MMs01137366 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 50 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 1.2968 -0.7539 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2922 -2.2539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8948 -0.7618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2007 1.4842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9039 2.2381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6026 1.4921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3059 2.2460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0046 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3104 3.7460 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5266 4.6240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0674 6.0520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5675 6.0566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0996 4.6314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5020 2.2302 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7988 1.4763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1001 2.2223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1046 3.7223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4059 4.4684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7027 3.7144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6981 2.2145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3968 1.4684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0040 4.4605 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.6032 1.0374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0374 0.6032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6032 -1.0374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0922 -2.2503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2885 -3.4539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4922 -2.2576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8912 -1.9618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2335 -0.6190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9076 3.4381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1235 3.5830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6244 5.1088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2420 6.2979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9456 7.2458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6965 7.2496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6056 6.3096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5036 3.5940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9952 5.1228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5056 3.4302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0672 4.3255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4096 5.6684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7355 1.6113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3932 0.2684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 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 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 17 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 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 16 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 M END