MMs02781118 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 41 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 -0.7602 1.2931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2601 1.2813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 -0.0236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2397 -1.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7398 -1.3049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2600 1.2578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7600 1.2460 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5202 2.5391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7804 3.8440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2804 3.8558 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5406 5.1371 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4998 -0.0589 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.1949 -0.7987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8047 0.6809 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2395 -1.3638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4794 -2.6569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2191 -3.9618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7191 -3.9735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4793 -2.6804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7395 -1.3756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4997 -0.0824 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -7.4590 -5.2549 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1684 2.3370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8683 2.3158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8316 -2.3606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1316 -2.3394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2822 -1.2154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6242 -0.4546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1357 1.6770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4777 2.4379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4333 1.7606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4454 3.3032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9487 6.1810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7405 5.1277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2794 -2.6475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3109 -5.0175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6792 -2.6899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 14 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 2 0 0 0 0 11 13 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 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 38 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 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 M END