PUBCHEM-ZINC05587356 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 34 0 0 0 0 0 0 0 0999 V2000 0.1320 1.4720 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 -0.0270 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 -0.7580 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 -2.4500 0.6930 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 -2.0160 -0.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -0.7390 -1.0880 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 -2.9880 -2.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 -0.2330 2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -0.9660 3.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -0.2840 4.7790 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 1.0060 4.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 1.4610 2.9800 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 1.8850 5.7480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 2.8420 5.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 1.3930 7.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 2.1380 8.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 1.6500 9.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 0.4190 9.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 -0.3260 8.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 0.1600 7.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -0.2470 11.4040 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 1.9400 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 1.7800 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 1.7800 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 -3.3290 -2.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 -2.4950 -2.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -3.8420 -1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -2.0400 3.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 3.0990 7.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 2.2290 10.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 -1.2860 8.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 -0.4200 6.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 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 29 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 20 32 1 0 0 0 0 M END