PUBCHEM-ZINC02189054 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3150 0.0090 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 1.3060 -0.7770 -0.0150 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1330 -0.1020 -0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -1.8430 -1.1120 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0370 -2.5350 -1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -2.5780 -0.9560 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -2.0130 -0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 -2.6650 -0.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 -0.7500 0.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -1.1780 -2.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -0.5920 -2.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 0.0190 -4.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 0.0440 -4.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 -0.5440 -4.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 -1.1490 -3.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6780 -0.5200 -5.2230 N 0 3 0 0 0 0 0 0 0 0 0 0 4.6860 -1.0360 -4.7760 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7020 0.0180 -6.3160 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5260 -1.4370 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 -2.6390 1.3930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 -0.6900 2.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 -1.3930 3.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8960 -0.3830 4.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 0.2670 4.9740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 1.2010 5.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 1.8710 6.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 2.8200 7.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3060 3.1030 7.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5020 2.4370 7.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 1.4820 6.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 1.8680 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8420 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -3.5100 -1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 -0.3620 0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -0.6120 -2.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 0.4760 -4.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2930 -1.6030 -2.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -2.0830 3.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 -1.9510 3.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 -0.9010 5.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 0.3600 4.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 1.6510 5.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7150 3.3420 7.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 3.8450 8.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 2.6600 8.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5460 0.9590 6.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 0.6440 -6.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 1.5830 -6.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 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 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 20 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 43 1 0 0 0 0 28 29 1 0 0 0 0 28 44 1 0 0 0 0 29 30 2 0 0 0 0 29 45 1 0 0 0 0 30 31 1 0 0 0 0 30 46 1 0 0 0 0 31 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END