MMs02234953 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 60 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 -1.2983 0.7513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 0.0026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5996 -1.4974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3013 -2.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0015 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2968 -2.2513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2953 -3.7513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5966 -1.5026 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8949 -2.2539 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8949 -1.0539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8934 -3.7539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1917 -4.5052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1902 -6.0052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8904 -6.7539 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1947 -1.5052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4929 -2.2565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8964 0.7539 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1961 0.0052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4944 0.7565 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.4944 -0.4435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4929 2.2565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7912 3.0078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0910 2.2591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0925 0.7591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3923 0.0104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3938 -1.4896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6906 0.7616 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.7304 0.1627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6891 2.2616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3893 3.0103 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.9874 3.0129 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7942 0.0078 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8949 2.2539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5951 3.0026 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0398 0.5990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2971 1.9513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6394 -2.0964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3025 -3.4487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5978 -0.3026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7118 -3.5443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4818 -4.8811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6032 -3.3780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3732 -4.7147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4257 -0.9148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9684 -0.9133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3114 2.0469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0814 3.3837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0190 3.9262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5617 3.9278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9862 4.2129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0272 2.4140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7954 -1.1922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9335 2.8549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4885 -6.7565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0052 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2360 0.5938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4873 -7.9565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 2 0 0 0 0 14 55 1 0 0 0 0 16 17 2 0 0 0 0 16 56 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 33 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 31 1 0 0 0 0 25 26 1 0 0 0 0 25 33 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 33 53 1 0 0 0 0 34 35 2 0 0 0 0 34 54 1 0 0 0 0 55 58 1 0 0 0 0 56 57 1 0 0 0 0 M END