ASINEX-ZINC04559964 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 -0.0250 1.3850 0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.1370 -0.0080 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6210 -0.4860 -0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -0.7100 1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -1.2360 2.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 -0.6190 1.4160 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6750 -1.0820 2.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7670 -2.1230 2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 -1.1100 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0180 -0.0960 0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9170 -2.5240 1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 -0.6490 -0.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 -0.7120 -1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -0.2890 -2.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1630 -0.3950 -3.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4510 -0.9230 -3.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0030 -1.3480 -2.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2540 -1.2410 -1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9920 -1.7780 0.1800 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.3640 -1.0460 -5.1240 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 1.8270 0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 1.8370 -0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 1.6830 0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1030 -0.2010 3.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 -1.5030 3.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2980 -2.3740 3.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 -3.0320 1.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7350 -2.0080 -0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9120 -0.6620 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5320 0.1800 -0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4460 0.8200 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5090 -3.4250 0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3820 -2.7570 2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6430 -2.0370 0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4210 0.1380 -2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7300 -0.0600 -4.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0100 -1.7570 -2.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7930 -1.5580 1.4310 N 0 3 0 0 0 0 0 0 0 0 0 0 5.2110 -0.7270 1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 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 10 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 9 38 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 11 38 1 0 0 0 0 12 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 20 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 38 1 M END