PUBCHEM-ZINC03703024 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 1.0910 2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 3.0240 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 3.4550 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0680 2.9670 0.3230 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0210 3.2650 -0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6940 4.0100 -1.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6620 4.3170 -2.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9580 3.8820 -2.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2900 3.1320 -1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3270 2.8170 -0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6560 2.0770 0.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0160 1.6520 0.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0430 4.2020 -3.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4220 4.6470 -4.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2520 5.1220 -3.8720 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7280 4.4750 -4.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3320 6.2340 -3.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 6.2160 -3.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 7.3540 -3.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1800 8.2970 -2.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8490 7.7590 -2.7300 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 9.9620 -1.8920 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 1.5250 2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 0.0040 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 1.3960 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 3.4700 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 3.3560 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7690 4.5440 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 3.0480 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 4.3550 -1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3050 2.7900 -1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1430 1.0720 1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6680 2.5250 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2750 1.0350 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6550 3.3160 -3.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6690 5.0040 -3.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9320 3.7980 -5.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1990 5.0380 -5.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 5.3760 -3.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 7.4700 -3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4290 5.6970 -4.5300 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1700 6.1830 -5.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 45 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 45 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 16 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 46 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 46 47 1 0 0 0 0 M END