IFLAB-ZINC00936129 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -0.6750 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -2.0800 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -2.7640 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -2.1040 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 -0.7330 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4730 -0.3500 0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2600 -1.4380 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -2.5420 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7440 -1.4360 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4420 -2.6380 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8230 -2.6350 0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5170 -1.4440 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8300 -0.2410 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4420 -0.2350 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5350 0.9620 -0.0960 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.8140 1.2490 0.9160 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.2890 2.5510 0.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6340 0.0900 0.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1730 1.3350 2.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7570 2.5480 3.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2550 2.6160 4.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1690 1.4710 5.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5860 0.2570 4.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0930 0.1910 3.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4820 1.5630 6.8870 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 -0.1300 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 -2.6140 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -3.8440 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7930 -3.5710 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9030 -3.5710 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3620 -3.5670 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5970 -1.4470 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9060 0.6990 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2750 1.6280 -0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8240 3.4430 2.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9290 3.5640 4.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5190 -0.6380 5.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4220 -0.7560 2.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 10 34 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 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 M END