MMs01235198 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 51 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 0.4525 -1.4301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9172 -1.7534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3697 -3.1835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8345 -3.5067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8468 -2.3998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3943 -0.9697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9295 -0.6464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3115 -2.7230 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0009 -1.5639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4340 -1.7280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7272 -2.4880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4039 -3.9528 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9110 -4.0980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1510 -5.3912 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4441 -6.1512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8578 -4.6312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3909 -6.6844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1308 -7.9892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3708 -9.2824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8708 -9.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1309 -7.9660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8910 -6.6728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1022 -1.8885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3088 -2.7796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6838 -2.1801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8522 -0.6896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6455 0.2015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2705 -0.3980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2272 -0.0901 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.1441 0.3620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 1.1441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1441 -0.3620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5599 -4.0690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1964 -4.6508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2041 -0.0841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5676 0.4977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5484 -0.9181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1468 -0.7627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3308 -7.9985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9627 -10.3262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2628 -10.3053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 -7.9567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2990 -5.6289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1742 -3.9720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6492 -2.8930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7802 1.3939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3052 0.3148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 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 9 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 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 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 M END