CHEMSTAR-ZINC04065170 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.7490 2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -1.2050 3.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0710 -1.4200 3.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7710 -1.1710 2.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0970 -0.7190 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -1.9080 4.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 -2.1380 5.7590 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 -2.6020 6.8940 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 -2.8410 8.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 -2.6540 8.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8380 -3.3260 9.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 -3.6070 10.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 -4.0590 11.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3870 -4.4780 12.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5800 -4.8480 13.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7480 -4.8090 12.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7250 -4.3990 11.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5200 -4.0180 10.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1910 -3.5800 9.2980 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8200 -3.4650 8.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6430 -5.4140 15.0150 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -3.4780 10.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -4.2860 10.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -4.1600 10.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -3.2350 11.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 -2.4310 12.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -2.5510 11.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2720 -2.1390 4.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -0.5820 2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -1.3960 4.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8380 -1.3340 2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6360 -0.5300 0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7660 -2.7500 6.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4830 -4.5100 13.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6840 -5.1040 12.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6390 -4.3720 10.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -5.0080 9.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1950 -4.7850 10.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8990 -3.1400 11.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2310 -1.7100 12.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -1.9260 12.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7920 -1.2240 4.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5400 -2.9400 5.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5610 -2.4180 3.5960 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 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 22 23 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 47 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 30 49 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 M END