MMs00144883 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.1294 -0.9871 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -0.5025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6784 -1.4896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0980 -1.0051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3882 0.4666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2587 1.4537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8392 0.9691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8077 0.9512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9372 -0.0359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3567 0.4486 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.0462 -0.7105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4862 -0.5385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9058 -0.0539 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.1322 -0.9176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3325 -0.0180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8480 1.4015 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.3481 1.3794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7658 -0.4604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8656 0.5597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2989 0.1173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6324 -1.3452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5326 -2.3653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0994 -1.9229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0657 -1.7876 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 9.6469 1.9203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7897 0.9035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9035 0.7897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7897 -0.9035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4463 -2.6670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0016 -1.7948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4908 2.6310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9356 1.7588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0026 -0.7886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5161 -1.0870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5516 -1.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0652 -1.5896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1499 -2.1174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6285 2.3397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5988 1.7296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1787 0.9333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7995 -3.5352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2195 -2.7389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7433 2.7100 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 26 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 18 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 26 44 1 0 0 0 0 M END