MMs02964516 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 1.4558 0.3614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4967 -0.7186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9525 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3674 1.0843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9934 -1.4373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4492 -1.0758 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5973 -2.0412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4912 -3.5374 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8702 -1.2476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2604 -1.8109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4434 -0.8886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3925 0.6106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8026 1.1222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7249 -0.0607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8848 -1.3035 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2240 -0.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0176 -1.2828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5167 -1.2319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2223 0.0918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4287 1.3647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9295 1.3138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1342 2.6884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3406 3.9613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.7214 0.1427 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.5088 0.2082 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.0125 0.3144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2189 1.5872 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2891 1.1646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1646 -0.2891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2891 -1.1646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9688 1.4582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4513 1.0315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9979 -2.1073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4804 -2.5340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4262 -2.9993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3983 1.2826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1345 2.2754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4532 -2.3417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1516 -2.2502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2947 2.3321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6333 2.7392 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.1978 3.7982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 36 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 37 1 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 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 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 42 43 1 0 0 0 0 M END