MMs01255638 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 0 0 0 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 0.0068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2559 -1.2888 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5117 -2.5913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0118 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7558 -1.2821 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7626 -2.7820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7491 0.2179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2558 -1.2753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 0.0339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2558 -1.2617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5117 -2.5641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0117 -2.5709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2676 -3.8733 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.2440 1.3363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4882 2.6320 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7440 1.3431 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4881 2.6455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7323 3.9412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4764 5.2436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9764 5.2504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7322 3.9547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9881 2.6523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2322 3.9615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7322 3.9683 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0054 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0027 -0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2863 1.1876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6257 0.4223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6412 -2.9966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3087 -3.7740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -1.9981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1882 -2.6035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0172 -3.7980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3952 1.0636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4558 -1.2563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1164 -3.6006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3487 0.3066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5323 3.9358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8717 6.2801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5717 6.2923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5928 1.6158 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 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 3 0 0 0 0 M END