CHEMBRIDGE-ZINC01193960 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 0.0060 1.4570 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 0.0050 -0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 -0.5920 -1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 0.0760 -1.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -2.0960 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -3.9610 -2.4610 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5580 -4.3960 -1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -4.4780 -3.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 -5.6410 -2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5630 -6.1160 -3.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1410 -5.4280 -4.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5590 -4.2640 -4.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 -3.7870 -4.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 -4.3440 -3.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1890 -3.4200 -4.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2740 -3.7710 -4.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8010 -5.0480 -4.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2450 -5.9760 -4.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1580 -5.6250 -3.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5960 -6.5610 -2.3580 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5540 -7.8640 -2.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0760 -8.2370 -3.7340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 -8.8380 -1.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8260 -10.1880 -2.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -11.0920 -1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -10.6640 -0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -9.3280 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -8.4140 -0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0380 -2.5030 -6.1330 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 1.8300 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 1.8220 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 1.8100 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -2.4870 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -2.4940 -1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -6.1790 -1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0170 -7.0250 -2.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0470 -5.7990 -4.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0110 -3.7270 -5.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -2.8760 -4.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7790 -2.4220 -4.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6490 -5.3190 -5.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6560 -6.9730 -3.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 -6.2730 -1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 -10.5230 -3.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -12.1370 -1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -11.3770 0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 -9.0000 1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3110 -7.3720 -0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 -2.4980 -2.3510 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 -2.0940 -3.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 49 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 6 49 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 49 50 1 0 0 0 0 M END