CHEMDIV-ZINC04939306 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 1 0 0 0 0 0999 V2000 0.1320 1.1420 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -0.3690 -0.0670 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5900 -0.5810 -1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 -1.0500 1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 -1.8680 1.7320 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 -0.8690 -0.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -0.8200 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 -0.3180 -2.3030 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 -0.2530 -3.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6290 0.2740 -4.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 0.3170 -5.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7000 -0.1560 -5.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2600 -0.6740 -4.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 -0.7330 -3.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0320 -1.2620 -2.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2500 -1.2860 -1.1680 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4180 -1.7780 -2.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9070 -2.5940 -3.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2000 -3.0720 -3.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0110 -2.7440 -2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5320 -1.9350 -1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2400 -1.4550 -1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7190 -0.0760 -7.3430 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 1.5130 0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 1.6340 -0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 1.3540 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6190 -1.2340 0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 0.6440 -4.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 0.7230 -6.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2770 -1.0370 -4.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2750 -2.8510 -4.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5790 -3.7040 -3.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0220 -3.1200 -2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1710 -1.6820 -0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8660 -0.8270 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 -0.7470 1.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6870 -1.2100 1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 16 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 21 2 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 36 37 1 0 0 0 0 M END