IFLAB-ZINC05258474 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 41 0 0 1 0 0 0 0 0999 V2000 -0.0240 1.1050 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 3.0460 1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4670 3.5010 2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 5.0300 2.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2440 6.9320 3.8630 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3280 7.3510 3.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3760 7.3580 5.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 6.9590 6.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 6.3900 5.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 7.2340 7.3960 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 6.7820 8.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 6.7180 7.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 6.2710 8.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2810 5.8860 9.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 5.9470 10.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 6.4000 9.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7490 6.4910 10.2820 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.4300 7.4380 3.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1580 6.6580 2.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 0.0150 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 1.4760 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.4720 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 3.4270 0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 3.4310 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4870 3.1160 2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 3.1200 3.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 5.4150 2.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 5.4110 1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5030 8.4390 5.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2440 6.8680 5.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7190 7.7460 7.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 7.0180 6.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3950 6.2220 7.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1390 5.5360 10.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 5.6450 11.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 1.5780 1.1990 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 1.1950 1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1940 5.4660 3.7820 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1200 5.0700 3.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6760 8.7560 3.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4480 9.0330 2.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 18 1 0 0 0 0 5 38 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 31 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 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 36 37 1 0 0 0 0 38 39 1 0 0 0 0 40 41 1 0 0 0 0 M END