CHEMDIV-ZINC04151215 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.6820 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0230 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 1.4150 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 2.1350 -0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2790 2.5370 1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3830 3.2010 0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3810 3.2140 -0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2670 2.5460 -1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8620 2.3100 -2.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7020 2.6940 -3.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3190 2.4710 -4.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1030 1.8680 -5.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 1.4850 -4.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6400 1.6970 -2.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5850 1.5670 -6.9600 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.8800 2.2850 2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 3.4940 3.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7130 3.2420 4.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0130 2.2010 5.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 -0.6430 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5550 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7620 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 3.1690 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1330 3.6420 1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1270 3.6670 -1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6510 3.1650 -3.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9680 2.7680 -5.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 1.0150 -4.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 1.3930 -2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2460 1.4000 2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7740 2.1250 3.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7470 4.3790 3.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 3.6540 2.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9190 -0.8310 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 4.1730 5.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7920 3.9660 6.0780 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 23 38 1 0 0 0 0 39 40 1 0 0 0 0 M END