MMs01879288 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 52 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 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2559 -1.3568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2873 -2.2567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0136 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5588 0.5864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8931 -0.7703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8853 -2.2703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0271 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4912 -0.7839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -1.2407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8019 1.4593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1049 2.2025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4000 1.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4000 2.6458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0892 -0.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7029 2.1890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7107 3.6890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9980 1.4322 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3010 2.1754 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.3402 2.7754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3088 3.6754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5961 1.4187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5882 -0.0813 0.0000 O 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 0.0873 -2.2505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 -3.4567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4873 -2.2630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2023 1.1729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7151 -1.6991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2577 -1.7071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6191 1.2571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3974 2.5891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3383 3.1258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8810 3.1178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5750 0.1480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7967 -1.1840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3131 -1.7126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8558 -1.7207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9918 0.2322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5088 3.6692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3150 4.8754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1088 3.6817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6482 2.0810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8990 2.1619 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6059 1.4864 0.0000 N 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 17.9351 1.5565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 50 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 19 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 48 50 1 0 0 0 0 49 52 1 0 0 0 0 50 51 1 0 0 0 0 M END