CHEMDIV-ZINC04732211 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 0 0 0 0 0 0999 V2000 -6.6500 1.7230 -3.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1940 0.2830 -3.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2800 -0.1500 -2.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0920 0.5820 -1.8030 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6710 -1.3520 -2.8070 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6840 -2.2470 -3.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8600 -3.4730 -3.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4300 -3.1670 -2.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9300 -1.9240 -1.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 -1.4200 -0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8950 -2.1500 0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3970 -3.3880 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 -3.8990 -1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -4.3870 1.2500 Br 0 0 0 0 0 0 0 0 0 0 0 0 -4.2850 0.1560 -0.0220 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 1.1190 -0.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7010 0.0460 -0.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8570 0.4000 1.5600 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 0.4370 1.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5510 0.8500 1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 0.8860 1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 0.5090 2.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 0.0960 3.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 0.0640 3.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0500 -0.3360 4.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5790 -0.7040 5.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7640 -1.1220 6.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 1.2910 0.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 1.1960 0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 1.6930 -0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2400 2.0670 -4.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2590 1.7630 -2.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7780 2.3650 -3.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0640 -0.3730 -3.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6600 0.2270 -4.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7050 -2.5420 -4.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2190 -1.7610 -4.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4760 -4.3720 -3.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9890 -3.5900 -4.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6860 -1.7540 1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2850 -4.8650 -1.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5430 0.5180 2.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8510 1.1440 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 0.5370 2.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 -0.1970 4.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8810 -1.5370 5.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 0.1460 5.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4050 -1.4030 7.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4620 -0.2900 6.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2700 -1.9730 5.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 1.8090 1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3320 0.1580 1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8270 1.0810 -1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 2.7320 -0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0340 1.6210 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 41 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 42 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 43 1 0 0 0 0 21 22 1 0 0 0 0 21 28 1 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 M END