MMs01487194 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 53 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 0.7473 -1.3006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2473 -1.3038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 -2.6044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2418 -3.9019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9890 -5.2025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4890 -5.2056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2418 -3.9082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4945 -2.6076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2472 -1.3101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7472 -1.3133 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0158 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.1000 -1.0551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7527 1.2848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5055 2.5822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2527 1.2880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7472 -1.3196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7527 1.2785 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2527 1.2753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1370 2.4870 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.5626 2.0204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8632 2.7677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1606 2.0149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1575 0.5149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8568 -0.2323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5594 0.5204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1318 0.0599 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0405 0.5978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5978 1.0405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0405 -0.5978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3812 -1.7087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9531 -2.4828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0418 -3.8993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3868 -6.2404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0868 -6.2461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4418 -3.9107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3450 -2.3538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1527 2.3240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5434 1.9801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1077 3.6202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4675 3.1844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2553 2.4880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0527 1.2905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2502 0.0880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1549 2.3190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8657 3.9677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2011 2.6127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1954 -0.0872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8543 -1.4323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 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 39 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 18 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 29 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 M END