PUBCHEM-ZINC01073762 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -0.0140 0.4490 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 0.6300 2.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 1.5620 3.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0590 1.7110 3.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7740 1.3680 2.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1680 1.5400 2.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7810 2.0540 3.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 2.3710 4.7970 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 2.2180 4.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 2.5860 6.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3230 2.3070 7.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 2.7540 8.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 3.3950 7.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 3.4510 6.0040 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.1240 2.2260 3.7730 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6830 2.7540 4.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1780 2.8740 4.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7860 2.4950 3.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1570 2.6050 3.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9200 3.0950 4.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3120 3.4740 5.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9410 3.3590 5.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1100 3.8710 7.4930 Br 0 0 0 0 0 0 0 0 0 0 0 0 -4.9550 1.1960 1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5790 0.9220 0.5330 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 0.8090 1.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 -0.6330 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 0.7100 0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 0.8000 -0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 0.6650 2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4090 -0.3900 2.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 1.1440 4.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 2.5390 3.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2300 1.7750 7.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6050 2.5990 9.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 3.8110 8.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4540 2.0850 5.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2570 3.7370 5.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1910 2.1130 2.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6330 2.3090 2.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9910 3.1820 4.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9080 3.8580 6.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2840 -0.2680 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5650 1.2700 0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 1.0820 1.3500 N 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 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 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 24 25 3 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 M END