MMs01156978 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 56 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 1.3070 2.2454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8997 0.7362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0184 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4978 0.7270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5031 2.2270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0959 0.7178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3869 -1.5368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0852 -2.2822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7889 -1.5276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6833 -2.2914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9850 -1.5460 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.2814 -2.3006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5830 -1.5552 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.8794 -2.3098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8741 -3.8098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5724 -4.5552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2760 -3.8006 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.5671 -6.0552 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 18.1811 -1.5644 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.5493 -2.1794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5569 -1.0682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8115 0.2335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3432 -0.0732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5963 1.0414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0414 -0.5963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5963 -1.0414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5070 2.2411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3113 3.4454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 2.2496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3661 -0.9312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8235 -0.9257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1317 1.6582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6743 1.6527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1919 -1.2184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1001 1.9178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4336 0.5595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0810 -3.4822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7475 -2.1239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9087 -3.2079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4514 -3.2134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9112 -4.4135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9456 -3.2165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5176 -2.8882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.3567 -1.9629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.5302 -0.3663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.9095 0.7176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.4447 1.3760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1432 -0.0690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2220 1.1206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3017 0.7454 0.0000 N 0 0 0 0 0 0 0 0 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 1 54 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 54 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 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 52 1 0 0 0 0 27 53 1 0 0 0 0 M END