PUBCHEM-ZINC06233226 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 0 0 0 0 0 0999 V2000 0.1680 1.1790 -0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -0.3500 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 -0.7870 -0.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 -2.1170 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -2.8900 -0.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8620 -2.6300 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6810 -2.9160 1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4610 -2.8090 2.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4640 -3.1690 3.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6840 -3.6350 2.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9070 -3.7430 1.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9100 -3.3850 0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8540 -3.3880 -0.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6670 -2.9440 -1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2790 -2.8160 -2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1800 -3.1650 -3.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8090 -3.0420 -4.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 -2.5740 -5.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6520 -2.2260 -4.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 -2.3380 -2.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2520 -3.0640 4.8220 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4060 -2.3730 5.7880 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.6270 -3.0360 5.4910 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8520 -2.3140 7.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6020 -0.7060 5.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6010 -0.3810 4.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7550 0.9270 3.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9110 1.9120 4.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9120 1.5860 5.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7610 0.2790 5.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1210 3.7010 3.8440 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 1.5060 -0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 1.5380 -1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 1.5800 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -0.7520 -0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 -0.7100 0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5130 -2.4480 2.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4630 -3.9140 3.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8570 -4.1060 1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1630 -3.5300 -3.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5050 -3.3110 -5.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 -2.4800 -6.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 -1.8630 -4.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3100 -2.0620 -2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2600 -1.1500 3.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5350 1.1810 3.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2520 2.3540 5.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9840 0.0250 6.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4280 -3.3970 5.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 14 2 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 47 1 0 0 0 0 30 48 1 0 0 0 0 M END