CHEMBRIDGE-ZINC04978008 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 0.2510 1.3810 0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -0.1220 0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -0.6010 -0.8750 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -1.9430 -1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -2.7360 -0.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 -2.3360 -2.3220 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4580 -1.9560 -2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 -1.7420 -3.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 -2.2330 -4.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 -3.7530 -4.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 -3.8600 -2.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 -5.7960 -3.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3220 -6.2910 -4.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8200 -7.1340 -5.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6700 -7.6140 -6.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0250 -7.2670 -6.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5290 -6.4340 -5.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6870 -5.9500 -4.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3740 -4.9080 -3.6160 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.1300 -8.4850 -7.8510 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9080 -8.6900 -7.8500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9250 -8.9570 -8.6740 O 0 5 0 0 0 0 0 0 0 0 0 0 1.3140 1.6350 0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 1.8630 -0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 1.7940 1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 -0.5940 1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -0.3610 0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 -2.0100 -3.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 -0.6460 -3.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -1.8460 -5.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 -1.8290 -4.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -4.1940 -4.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 -4.0680 -5.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0510 -4.2730 -1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 -4.3160 -2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 -6.2330 -3.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 -6.1010 -2.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7670 -7.4150 -5.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6980 -7.6300 -7.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5830 -6.1640 -5.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 -4.2880 -3.6720 N 0 3 0 0 0 0 0 0 0 0 0 0 3.1520 -3.8900 -3.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 41 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 41 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 38 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M CHG 1 41 1 M END