MMs01317939 MOE2007 2D CORINA 3.40 0006 02.08.2006 47 49 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 0.7460 -1.3013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0079 -2.5981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7381 -3.8994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2381 -3.9040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9841 -5.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2302 -6.5020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7302 -6.4974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0158 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5158 -5.1916 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5113 -3.6916 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5204 -6.6915 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0158 -5.1870 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7619 -3.8857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0079 -2.5889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7539 -1.2876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2539 -1.2830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0079 -2.5798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2619 -3.8811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0158 -5.1778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2698 -6.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5158 -5.1733 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2698 -6.4700 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.8698 -5.4308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6638 -7.8422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7816 -8.8425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0784 -8.0885 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7620 -6.6223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7623 -5.5045 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9762 -7.8033 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0411 0.5968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5968 1.0411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0411 -0.5968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6676 -0.5328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6629 -2.0755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8413 -2.8666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1841 -5.2089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 -7.5348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6190 -6.2244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8079 -2.5926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1508 -0.2502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8508 -0.2420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2079 -2.5761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6228 -7.2454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9615 -8.8151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8923 -9.6481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4899 -9.8111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 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 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 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 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 28 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 M END