MMs00792750 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 1.5000 -0.0092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2579 1.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5159 2.5889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2738 3.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7738 3.8741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5158 2.5705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7579 1.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0275 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7578 1.2577 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7419 -1.3403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9840 -2.6347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7260 -3.9383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2260 -3.9475 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9839 -2.6531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2419 -1.3495 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4839 -2.6623 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.2259 -3.9659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7259 -3.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4839 -2.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9838 -2.6898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7259 -3.9934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9679 -5.2878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4680 -5.2786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4840 -2.6256 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0073 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0073 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3159 2.5962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6802 4.9262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3801 4.9096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7158 2.5632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8936 -1.0631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1197 -4.9739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0958 -4.3694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4271 -5.1489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8902 -1.6377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5902 -1.6543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9258 -4.0007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5616 -6.3307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8616 -6.3142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 M END