PUBCHEM-ZINC06563630 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 35 0 0 0 0 0 0 0 0999 V2000 -0.2720 1.6540 -0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 0.1260 -0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -0.3540 0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 -0.4550 -0.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 -1.9540 -0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 -2.5040 -0.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6490 -2.6850 -0.3540 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 -4.0260 -0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 -4.8010 -0.9340 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7210 -4.7560 -0.2580 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7100 -6.1290 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6670 -6.9080 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6570 -8.2690 -0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6850 -8.8690 -0.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7280 -8.1110 -1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7550 -6.7330 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8700 -5.9170 -1.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8400 -4.7080 -1.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6550 -10.7350 -1.2490 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 2.0690 -0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 1.9970 -1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 1.9870 0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -0.2060 -1.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 -0.0210 1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -1.4420 0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 0.0600 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 -0.1960 0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3120 -0.0430 -1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4750 -2.2450 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5280 -4.3250 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 -6.4490 0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -8.8710 0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5260 -8.5830 -1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9220 -6.5130 -2.3130 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6290 -5.9370 -2.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 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 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 34 35 1 0 0 0 0 M END