PUBCHEM-ZINC03738959 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.6970 -0.0210 -1.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 -0.8550 -0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -0.7010 0.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 -1.7730 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7390 -2.0320 1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1110 -3.1480 2.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -3.9430 2.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 -3.6390 2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -2.5500 1.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9230 -2.1710 1.5970 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9190 -2.8930 2.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 -1.1620 0.6220 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3800 -0.1700 0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0280 -0.9240 1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3250 -1.0000 0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1960 -0.6790 2.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5950 -0.6020 2.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1360 -0.2390 3.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3060 0.0450 4.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9140 -0.0240 4.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3870 -0.3890 3.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0740 -0.5290 2.7350 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2770 -0.3650 3.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6300 -1.3680 -0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3930 -1.1530 -1.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -0.3590 -2.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 -0.0880 -2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 1.0300 -1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 -0.4770 -0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 -1.9010 -0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1580 -3.4100 2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 -4.7980 3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -4.2770 3.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7570 -2.8290 3.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8870 -2.4320 2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9650 -3.9350 1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2540 -0.8200 1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2150 -0.1790 3.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7450 0.3250 5.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2730 0.2000 5.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4650 -0.7720 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9300 -2.4220 -0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1730 -0.0890 -1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5200 -1.6320 -2.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1710 -1.7650 -0.7160 N 0 3 0 0 0 0 0 0 0 0 0 0 3.3270 -2.7700 -0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 -1.6820 -1.3410 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 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 45 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 22 23 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 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 M CHG 1 45 1 M END