CHEMDIV-ZINC04794059 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 0.1290 2.5100 -0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 1.0260 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 0.5320 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 -0.8290 1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 -1.7020 0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -1.2140 -0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 0.1530 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 0.6500 -2.4540 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 0.1070 -3.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 0.8100 -4.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 0.6950 -5.2400 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2840 1.0930 -4.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 0.3790 -3.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 0.2390 -6.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 0.0000 -7.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4910 0.0260 -7.1520 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1920 0.7770 -6.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 -1.3490 -6.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0330 -1.4940 -5.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5020 -2.7550 -5.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9400 -3.8710 -6.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 -3.7260 -7.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 -2.4640 -7.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 0.1450 -8.6060 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5860 0.8090 -9.4970 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.1440 0.8150 -10.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7820 0.1680 -9.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7280 2.4980 -9.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 3.5160 -9.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3470 4.7570 -9.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2210 4.7460 -8.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7570 3.0980 -7.7200 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7990 6.2710 -7.0590 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 -3.4100 0.6450 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 2.7890 -0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 2.7670 -1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 3.0460 0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 1.2110 2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -1.2120 2.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -1.8960 -1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 0.2760 -2.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -0.9630 -3.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 1.8610 -4.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.3330 -5.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 2.1720 -4.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1670 0.8030 -5.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 -0.6950 -3.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 0.7450 -2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4720 -0.6220 -5.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3070 -2.8680 -4.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3060 -4.8560 -5.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4710 -4.5970 -7.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 -2.3510 -8.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -0.1640 -9.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 3.3820 -10.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8870 5.6650 -9.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 47 1 0 0 0 0 13 48 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 24 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 2 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 28 29 2 0 0 0 0 28 32 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 2 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 M END