MMs01551942 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 40 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 0.7472 -1.3007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0056 -2.5981 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6056 -3.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5056 -2.5948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2528 -1.2942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7528 -1.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5056 -2.5883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7584 -3.8890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2584 -3.8922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0056 -2.5851 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.7416 -3.8987 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2416 -3.9020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9944 -2.6046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9888 -5.2026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4888 -5.2059 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2360 -6.5065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6229 -7.8755 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7354 -8.8816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0361 -8.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7274 -6.6665 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7335 -5.5540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0405 0.5978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5978 1.0405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0405 -0.5978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6681 -0.5313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6648 -2.0740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6506 -0.2562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3506 -0.2504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3607 -4.9269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6607 -4.9328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1393 -4.9367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8602 -5.6106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1946 -6.3848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6074 -10.0748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1313 -8.6249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6235 -6.3589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5384 -4.6640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8435 -4.7491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 12 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 M END