CHEMDIV-ZINC04077091 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 0.2360 1.3890 -0.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 0.0070 -0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -0.6840 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1550 0.0140 0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 1.4000 0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 2.0890 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.4900 0.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 4.1480 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 3.5300 -0.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 5.6510 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4790 6.1420 -0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4910 7.6720 -0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 8.1010 -1.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 7.6120 -1.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 6.0830 -1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2350 9.1150 -2.6200 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 8.9010 -3.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 8.9600 -2.6070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 10.7650 -2.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 11.4580 -2.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 12.7390 -1.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 13.0850 -1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9960 11.7500 -1.1200 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 14.7580 -0.2990 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.1050 -0.6470 1.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8630 -2.0330 1.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 -2.6980 0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -2.0460 -0.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 1.9240 -1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 -0.5350 -1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.9440 1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9860 3.9860 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 6.0800 0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9510 5.7330 -1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 5.8140 0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5110 8.0230 -0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 8.0840 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 7.9230 -2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 8.0190 -0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7530 5.7130 -1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 5.6740 -2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 11.0510 -2.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 13.4080 -1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7800 -2.5060 2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 -2.1320 2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1800 -2.5930 -0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 -3.7550 0.5640 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 M END