PUBCHEM-ZINC06497787 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 1.8170 -5.4300 0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 -4.6650 -0.2310 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 -3.2570 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -2.5530 -1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -4.3050 -0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -4.6270 -2.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -4.5160 -2.8370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 -4.7990 -4.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5650 -2.4700 0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 -0.9660 0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 -0.1590 0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 1.1290 0.5480 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.8430 2.2790 0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2610 3.4610 0.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0170 3.4310 1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 2.2710 1.5120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 1.1320 1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6010 -0.1740 1.2740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 -0.4800 1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1590 -0.7170 -0.5510 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.8760 -5.1800 0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -5.2000 1.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 -6.4920 0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -3.0560 1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 -2.8850 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -1.4760 -0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 -2.8910 -2.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 -4.5430 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 -4.8970 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6930 -5.6430 -2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9490 -3.9260 -3.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -5.8180 -4.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 -4.1010 -4.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 -4.6930 -4.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -2.8680 1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5540 -2.8600 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8080 2.2750 -0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7590 4.4010 0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 4.3500 1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1940 -2.8760 -0.7270 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 20 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 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 M CHG 1 12 1 M END