PUBCHEM-ZINC03760121 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 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 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -1.8240 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 -2.3530 2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 -3.7220 2.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -4.5660 1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -4.0410 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -2.6730 0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -6.0590 1.7640 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3550 -6.2960 2.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 -6.5700 0.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5020 -6.8400 1.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5300 -7.3080 0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3220 -7.5070 -0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0850 -7.2360 -1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -6.7730 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7290 -8.1470 -1.7850 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -6.1560 2.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5550 -6.7360 1.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5200 -8.2620 1.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -8.7980 0.9400 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4000 -8.5510 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -8.1580 1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2290 -10.2950 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 -10.7990 1.6110 O 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 1.8880 -1.6940 3.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 -4.1340 3.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -4.7020 -0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -2.2640 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 -6.6840 2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4960 -7.5190 1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 -7.3910 -2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -6.5660 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 -5.0700 2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 -6.4250 3.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3940 -6.3460 2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6700 -6.4570 0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4440 -8.5430 2.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4310 -8.6830 1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -8.4170 2.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 -8.5270 0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -6.6990 1.3630 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2420 -11.0670 0.6800 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1480 -12.0220 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 48 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 49 50 1 0 0 0 0 M END