MMs00637361 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 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 1.2929 0.7605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8909 0.7815 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9302 1.3815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8788 2.2814 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5737 3.0209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5616 4.5209 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2808 2.2604 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2081 -1.4579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5132 -2.1974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8061 -1.4369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 0.0630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4889 0.8025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4768 2.3024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7697 3.0629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0869 0.8235 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 0.0840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5253 -3.6974 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.6101 -1.4789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9152 -2.2184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3172 -2.2394 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0121 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3293 -3.7394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6084 1.0343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5172 -0.3042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6084 -1.0343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9131 2.8898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2368 2.8520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6909 -1.7621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8501 -2.0285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3781 2.0286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8041 3.6713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1613 4.0973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8004 -0.9600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4360 -0.5076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9835 1.1281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6037 -0.4559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5099 -1.2042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5795 -2.5440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1294 -3.7491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 -4.9393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5293 -3.7297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M END