MMs01252697 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 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 1.1615 0.9492 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2451 -0.0880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 -1.5743 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5664 0.6222 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2993 2.0982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3365 3.1818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8130 2.3003 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9175 -0.0294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1573 0.8150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2030 2.3143 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6430 2.7342 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4873 1.4944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5691 0.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9866 1.4487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6968 0.1275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1961 0.0818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9852 1.3575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2751 2.6787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7758 2.7244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0657 4.0456 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.2219 1.5291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4113 3.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7947 3.5970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9886 2.6889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7991 1.2009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4158 0.6210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3720 3.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5614 4.7568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5659 2.3608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7553 3.8488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7593 0.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4646 -0.3797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7593 -0.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2449 3.3573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2165 -1.0033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7550 -0.8888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0654 -0.8930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7642 -0.9752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1847 1.3209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9065 3.6992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5438 3.7435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9463 4.7874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7543 0.4745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 0.0258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3710 4.9084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7130 5.9472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7518 4.6053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2923 3.3159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5210 1.6343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8394 1.4057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2914 4.9555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8620 4.3127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2193 2.7421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 22 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 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 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 31 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 M END