MMs01830809 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.3009 -0.7467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3047 -2.2467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6057 -2.9934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9028 -2.2401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8990 -0.7401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0132 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4971 -0.7335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5009 -2.2335 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0951 -0.7269 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0989 -2.2269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3999 -2.9736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6970 -2.2203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9979 -2.9670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6932 -0.7203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 0.0264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3885 1.5263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6856 2.2796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9865 1.5329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2837 2.2862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4037 -4.4736 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 7.8018 -2.9802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5974 1.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0407 0.5974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5974 -1.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 -2.8493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6087 -4.1934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9436 -2.8375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 1.2066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1931 1.2132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0205 0.9371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5632 0.9410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3477 2.1237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6826 3.4796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0311 -0.5644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8863 1.2485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3214 2.8889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6810 3.3239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1992 -1.9425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7641 -3.5829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4044 -4.0179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 2 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M END