PUBCHEM-ZINC03121479 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 0.5190 2.6030 0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 1.3640 -0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 0.4910 -0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 0.8600 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 2.1110 0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8030 2.9750 0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7530 -0.0710 -0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5490 -1.1600 -0.8520 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0050 0.2890 -0.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0540 -0.6270 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3140 -0.2620 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3880 -1.2660 0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6950 -0.9080 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6960 -1.8550 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4110 -3.1580 0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1210 -3.5210 0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1100 -2.5840 0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5120 -4.1870 0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1500 -4.2050 1.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6580 -5.0440 2.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2440 -5.0600 3.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3230 -4.2380 4.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8150 -3.3990 3.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2320 -3.3870 1.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1240 -4.2600 5.8880 Br 0 0 0 0 0 0 0 0 0 0 0 0 5.7880 -1.9870 -0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2260 -2.7930 0.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1690 -2.3410 -1.8630 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8200 -3.5870 -2.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1340 -4.0260 -3.5470 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7190 -5.2380 -3.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0220 -5.8540 -2.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9210 -4.7700 -1.5210 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 3.2840 0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 1.0800 -0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -0.4760 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8600 2.4030 0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9800 3.9430 1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1790 1.1830 0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5300 0.7670 0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9180 0.1090 -0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7050 -1.5800 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9070 -4.5400 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1040 -2.8670 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0950 -5.1700 0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2620 -3.9360 -0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8150 -5.6850 2.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8590 -5.7150 4.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6570 -2.7560 3.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6190 -2.7350 1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6860 -1.7260 -2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9270 -5.6950 -4.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5980 -6.8450 -2.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 2 0 0 0 0 29 33 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 31 52 1 0 0 0 0 32 33 1 0 0 0 0 32 53 1 0 0 0 0 M END