PUBCHEM-ZINC01057753 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 1 0 0 0 0 0999 V2000 -1.8390 0.3500 -1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 -0.7170 -0.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 -0.8460 0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -1.8260 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 -2.6770 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 -2.5520 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -1.5670 -1.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 -3.6130 -2.2350 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 -5.1460 -2.0080 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4570 -4.9470 -1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -5.7420 -3.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 -4.9700 -4.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7610 -4.1620 -3.5140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 -5.2280 -5.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0520 -4.3370 -6.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2870 -4.5410 -7.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7170 -5.6390 -8.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -6.5350 -7.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6840 -6.3310 -6.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 -5.9190 -10.0980 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.3810 -6.0890 -1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 -5.9900 0.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2780 1.2640 -1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3570 0.0280 -2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6070 0.5760 -0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 -0.1870 1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 -1.9300 2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 -3.4450 0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 -1.4710 -2.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 -5.8000 -4.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 -6.7610 -3.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5010 -3.4770 -5.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9120 -3.8390 -8.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 -7.3960 -8.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -7.0530 -5.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 -6.8840 -1.9210 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 21 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 14 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 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 M CHG 1 36 -1 M END