MMs01158879 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 52 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 -0.0010 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3006 -2.2491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2975 -2.2509 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2583 -2.8509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2965 -3.7509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5971 -1.5018 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8956 -2.2526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8946 -3.7526 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1951 -1.5035 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3466 -0.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3529 -0.0118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8204 0.2990 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.5695 -1.0005 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.1695 0.0387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5650 -2.1146 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8759 -3.5820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7605 -4.5849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3022 -4.0465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4176 -3.0435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8438 -3.5080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1547 -4.9755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0393 -5.9784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6131 -5.5139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4977 -6.5169 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.0612 -1.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0656 -0.0443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4355 -0.6553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2777 -2.1470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8103 -2.4579 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.0008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0008 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0402 -0.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8999 -1.2095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3402 -2.8484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7013 -3.2888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0965 -3.7501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2957 -4.9509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4965 -3.7517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5979 -0.3018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1529 -0.0110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2283 1.1817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1689 -1.8696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7362 -2.7057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2957 -5.3471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2880 -7.1524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8169 1.1297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4752 -0.0560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1689 -2.9506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 10 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 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 26 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 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 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 M END