MMs00250772 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 58 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 0.7589 -1.2939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2588 -1.2836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0177 -2.5775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2766 -3.8816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7766 -3.8919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0178 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0355 -5.1755 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5354 -5.1653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2765 -3.8611 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2943 -6.4591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7943 -6.4489 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6842 -7.6563 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1076 -7.1831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0973 -5.6831 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6676 -5.2293 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3271 -8.0564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1805 -9.5492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4001 -10.4226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7662 -9.8031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9128 -8.3103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6932 -7.4370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8398 -5.9441 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.2059 -5.3247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4255 -6.1980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3525 -3.8319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7186 -3.2124 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8652 -1.7196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6457 -0.8462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7923 0.6466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1584 1.2661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3779 0.3927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2313 -1.1001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3050 2.7589 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0351 0.6071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6071 1.0351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0351 -0.6071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8517 -0.2403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2177 -2.5693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1838 -4.9352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1822 -2.6062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4426 -6.2188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1695 -6.8773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5108 -7.6394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0877 -10.0448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2828 -11.6169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7418 -10.5018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0057 -7.8148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8642 -5.2455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1561 -3.9238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0543 -2.6695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5528 -1.3418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8167 1.3453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4708 0.8883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2070 -1.7988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 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 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 42 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 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 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 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 31 32 2 0 0 0 0 31 34 1 0 0 0 0 32 33 1 0 0 0 0 32 54 1 0 0 0 0 33 55 1 0 0 0 0 M END