MMs01063748 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 47 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 1.3025 0.7439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9006 0.7318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9076 2.2318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6121 2.9878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3095 2.2439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 3.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.2101 2.9757 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5056 2.2196 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7496 0.9241 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2617 3.5151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8012 1.4636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0897 -0.7925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3992 1.4514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1037 2.2075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8279 1.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7039 0.6907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8166 -0.5187 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1821 -1.6617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1964 0.8405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8129 2.2079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9369 3.4256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4444 3.2757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5951 1.0420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 -0.5951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5951 -1.0420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5924 -1.2121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9370 0.1269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6177 4.1878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2157 4.1757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7521 -0.6316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0841 -1.9925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1093 3.4075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1071 -0.3562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3594 0.5447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8046 1.5323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6505 3.0672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0179 3.9466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6116 4.5806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2814 3.5715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5337 4.4724 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 33 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 18 2 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 26 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M END