PUBCHEM-ZINC06282511 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 -0.7960 1.7620 -5.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 0.3370 -6.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -0.3380 -5.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 0.3710 -4.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 -0.2770 -3.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 -1.6800 -3.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 -2.3980 -4.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -1.7020 -5.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 -3.8050 -4.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -4.4190 -3.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 -3.6520 -2.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5090 -4.2770 -1.8240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5810 -2.3390 -2.6570 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4190 -4.3390 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 -5.9210 -3.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 -6.4940 -4.4710 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 -6.5770 -5.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 -7.8590 -6.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 -7.9460 -7.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1010 -9.1440 -7.9760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 -7.0460 -3.8740 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 -7.9970 -4.8130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 -7.3510 -2.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 -5.6950 -3.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 -5.4740 -5.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2190 -4.4140 -5.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3240 -3.5740 -3.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5410 -3.7960 -2.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6580 -4.8590 -2.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5370 -2.1240 -3.9890 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 2.0470 -4.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 2.1500 -6.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 2.1750 -6.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 1.4490 -4.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 0.2860 -2.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -2.2420 -5.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -4.3810 -5.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0180 -6.2060 -3.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8510 -6.2970 -2.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -6.5890 -6.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8910 -5.7140 -6.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0210 -7.8480 -5.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 -8.7230 -5.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4320 -7.9580 -8.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9630 -7.0830 -8.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3210 -9.2650 -8.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 -6.1300 -5.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8300 -4.2420 -5.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6220 -3.1400 -1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 -5.0340 -1.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 13 2 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 M END