MMs03572065 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.2959 0.7554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8940 0.7662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8877 2.2662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5856 3.0108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2897 2.2554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0125 3.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4920 0.7770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8004 -1.4676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0901 0.7878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6881 0.7986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0540 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.9965 -1.4460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0027 -2.9460 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2862 0.8094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4368 2.3018 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.5417 3.1010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9027 2.6197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6473 3.9219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1473 3.9281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9027 2.6322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1581 1.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6581 1.3238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6590 0.2049 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6819 2.2985 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6043 1.0367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0367 -0.6043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6043 -1.0367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 -1.1892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9245 2.8705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5806 4.2108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7169 1.6930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2595 1.6994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6247 -0.8793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1674 -0.8729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0430 4.9586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7430 4.9698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.1027 2.6372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7624 0.2933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0295 -0.5460 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 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 29 2 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 16 44 1 0 0 0 0 17 18 3 0 0 0 0 19 20 1 0 0 0 0 19 28 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 M END