MMs01053246 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 43 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 -0.7564 -1.2953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0128 -2.5980 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5872 -3.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4871 -2.6055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2436 -1.3101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2307 -3.9082 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7307 -3.9156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4871 -2.6203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9871 -2.6277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7307 -3.9304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9742 -5.2258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4743 -5.2183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7178 -6.5285 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.2306 -3.9379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7693 -3.8934 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2692 -3.8859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1449 -2.6681 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7917 -6.2382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5738 -3.1245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5812 -4.6245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1569 -5.0951 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8839 -5.3681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1792 -4.6117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1718 -3.1117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8691 -2.3681 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0363 -0.6051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6051 1.0363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0363 0.6051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6718 -0.5194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6795 -2.0621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6256 -4.9444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8922 -1.5781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5922 -1.5915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8691 -6.2546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2247 -5.1378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4306 -3.9438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2366 -2.7379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8898 -6.5681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2214 -5.2065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2081 -2.5066 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 5 1 0 0 0 0 3 16 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 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 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 26 2 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 M END