MMs01466087 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 53 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 1.5000 -0.0016 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9000 1.0376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2514 1.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7514 1.2950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7486 -1.3031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2486 -1.3015 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4972 -2.5997 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 -1.8483 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7954 -3.3511 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7458 -3.8979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7542 -3.8963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5056 -5.1945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -6.4944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -6.4960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4944 -5.1978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9944 -5.1994 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7430 -6.4992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0056 -5.1929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7542 -3.8931 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7570 -6.4912 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2570 -6.4895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0084 -7.7878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5084 -7.7862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2570 -6.4863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5056 -5.1881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0056 -5.1897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7570 -6.4847 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0013 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0013 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1242 1.7083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 2.4782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5443 2.4770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8795 1.7042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4201 0.7655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4184 -0.7772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8758 -1.7147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5390 -2.4846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3531 -2.8564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3581 -7.5330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3419 -7.5359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7031 -7.0981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3419 -7.5391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7829 -5.9003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1581 -7.5310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4095 -8.8276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1095 -8.8247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1045 -4.1482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4045 -4.1511 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 8 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 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 41 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 M END