MMs01085463 MOE2007 2D CORINA 3.40 0006 02.08.2006 47 52 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 1.2273 -0.7217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 -0.0163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4741 1.3994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2444 2.1196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0064 1.4265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1077 3.5809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1952 4.7611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1362 6.1441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3089 6.8982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5437 6.2538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6057 4.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4302 4.1221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3131 2.8953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4431 3.2679 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7160 3.5785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5008 4.5843 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5008 5.7843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 4.6441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7381 5.8833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3656 3.2683 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9393 2.5923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9303 1.0924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7479 2.6860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9348 1.1977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3172 0.6154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5126 1.5214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3257 3.0097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9434 3.5920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5212 3.9157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7167 4.8217 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -8.4272 2.7202 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.6152 5.1111 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7203 2.3760 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.0429 -0.5935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2199 -1.9217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4973 -0.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0275 2.0356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7972 4.7400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0709 6.6964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2546 8.0969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5558 6.8985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6687 4.3037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9784 0.4729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4667 -0.5753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6185 1.0555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7939 4.7826 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 35 1 0 0 0 0 2 3 2 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 4 5 2 0 0 0 0 4 14 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 22 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 47 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 33 1 0 0 0 0 M END