863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9089 -2.2295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2040 -1.4727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8931 0.7704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5069 -2.2159 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8020 -1.4591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0409 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1050 -2.2022 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4000 -1.4454 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.4000 -2.6454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7735 -2.0483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7714 -0.9284 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.0820 -2.0875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0146 0.3667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5490 0.0472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6175 1.7402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1084 1.9048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7294 2.9491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3323 4.3226 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.4443 5.5315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2640 -1.0773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1392 0.1408 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8812 -2.4444 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.1381 -3.7474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1476 -4.8568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5147 -4.2395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3501 -2.7486 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 17.3893 -3.3486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4595 -1.7390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1399 -0.2735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.8885 -2.1951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.9979 -1.1855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6054 1.0361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0361 -0.6054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6054 -1.0361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5698 -2.0918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9152 -3.4295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2321 0.6327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8868 1.9704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5132 -3.4159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1113 -3.4022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1790 -3.0907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7480 -2.7486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3490 0.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4173 1.2399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9004 2.0815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7311 3.6149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4114 6.2419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7339 6.4986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4772 4.8211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1636 -3.0471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3398 -4.6433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1805 -5.5672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7531 -5.8929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8915 -5.3788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6872 -3.9839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.8056 -2.0731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.8855 -0.3779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1903 -0.2980 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 25 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 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 28 56 1 0 0 0 0 29 30 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 35 36 1 0 0 0 0 36 61 1 0 0 0 0 36 62 1 0 0 0 0 36 63 1 0 0 0 0 M END