MMs03095452 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 -0.7437 -1.3026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2437 -1.3098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2562 1.2882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7562 1.2954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0125 2.5836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2687 3.8863 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0216 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2437 -1.3243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4875 -2.6197 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7437 -1.3315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4999 -0.0361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9999 -0.0433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7436 -1.3459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9874 -2.6413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4874 -2.6341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2436 -1.3531 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.9874 -2.6557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2311 -3.9512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.4874 -2.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2436 -1.3675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7436 -1.3748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4873 -2.6774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7311 -3.9728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2311 -3.9656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4749 -5.2610 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1388 -2.3390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8387 -2.3519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1612 2.3375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1049 1.0147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9049 1.0060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6049 0.9931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5824 -3.6834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8824 -3.6704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8486 -0.3168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6486 -0.3254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3486 -0.3384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.6873 -2.6832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3261 -5.0149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5124 2.5764 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 42 2 0 0 0 0 9 10 1 0 0 0 0 9 32 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 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 M CHG 1 8 -1 M END