MMs02725701 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 53 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 0.7519 -1.2979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2519 -1.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2519 -1.2913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5038 -2.5914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0038 -2.5937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2557 -3.8894 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 6.7519 -1.2891 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 0.0110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 0.0133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7519 -1.2847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7481 1.3134 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2481 1.3156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0000 0.0177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5000 0.0199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2481 1.3200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4962 2.6180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9962 2.6157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7481 1.3222 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.7459 2.8222 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7503 -0.1778 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2481 1.3244 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.1315 0.1122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5574 0.5778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5552 2.0778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1280 2.5393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0383 0.6015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6015 1.0383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0383 -0.6015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3751 -1.7100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 -2.4794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3985 1.0428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0985 1.0467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4054 -3.6338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3718 0.4198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7066 1.1931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1465 2.3517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4015 -1.0224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1015 -1.0185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0946 3.6581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3946 3.6541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0932 -0.4893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6212 -0.9833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8087 -0.5956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7507 0.7050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7488 1.9542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8030 3.2520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0878 3.1377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6144 3.6362 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 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 36 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 M END