MMs01356521 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 0.7440 -1.3025 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3440 -0.2633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2440 -1.3094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9880 -2.6119 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2559 1.2748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5120 2.5773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7559 1.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 -0.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7559 1.2540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0119 2.5565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5119 2.5634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7679 3.8659 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -2.5980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 -2.5911 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5051 -1.0911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5189 -4.0911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0120 -2.5842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7560 -1.2817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2559 -1.2748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0119 -2.5703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2680 -3.8728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7680 -3.8797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3110 -5.3085 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5286 -6.1845 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.7381 -5.2972 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 0.5952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5952 1.0420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 -0.5952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2861 -1.2016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6257 -0.4364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8951 -1.0711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5951 -1.0836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9559 1.2484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6167 3.5929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5832 -3.6400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1512 -0.2453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8511 -0.2328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2119 -2.5648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 17 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 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 15 2 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 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 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 29 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 M END