MMs03708643 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 43 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 0.0102 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3144 -2.2411 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3246 -3.7410 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3638 -3.1410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0307 -4.4999 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0410 -5.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2529 -6.7587 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3451 -6.7410 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 -5.9821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9431 -6.7232 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6287 -4.4822 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9226 -3.7233 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2332 -4.8824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2971 -4.3240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2931 -3.2025 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1417 -2.3540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5343 -1.9086 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6858 -1.0601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0692 -2.2305 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1350 -0.5341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2451 0.6733 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7860 -3.3491 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4054 -4.7152 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 9.0249 -6.0813 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4692 -4.5101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7281 -3.2060 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0082 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1729 -1.2997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3925 -2.6304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3533 -7.9409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7042 -5.3673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2727 -5.0227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1344 -1.1984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9627 0.3347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7257 1.7729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2191 -6.1986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4774 -3.3102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6692 -4.5183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 -5.7101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 33 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 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 23 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 24 25 2 0 0 0 0 25 39 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 M CHG 1 24 1 M END