PUBCHEM-ZINC06445315 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 52 0 0 0 0 0 0 0 0999 V2000 1.2430 1.0300 -2.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -0.3040 -2.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 -0.7000 -1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6620 0.6770 -0.4520 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 1.7280 -1.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 -2.0680 -0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 -2.9360 -1.2450 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 -4.3010 -1.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 -5.0770 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 -4.6400 1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6340 -5.6780 1.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4770 -5.4260 2.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9830 -4.1520 3.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 -3.1090 2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8050 -3.3370 1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 -2.2220 0.5290 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9460 -6.8320 4.1430 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -6.4890 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -6.8470 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -8.1640 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -9.1530 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 -8.8030 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 -7.4890 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 -11.3620 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -12.8250 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 -13.0660 -1.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5050 -12.2350 -1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 -10.7660 -1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 1.4800 -3.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 -0.9800 -2.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 2.7810 -1.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -4.7470 -1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 -6.6720 1.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6400 -3.9750 4.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0540 -2.1210 2.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1090 -6.0820 0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7510 -8.4400 0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 -9.5730 -0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0170 -7.2180 -0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 -11.1590 0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 -11.1690 -1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4880 -13.4740 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -13.0320 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1860 -12.4580 -1.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -12.4240 -0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 -10.5630 -2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 -10.1280 -0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -10.4910 -0.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 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 6 1 0 0 0 0 4 5 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 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 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 M END