PUBCHEM-ZINC05386642 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 38 0 0 1 0 0 0 0 0999 V2000 0.0780 1.2450 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -0.1310 -0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 -0.4550 -0.2560 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 -1.6980 -0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3820 -1.7950 -0.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0540 -0.6150 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 0.6650 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 0.7190 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3410 1.7710 -0.0530 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5660 1.5910 0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7260 0.8420 0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4250 -0.5000 0.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3310 -1.6450 0.1300 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7590 -2.5140 -0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0460 -1.9290 1.4920 C 0 0 3 0 0 0 0 0 0 0 0 0 7.0210 -1.0120 2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5120 -2.1790 1.0540 C 0 0 3 0 0 0 0 0 0 0 0 0 8.9910 -3.0550 1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4320 -2.3240 -0.4630 C 0 0 3 0 0 0 0 0 0 0 0 0 8.1200 -3.3400 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3630 -1.4420 -0.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6880 -1.9440 -1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4580 -2.1540 -2.6290 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5820 -1.7550 -2.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3310 -1.0560 1.4110 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8250 -0.2580 1.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5620 -3.0470 2.0160 O 0 5 0 0 0 0 0 0 0 0 0 0 7.4610 1.6020 0.3950 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.4440 3.0080 0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3550 4.1610 0.4550 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 1.8870 -0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6690 -0.8680 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4960 -2.6220 -0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9390 -0.8860 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5440 -2.5550 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 9 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 11 2 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 27 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 25 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 29 30 3 0 0 0 0 M CHG 1 27 -1 M END