PUBCHEM-ZINC04576991 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 47 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8350 -1.5960 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -0.1240 2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -0.7270 3.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6210 -1.4010 3.5810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -0.5180 4.9350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -1.1050 6.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.7240 7.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0170 -0.0300 7.2560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 -1.1530 8.5590 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 -0.7820 9.7620 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4300 -0.7400 9.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -1.8250 10.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 -3.1500 10.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -4.0440 9.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 -5.2600 9.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7470 -5.5800 9.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5320 -4.6860 10.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 -3.4730 10.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 0.5680 10.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 1.1600 9.6470 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 0.2970 1.3120 Br 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 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 0.9620 2.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 -0.4970 2.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 0.0200 5.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -2.1900 6.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7670 -0.7320 6.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -1.7080 8.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 -1.9310 11.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 -1.5040 11.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 -3.7940 9.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -5.9580 8.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1580 -6.5290 9.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5550 -4.9370 10.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6170 -2.7760 11.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4570 1.1140 11.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 1.9820 11.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 25 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 23 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 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 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 46 47 1 0 0 0 0 M END