MMs00473613 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 50 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 0.0064 -1.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0064 -2.7000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3087 -2.2444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3151 -3.7444 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6045 -1.4889 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8939 0.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2025 -1.4777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9067 -2.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4919 0.7778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0334 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2894 -2.2555 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5916 -1.5111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 -0.0111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8874 -2.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0378 -3.7591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5037 -4.0773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2481 -5.3795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7481 -5.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5037 -4.0901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7593 -2.7879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2593 -2.7815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2604 -1.6625 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5785 -0.1966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4925 -6.6882 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 0.0026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0051 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0076 -0.0956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1828 1.1370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1186 1.6826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6613 1.6892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2353 -0.5777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3834 -1.2643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6178 -2.6036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1393 -3.1558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6820 -3.1492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2842 -3.4555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1426 -4.5582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6437 -6.4162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7037 -4.0953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3637 -1.7512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4058 0.0579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8330 0.9761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7512 -0.4511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4855 2.2778 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 31 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 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 35 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 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 48 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 18 41 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 42 1 0 0 0 0 21 22 1 0 0 0 0 21 27 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 44 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 M CHG 1 48 -1 M END