MMs03278936 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 42 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 0.7583 -1.2942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0167 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -3.8922 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3750 -2.8530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0333 -5.1960 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7917 -6.4902 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1022 -7.6494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2049 -7.6114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5791 -7.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4318 -5.5173 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8733 -7.7684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2475 -7.1671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2440 -8.2882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4857 -9.5824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0205 -9.2612 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2916 -6.4806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0500 -7.7748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5499 -7.7652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2916 -6.4614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5332 -5.1672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0333 -5.1768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 -3.8826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3082 -9.0594 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0354 0.6067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6067 1.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0354 -0.6067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6726 -0.5170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6825 -2.0596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9075 -1.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8976 -3.3753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7705 -8.3105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7982 -8.6544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5045 -5.9949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4382 -8.1705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9667 -10.6818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4566 -8.8179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4915 -6.4537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1266 -4.1241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 23 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 17 1 0 0 0 0 9 10 1 0 0 0 0 9 32 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 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 M END