CHEMSTAR-ZINC04173751 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 52 0 0 1 0 0 0 0 0999 V2000 0.1430 1.4290 -0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -0.0050 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -0.0200 1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 -0.5300 0.0090 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9020 0.0130 0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5750 -2.0380 0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7810 -2.3960 0.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 -0.2280 -1.2210 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3200 0.5500 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7480 1.3210 -0.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9600 0.1600 -2.5380 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2830 -0.8730 -2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 0.1370 -3.3990 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1420 1.1050 -3.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8320 -0.7090 -2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 -1.5290 -2.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0650 -0.0050 -4.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5500 1.4560 -5.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0490 2.3320 -6.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5630 3.6280 -6.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5710 4.0530 -5.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0960 3.1890 -4.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6030 1.8890 -4.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1090 0.7780 -3.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4510 -0.4250 -4.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3160 -0.8840 -5.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4500 -1.9930 -5.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6840 -2.6400 -5.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7880 -2.1840 -5.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6790 -1.0790 -4.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5670 1.2820 -2.1900 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -0.5260 -5.9370 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 1.8020 -0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 1.4830 -1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 2.1110 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 -0.6490 -0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 0.6240 2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 -1.0240 1.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 0.3450 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2600 2.0430 -6.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 4.3150 -6.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9570 5.0670 -5.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8890 3.5560 -3.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6230 -2.3730 -6.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7870 -3.5070 -6.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7400 -2.7020 -5.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5560 -0.7670 -3.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -2.7300 0.4750 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 48 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 17 32 1 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 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 31 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 29 2 0 0 0 0 28 45 1 0 0 0 0 29 30 1 0 0 0 0 29 46 1 0 0 0 0 30 47 1 0 0 0 0 M CHG 1 48 -1 M END