PUBCHEM-ZINC06068956 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 0.5050 1.1560 0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -0.3220 0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -1.2050 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 -2.4790 0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -3.7340 1.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -4.8430 0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 -4.7050 -0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 -3.4710 -1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 -2.3560 -0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -1.0350 -0.9370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 -0.5440 -2.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -1.1600 -3.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 0.6370 -2.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 1.6100 -3.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 2.7090 -3.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5720 2.8200 -3.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1690 1.8400 -2.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 0.7350 -2.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4980 4.1730 -4.0370 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 -5.9930 1.2450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 -7.1540 0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2630 -0.8930 2.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 -0.7690 3.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 -1.7280 3.9670 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6210 0.5000 3.3980 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 0.8790 3.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2300 2.3700 3.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 2.9970 3.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5650 1.4020 0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 1.6870 -0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 1.5570 1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4930 -3.8410 2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 -5.5420 -1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 -3.3950 -2.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 1.5150 -3.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 3.4680 -4.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2140 1.9250 -2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 -0.0360 -1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5300 -7.9750 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 -7.0090 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 -7.4420 -0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 -1.6910 3.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 0.0250 2.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1350 1.2860 2.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6840 0.2540 3.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 0.6700 5.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3370 2.7770 4.1470 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 22 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 32 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 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 18 2 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 20 21 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 47 1 0 0 0 0 M CHG 1 47 -1 M END